*HEADER    IMMUNE SYSTEM                           09-APR-01   1IEH              
*TITLE     SOLUTION STRUCTURE OF A SOLUBLE SINGLE-DOMAIN ANTIBODY WITH           
*TITLE    2 HYDROPHOBIC RESIDUES TYPICAL OF A VL/VH INTERFACE                    
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: BRUC.D4.4;                                                 
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: SINGLE DOMAIN ANTIBODY FROM A NAIVE LLAMA                  
*COMPND   5 LIBRARY;                                                             
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: LAMA GLAMA;                                     
*SOURCE   3 ORGANISM_COMMON: LLAMA;                                              
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA                                   
*KEYWDS    TWO PLEATED BETA-SHEET,  IMMUNOGLOBULIN BETA-BARREL                   
*EXPDTA    NMR, 10 STRUCTURES                                                    
*AUTHOR    W.VRANKEN, D.TOLKATCHEV, P.XU, J.TANHA, Z.CHEN, S.NARANG,             
*AUTHOR   2 F.NI                                                                 
*REVDAT   1   07-AUG-02 1IEH    0                                                
 ASSI {    3}
   (( segid "    " and resid 47   and name HE1 ))
   (( segid "    " and resid 50   and name HA  ))
      4.100     2.100     1.900 peak     3 weight  0.10000E+01 volume  0.24910E-03 ppm1     10.408 ppm2      5.542 CV     1
 ASSI {    5}
   (( segid "    " and resid 47   and name HE1 ))
   (( segid "    " and resid 50   and name HB  ))
      4.700     2.700     1.300 peak     5 weight  0.10000E+01 volume  0.17577E-03 ppm1     10.404 ppm2      4.125 CV     1
 ASSI {    8}
   (( segid "    " and resid 47   and name HE1 ))
   (  segid "    " and resid 35   and name HB% )
      3.200     1.300     1.300 peak     8 weight  0.10000E+01 volume  0.10558E-02 ppm1     10.404 ppm2      1.462 CV     1
 ASSI {    9}
   (( segid "    " and resid 47   and name HE1 ))
   (  segid "    " and resid 50   and name HG2%)
      4.000     2.000     2.000 peak     9 weight  0.10000E+01 volume  0.30502E-03 ppm1     10.402 ppm2      1.194 CV     1
 ASSI {   14}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 16   and name HN  ))
      2.800     1.000     1.000 peak    14 weight  0.10000E+01 volume  0.13962E-02 ppm1      9.772 ppm2      8.425 CV     1
 ASSI {   18}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 14   and name HA  ))
      2.300     0.700     0.700 peak    18 weight  0.10000E+01 volume  0.41879E-02 ppm1      9.770 ppm2      3.866 CV     1
 ASSI {   21}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 14   and name HB1 ))
      3.700     1.700     1.700 peak    21 weight  0.10000E+01 volume  0.10070E-02 ppm1      9.770 ppm2      2.207 CV     1
 OR {   21}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 14   and name HG2 ))
 ASSI {   23}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 14   and name HG1 ))
      5.100     3.300     0.900 peak    23 weight  0.10000E+01 volume  0.20243E-03 ppm1      9.773 ppm2      1.708 CV     1
 ASSI {   24}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 86   and name HB2 ))
      3.100     1.200     1.200 peak    24 weight  0.10000E+01 volume  0.98015E-03 ppm1      9.770 ppm2      1.416 CV     1
 ASSI {   25}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 86   and name HB1 ))
      3.900     1.900     1.900 peak    25 weight  0.10000E+01 volume  0.40329E-03 ppm1      9.770 ppm2      1.267 CV     1
 OR {   25}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 86   and name HG  ))
 ASSI {   26}
   (( segid "    " and resid 15   and name HN  ))
   (  segid "    " and resid 12   and name HG2%)
      4.800     2.800     1.200 peak    26 weight  0.10000E+01 volume  0.19516E-03 ppm1      9.772 ppm2      0.733 CV     1
 ASSI {   28}
   (( segid "    " and resid 15   and name HN  ))
   (  segid "    " and resid 115  and name HG1%)
      4.200     2.200     1.800 peak    28 weight  0.10000E+01 volume  0.34265E-03 ppm1      9.772 ppm2      0.584 CV     1
 ASSI {   29}
   (( segid "    " and resid 15   and name HN  ))
   (  segid "    " and resid 115  and name HG2%)
      3.600     1.600     1.600 peak    29 weight  0.10000E+01 volume  0.77392E-03 ppm1      9.771 ppm2      0.406 CV     1
 ASSI {   35}
   (( segid "    " and resid 107  and name HE1 ))
   (  segid "    " and resid 45   and name HD2%)
      3.400     1.400     1.400 peak    35 weight  0.10000E+01 volume  0.32016E-03 ppm1      9.688 ppm2      0.338 CV     1
 OR {   35}
   (( segid "    " and resid 107  and name HE1 ))
   (  segid "    " and resid 45   and name HD1%)
 ASSI {   36}
   (( segid "    " and resid 107  and name HE1 ))
   (  segid "    " and resid 4    and name HD1%)
      6.000     5.200     0.000 peak    36 weight  0.10000E+01 volume  0.18937E-04 ppm1      9.688 ppm2      0.688 CV     1
 ASSI {   38}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 43   and name HN  ))
      4.800     2.900     1.200 peak    38 weight  0.10000E+01 volume  0.79733E-04 ppm1      9.538 ppm2      7.936 CV     1
 ASSI {   39}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 45   and name HA  ))
      4.400     2.400     1.600 peak    39 weight  0.10000E+01 volume  0.44686E-03 ppm1      9.532 ppm2      4.208 CV     1
 ASSI {   40}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 41   and name HD1 ))
      4.500     2.500     1.500 peak    40 weight  0.10000E+01 volume  0.22560E-03 ppm1      9.529 ppm2      3.640 CV     1
 ASSI {   41}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 41   and name HD2 ))
      4.000     2.000     2.000 peak    41 weight  0.10000E+01 volume  0.25213E-03 ppm1      9.532 ppm2      3.809 CV     1
 ASSI {   42}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 39   and name HG2 ))
      2.800     1.000     1.000 peak    42 weight  0.10000E+01 volume  0.29725E-02 ppm1      9.531 ppm2      2.170 CV     1
 OR {   42}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 39   and name HG1 ))
 ASSI {   44}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 39   and name HB2 ))
      3.600     1.600     1.600 peak    44 weight  0.10000E+01 volume  0.13925E-02 ppm1      9.529 ppm2      1.748 CV     1
 ASSI {   47}
   (( segid "    " and resid 40   and name HN  ))
   (  segid "    " and resid 92   and name HB% )
      3.800     1.800     1.800 peak    47 weight  0.10000E+01 volume  0.41157E-03 ppm1      9.530 ppm2      1.101 CV     1
 ASSI {   49}
   (( segid "    " and resid 40   and name HN  ))
   (  segid "    " and resid 45   and name HD1%)
      5.600     3.900     0.400 peak    49 weight  0.10000E+01 volume  0.12527E-03 ppm1      9.531 ppm2      0.318 CV     1
 OR {   49}
   (( segid "    " and resid 40   and name HN  ))
   (  segid "    " and resid 45   and name HD2%)
 ASSI {   52}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 6    and name HN  ))
      4.700     2.800     1.300 peak    52 weight  0.10000E+01 volume  0.23984E-03 ppm1      9.522 ppm2      8.582 CV     1
 ASSI {   55}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 6    and name HA  ))
      2.400     0.700     0.700 peak    55 weight  0.10000E+01 volume  0.37564E-02 ppm1      9.523 ppm2      5.748 CV     1
 ASSI {   56}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 22   and name HA  ))
      3.500     1.500     1.500 peak    56 weight  0.10000E+01 volume  0.89479E-03 ppm1      9.520 ppm2      5.350 CV     1
 ASSI {   59}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 22   and name HB2 ))
      5.000     3.100     1.000 peak    59 weight  0.10000E+01 volume  0.14460E-03 ppm1      9.521 ppm2      2.969 CV     1
 OR {   59}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 22   and name HB1 ))
 ASSI {   61}
   (( segid "    " and resid 7    and name HN  ))
   (  segid "    " and resid 6    and name HB% )
      3.100     1.200     1.200 peak    61 weight  0.10000E+01 volume  0.17879E-02 ppm1      9.523 ppm2      1.766 CV     1
 ASSI {   63}
   (( segid "    " and resid 7    and name HN  ))
   (  segid "    " and resid 111  and name HG2%)
      3.500     1.500     1.500 peak    63 weight  0.10000E+01 volume  0.70112E-03 ppm1      9.523 ppm2      1.056 CV     1
 ASSI {   65}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 36   and name HN  ))
      4.500     2.600     1.500 peak    65 weight  0.10000E+01 volume  0.24567E-03 ppm1      9.519 ppm2      8.779 CV     1
 ASSI {   67}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 36   and name HE3 ))
      3.700     1.700     1.700 peak    67 weight  0.10000E+01 volume  0.37575E-03 ppm1      9.519 ppm2      7.666 CV     1
 ASSI {   70}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 36   and name HA  ))
      2.300     0.700     0.700 peak    70 weight  0.10000E+01 volume  0.42420E-02 ppm1      9.523 ppm2      5.473 CV     1
 ASSI {   74}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 36   and name HB1 ))
      3.500     1.500     1.500 peak    74 weight  0.10000E+01 volume  0.57985E-03 ppm1      9.524 ppm2      2.784 CV     1
 ASSI {   75}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 95   and name HB1 ))
      5.000     3.100     1.000 peak    75 weight  0.10000E+01 volume  0.18030E-03 ppm1      9.522 ppm2      2.459 CV     1
 ASSI {   87}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 86   and name HA  ))
      2.500     0.800     0.800 peak    87 weight  0.10000E+01 volume  0.37280E-02 ppm1      9.520 ppm2      3.906 CV     1
 ASSI {   89}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 90   and name HB2 ))
      3.900     1.900     1.900 peak    89 weight  0.10000E+01 volume  0.64285E-03 ppm1      9.521 ppm2      3.059 CV     1
 ASSI {   94}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 86   and name HB1 ))
      3.000     1.100     1.100 peak    94 weight  0.10000E+01 volume  0.12986E-02 ppm1      9.521 ppm2      1.268 CV     1
 OR {   94}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 86   and name HG  ))
 ASSI {   95}
   (( segid "    " and resid 87   and name HN  ))
   (  segid "    " and resid 86   and name HD2%)
      3.500     1.500     1.500 peak    95 weight  0.10000E+01 volume  0.12975E-02 ppm1      9.520 ppm2      0.915 CV     1
 ASSI {   96}
   (( segid "    " and resid 87   and name HN  ))
   (  segid "    " and resid 115  and name HG1%)
      3.200     1.300     1.300 peak    96 weight  0.10000E+01 volume  0.11386E-02 ppm1      9.520 ppm2      0.659 CV     1
 ASSI {   98}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 96   and name HN  ))
      4.500     2.500     1.500 peak    98 weight  0.10000E+01 volume  0.29147E-03 ppm1      9.412 ppm2      8.901 CV     1
 ASSI {   99}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 48   and name HN  ))
      4.400     2.400     1.600 peak    99 weight  0.10000E+01 volume  0.35114E-03 ppm1      9.415 ppm2      7.914 CV     1
 ASSI {  100}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 36   and name HE3 ))
      3.200     1.300     1.300 peak   100 weight  0.10000E+01 volume  0.79108E-03 ppm1      9.410 ppm2      7.695 CV     1
 ASSI {  106}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 37   and name HA  ))
      2.400     0.700     0.700 peak   106 weight  0.10000E+01 volume  0.34725E-02 ppm1      9.415 ppm2      5.088 CV     1
 ASSI {  109}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 45   and name HA  ))
      4.200     2.200     1.800 peak   109 weight  0.10000E+01 volume  0.31115E-03 ppm1      9.410 ppm2      4.227 CV     1
 ASSI {  111}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 94   and name HB1 ))
      3.200     1.300     1.300 peak   111 weight  0.10000E+01 volume  0.12389E-02 ppm1      9.408 ppm2      2.881 CV     1
 ASSI {  115}
   (( segid "    " and resid 95   and name HN  ))
   (  segid "    " and resid 111  and name HG2%)
      3.500     1.500     1.500 peak   115 weight  0.10000E+01 volume  0.11561E-02 ppm1      9.414 ppm2      1.078 CV     1
 ASSI {  120}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 46   and name HG1 ))
      3.100     1.200     1.200 peak   120 weight  0.10000E+01 volume  0.11468E-02 ppm1      9.412 ppm2      2.106 CV     1
 ASSI {  123}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 45   and name HA  ))
      2.200     0.600     0.600 peak   123 weight  0.10000E+01 volume  0.54232E-02 ppm1      9.386 ppm2      4.214 CV     1
 ASSI {  124}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 47   and name HA  ))
      4.700     2.700     1.300 peak   124 weight  0.10000E+01 volume  0.14384E-03 ppm1      9.384 ppm2      4.420 CV     1
 ASSI {  129}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 45   and name HG  ))
      3.200     1.300     1.300 peak   129 weight  0.10000E+01 volume  0.16622E-02 ppm1      9.387 ppm2      1.232 CV     1
 OR {  129}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 45   and name HB2 ))
 ASSI {  132}
   (( segid "    " and resid 46   and name HN  ))
   (  segid "    " and resid 45   and name HD2%)
      3.800     1.800     1.800 peak   132 weight  0.10000E+01 volume  0.10976E-02 ppm1      9.385 ppm2      0.322 CV     1
 ASSI {  133}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 45   and name HN  ))
      4.800     2.900     1.200 peak   133 weight  0.10000E+01 volume  0.19434E-03 ppm1      9.384 ppm2      8.175 CV     1
 ASSI {  134}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 50   and name HN  ))
      4.400     2.400     1.600 peak   134 weight  0.10000E+01 volume  0.27294E-03 ppm1      9.375 ppm2      8.755 CV     1
 ASSI {  135}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 59   and name HN  ))
      4.900     3.000     1.100 peak   135 weight  0.10000E+01 volume  0.11372E-03 ppm1      9.386 ppm2      8.273 CV     1
 ASSI {  138}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 35   and name HA  ))
      3.100     1.200     1.200 peak   138 weight  0.10000E+01 volume  0.18645E-02 ppm1      9.376 ppm2      5.733 CV     1
 ASSI {  139}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 50   and name HA  ))
      2.400     0.700     0.700 peak   139 weight  0.10000E+01 volume  0.33154E-02 ppm1      9.376 ppm2      5.556 CV     1
 ASSI {  141}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 50   and name HB  ))
      4.200     2.200     1.800 peak   141 weight  0.10000E+01 volume  0.30358E-03 ppm1      9.373 ppm2      4.117 CV     1
 ASSI {  144}
   (( segid "    " and resid 51   and name HN  ))
   (  segid "    " and resid 35   and name HB% )
      4.500     2.500     1.500 peak   144 weight  0.10000E+01 volume  0.32212E-03 ppm1      9.374 ppm2      1.448 CV     1
 ASSI {  152}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 69   and name HA  ))
      2.400     0.700     0.700 peak   152 weight  0.10000E+01 volume  0.33860E-02 ppm1      9.255 ppm2      5.175 CV     1
 ASSI {  153}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 69   and name HB  ))
      4.300     2.300     1.700 peak   153 weight  0.10000E+01 volume  0.45162E-03 ppm1      9.255 ppm2      3.835 CV     1
 ASSI {  156}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 51   and name HB  ))
      5.800     4.200     0.200 peak   156 weight  0.10000E+01 volume  0.15594E-03 ppm1      9.260 ppm2      1.625 CV     1
 OR {  156}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 51   and name HG11))
 ASSI {  159}
   (( segid "    " and resid 70   and name HN  ))
   (  segid "    " and resid 51   and name HD1%)
      5.200     3.400     0.800 peak   159 weight  0.10000E+01 volume  0.20954E-03 ppm1      9.254 ppm2      0.835 CV     1
 ASSI {  160}
   (( segid "    " and resid 70   and name HN  ))
   (  segid "    " and resid 81   and name HD2%)
      4.700     2.800     1.300 peak   160 weight  0.10000E+01 volume  0.19936E-03 ppm1      9.254 ppm2      0.664 CV     1
 OR {  160}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 81   and name HB2 ))
 ASSI {  165}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 38   and name HA  ))
      2.200     0.600     0.600 peak   165 weight  0.10000E+01 volume  0.53671E-02 ppm1      9.253 ppm2      5.805 CV     1
 ASSI {  172}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 38   and name HB2 ))
      3.100     1.200     1.200 peak   172 weight  0.10000E+01 volume  0.22673E-02 ppm1      9.252 ppm2      0.694 CV     1
 OR {  172}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 38   and name HB1 ))
 ASSI {  174}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 38   and name HG1 ))
      4.000     2.000     2.000 peak   174 weight  0.10000E+01 volume  0.72357E-03 ppm1      9.252 ppm2      1.419 CV     1
 ASSI {  175}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 45   and name HA  ))
      4.800     2.900     1.200 peak   175 weight  0.10000E+01 volume  0.11761E-03 ppm1      9.249 ppm2      4.210 CV     1
 ASSI {  180}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 72   and name HA  ))
      3.000     1.100     1.100 peak   180 weight  0.10000E+01 volume  0.11994E-02 ppm1      9.236 ppm2      5.401 CV     1
 ASSI {  185}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 90   and name HN  ))
      4.100     2.200     1.900 peak   185 weight  0.10000E+01 volume  0.15888E-03 ppm1      9.202 ppm2      8.400 CV     1
 ASSI {  187}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 88   and name HB1 ))
      3.700     1.700     1.700 peak   187 weight  0.10000E+01 volume  0.58215E-03 ppm1      9.192 ppm2      3.936 CV     1
 OR {  187}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 88   and name HB2 ))
 ASSI {  190}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 87   and name HB1 ))
      4.100     2.100     1.900 peak   190 weight  0.10000E+01 volume  0.25765E-03 ppm1      9.202 ppm2      1.616 CV     1
 ASSI {  193}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 98   and name HA  ))
      3.500     1.500     1.500 peak   193 weight  0.10000E+01 volume  0.56071E-03 ppm1      9.172 ppm2      5.092 CV     1
 ASSI {  194}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 34   and name HG2 ))
      4.600     2.600     1.400 peak   194 weight  0.10000E+01 volume  0.48695E-03 ppm1      9.170 ppm2      2.439 CV     1
 OR {  194}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 34   and name HG1 ))
 ASSI {  196}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 34   and name HB2 ))
      3.700     1.800     1.800 peak   196 weight  0.10000E+01 volume  0.93406E-03 ppm1      9.171 ppm2      1.941 CV     1
 ASSI {  197}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 34   and name HB1 ))
      2.900     1.000     1.000 peak   197 weight  0.10000E+01 volume  0.14096E-02 ppm1      9.174 ppm2      1.746 CV     1
 ASSI {  203}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 21   and name HN  ))
      4.600     2.600     1.400 peak   203 weight  0.10000E+01 volume  0.25219E-03 ppm1      9.164 ppm2      8.857 CV     1
 ASSI {  205}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 23   and name HN  ))
      4.800     2.900     1.200 peak   205 weight  0.10000E+01 volume  0.18238E-03 ppm1      9.170 ppm2      8.283 CV     1
 ASSI {  207}
   (( segid "    " and resid 22   and name HN  ))
   (  segid "    " and resid 80   and name HD% )
      3.400     1.400     1.400 peak   207 weight  0.10000E+01 volume  0.15645E-02 ppm1      9.165 ppm2      6.951 CV     1
 ASSI {  208}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 21   and name HA  ))
      2.400     0.700     0.700 peak   208 weight  0.10000E+01 volume  0.34328E-02 ppm1      9.165 ppm2      5.818 CV     1
 ASSI {  209}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 80   and name HA  ))
      3.300     1.400     1.400 peak   209 weight  0.10000E+01 volume  0.10671E-02 ppm1      9.166 ppm2      5.676 CV     1
 ASSI {  213}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 21   and name HB1 ))
      3.000     1.100     1.100 peak   213 weight  0.10000E+01 volume  0.14026E-02 ppm1      9.165 ppm2      3.590 CV     1
 ASSI {  227}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 110  and name HA2 ))
      4.000     2.000     2.000 peak   227 weight  0.10000E+01 volume  0.43651E-03 ppm1      9.146 ppm2      2.686 CV     1
 ASSI {  231}
   (( segid "    " and resid 94   and name HN  ))
   (  segid "    " and resid 113  and name HG1%)
      3.500     1.500     1.500 peak   231 weight  0.10000E+01 volume  0.79407E-03 ppm1      9.150 ppm2      0.550 CV     1
 OR {  231}
   (( segid "    " and resid 94   and name HN  ))
   (  segid "    " and resid 113  and name HG2%)
 ASSI {  232}
   (( segid "    " and resid 94   and name HN  ))
   (  segid "    " and resid 93   and name HG2%)
      2.900     1.000     1.000 peak   232 weight  0.10000E+01 volume  0.20039E-02 ppm1      9.147 ppm2      0.363 CV     1
 ASSI {  233}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 95   and name HN  ))
      4.200     2.200     1.800 peak   233 weight  0.10000E+01 volume  0.46524E-03 ppm1      9.149 ppm2      9.411 CV     1
 ASSI {  234}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 38   and name HA  ))
      5.000     3.200     1.000 peak   234 weight  0.10000E+01 volume  0.99316E-04 ppm1      9.149 ppm2      5.845 CV     1
 ASSI {  238}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 87   and name HB1 ))
      3.800     1.800     1.800 peak   238 weight  0.10000E+01 volume  0.48414E-03 ppm1      9.135 ppm2      1.629 CV     1
 ASSI {  242}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 65   and name HB1 ))
      3.800     1.800     1.800 peak   242 weight  0.10000E+01 volume  0.41687E-03 ppm1      9.106 ppm2      1.808 CV     1
 OR {  242}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 65   and name HB2 ))
 ASSI {  243}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 65   and name HG2 ))
      3.900     1.900     1.900 peak   243 weight  0.10000E+01 volume  0.42848E-03 ppm1      9.108 ppm2      1.422 CV     1
 OR {  243}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 65   and name HG1 ))
 ASSI {  244}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 67   and name HB1 ))
      5.500     3.700     0.500 peak   244 weight  0.10000E+01 volume  0.96253E-04 ppm1      9.112 ppm2      1.616 CV     1
 ASSI {  249}
   (( segid "    " and resid 92   and name HN  ))
   (  segid "    " and resid 94   and name HE% )
      3.100     1.200     1.200 peak   249 weight  0.10000E+01 volume  0.13220E-02 ppm1      9.097 ppm2      6.771 CV     1
 ASSI {  255}
   (( segid "    " and resid 92   and name HN  ))
   (  segid "    " and resid 91   and name HG2%)
      3.200     1.300     1.300 peak   255 weight  0.10000E+01 volume  0.19281E-02 ppm1      9.099 ppm2      1.493 CV     1
 ASSI {  261}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 71   and name HB1 ))
      2.800     1.000     1.000 peak   261 weight  0.10000E+01 volume  0.34572E-02 ppm1      9.074 ppm2      3.931 CV     1
 OR {  261}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 71   and name HB2 ))
 ASSI {  265}
   (( segid "    " and resid 72   and name HN  ))
   (  segid "    " and resid 51   and name HD1%)
      3.400     1.500     1.500 peak   265 weight  0.10000E+01 volume  0.74785E-03 ppm1      9.072 ppm2      0.834 CV     1
 ASSI {  269}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 11   and name HA  ))
      2.200     0.600     0.600 peak   269 weight  0.10000E+01 volume  0.61659E-02 ppm1      9.033 ppm2      5.243 CV     1
 ASSI {  270}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 115  and name HA  ))
      3.100     1.200     1.200 peak   270 weight  0.10000E+01 volume  0.95848E-03 ppm1      9.033 ppm2      4.803 CV     1
 ASSI {  272}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 114  and name HB  ))
      3.800     1.800     1.800 peak   272 weight  0.10000E+01 volume  0.65210E-03 ppm1      9.032 ppm2      3.871 CV     1
 ASSI {  274}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 11   and name HB2 ))
      4.300     2.300     1.700 peak   274 weight  0.10000E+01 volume  0.62441E-03 ppm1      9.033 ppm2      1.652 CV     1
 ASSI {  275}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 11   and name HB1 ))
      3.400     1.400     1.400 peak   275 weight  0.10000E+01 volume  0.13305E-02 ppm1      9.033 ppm2      1.443 CV     1
 OR {  275}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 11   and name HG  ))
 ASSI {  276}
   (( segid "    " and resid 12   and name HN  ))
   (  segid "    " and resid 114  and name HG2%)
      4.400     2.500     1.600 peak   276 weight  0.10000E+01 volume  0.25997E-03 ppm1      9.033 ppm2      1.078 CV     1
 ASSI {  279}
   (( segid "    " and resid 12   and name HN  ))
   (  segid "    " and resid 115  and name HG2%)
      3.900     1.900     1.900 peak   279 weight  0.10000E+01 volume  0.38004E-03 ppm1      9.031 ppm2      0.412 CV     1
 ASSI {  280}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 61   and name HA  ))
      2.900     1.100     1.100 peak   280 weight  0.10000E+01 volume  0.16788E-02 ppm1      9.018 ppm2      4.424 CV     1
 ASSI {  285}
   (( segid "    " and resid 113  and name HN  ))
   (  segid "    " and resid 93   and name HG1%)
      2.800     1.000     1.000 peak   285 weight  0.10000E+01 volume  0.87244E-03 ppm1      8.971 ppm2      0.946 CV     1
 ASSI {  293}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 114  and name HN  ))
      4.300     2.300     1.700 peak   293 weight  0.10000E+01 volume  0.29126E-03 ppm1      8.971 ppm2      8.419 CV     1
 ASSI {  294}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 94   and name HN  ))
      2.600     0.800     0.800 peak   294 weight  0.10000E+01 volume  0.54190E-02 ppm1      8.972 ppm2      9.096 CV     1
 ASSI {  296}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 48   and name HN  ))
      5.300     3.500     0.700 peak   296 weight  0.10000E+01 volume  0.12331E-03 ppm1      8.972 ppm2      7.917 CV     1
 ASSI {  299}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 46   and name HA  ))
      2.200     0.600     0.600 peak   299 weight  0.10000E+01 volume  0.63499E-02 ppm1      8.968 ppm2      4.755 CV     1
 ASSI {  302}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 112  and name HG2 ))
      2.400     0.700     0.700 peak   302 weight  0.10000E+01 volume  0.43215E-02 ppm1      8.970 ppm2      2.201 CV     1
 ASSI {  303}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 46   and name HB2 ))
      4.300     2.400     1.700 peak   303 weight  0.10000E+01 volume  0.62294E-03 ppm1      8.969 ppm2      1.857 CV     1
 ASSI {  305}
   (( segid "    " and resid 47   and name HN  ))
   (  segid "    " and resid 45   and name HD2%)
      4.900     3.000     1.100 peak   305 weight  0.10000E+01 volume  0.32758E-04 ppm1      8.965 ppm2      0.319 CV     1
 OR {  305}
   (( segid "    " and resid 47   and name HN  ))
   (  segid "    " and resid 45   and name HD1%)
 ASSI {  311}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 72   and name HA  ))
      2.600     0.800     0.800 peak   311 weight  0.10000E+01 volume  0.25778E-02 ppm1      8.956 ppm2      5.403 CV     1
 ASSI {  313}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 78   and name HB  ))
      4.100     2.100     1.900 peak   313 weight  0.10000E+01 volume  0.22091E-03 ppm1      8.958 ppm2      3.455 CV     1
 ASSI {  316}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 72   and name HB1 ))
      4.100     2.100     1.900 peak   316 weight  0.10000E+01 volume  0.66065E-03 ppm1      8.954 ppm2      1.973 CV     1
 ASSI {  317}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 72   and name HB2 ))
      3.300     1.400     1.400 peak   317 weight  0.10000E+01 volume  0.87175E-03 ppm1      8.953 ppm2      1.758 CV     1
 ASSI {  318}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 72   and name HG1 ))
      3.700     1.700     1.700 peak   318 weight  0.10000E+01 volume  0.50387E-03 ppm1      8.955 ppm2      1.625 CV     1
 OR {  318}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 72   and name HG2 ))
 ASSI {  319}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 76   and name HB2 ))
      5.200     3.400     0.800 peak   319 weight  0.10000E+01 volume  0.69068E-04 ppm1      8.951 ppm2      1.423 CV     1
 OR {  319}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 76   and name HG1 ))
 ASSI {  321}
   (( segid "    " and resid 73   and name HN  ))
   (  segid "    " and resid 78   and name HG2%)
      5.400     3.600     0.600 peak   321 weight  0.10000E+01 volume  0.90458E-04 ppm1      8.952 ppm2      0.638 CV     1
 ASSI {  322}
   (( segid "    " and resid 110  and name HN  ))
   (  segid "    " and resid 93   and name HG2%)
      3.600     1.600     1.600 peak   322 weight  0.10000E+01 volume  0.78436E-03 ppm1      8.927 ppm2      0.362 CV     1
 ASSI {  324}
   (( segid "    " and resid 110  and name HN  ))
   (  segid "    " and resid 6    and name HB% )
      4.700     2.800     1.300 peak   324 weight  0.10000E+01 volume  0.14240E-03 ppm1      8.928 ppm2      1.776 CV     1
 ASSI {  325}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 109  and name HB2 ))
      3.000     1.100     1.100 peak   325 weight  0.10000E+01 volume  0.19275E-02 ppm1      8.925 ppm2      2.272 CV     1
 OR {  325}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 109  and name HB1 ))
 ASSI {  328}
   (( segid "    " and resid 110  and name HN  ))
   (  segid "    " and resid 95   and name HE% )
      2.800     1.000     1.000 peak   328 weight  0.10000E+01 volume  0.22137E-02 ppm1      8.927 ppm2      6.748 CV     1
 ASSI {  329}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 109  and name HN  ))
      3.900     1.900     1.900 peak   329 weight  0.10000E+01 volume  0.33891E-03 ppm1      8.931 ppm2      8.146 CV     1
 ASSI {  330}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 108  and name HA1 ))
      5.000     3.100     1.000 peak   330 weight  0.10000E+01 volume  0.30643E-04 ppm1      8.929 ppm2      4.253 CV     1
 ASSI {  331}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 59   and name HN  ))
      4.200     2.200     1.800 peak   331 weight  0.10000E+01 volume  0.35892E-03 ppm1      8.897 ppm2      8.256 CV     1
 ASSI {  338}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 59   and name HB1 ))
      3.600     1.600     1.600 peak   338 weight  0.10000E+01 volume  0.97964E-03 ppm1      8.900 ppm2      3.367 CV     1
 ASSI {  350}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 70   and name HA  ))
      3.400     1.400     1.400 peak   350 weight  0.10000E+01 volume  0.69100E-03 ppm1      8.881 ppm2      5.354 CV     1
 ASSI {  355}
   (( segid "    " and resid 82   and name HN  ))
   (  segid "    " and resid 81   and name HD1%)
      3.700     1.700     1.700 peak   355 weight  0.10000E+01 volume  0.45839E-03 ppm1      8.876 ppm2      0.148 CV     1
 ASSI {  356}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 81   and name HG  ))
      3.100     1.200     1.200 peak   356 weight  0.10000E+01 volume  0.16440E-02 ppm1      8.870 ppm2      0.473 CV     1
 ASSI {  357}
   (( segid "    " and resid 82   and name HN  ))
   (  segid "    " and resid 81   and name HD2%)
      3.400     1.400     1.400 peak   357 weight  0.10000E+01 volume  0.18336E-02 ppm1      8.880 ppm2      0.654 CV     1
 OR {  357}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 81   and name HB2 ))
 ASSI {  363}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 84   and name HN  ))
      4.800     2.900     1.200 peak   363 weight  0.10000E+01 volume  0.17920E-03 ppm1      8.860 ppm2      7.722 CV     1
 ASSI {  366}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 17   and name HA  ))
      5.100     3.300     0.900 peak   366 weight  0.10000E+01 volume  0.11262E-03 ppm1      8.853 ppm2      5.531 CV     1
 ASSI {  370}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 84   and name HN  ))
      4.500     2.500     1.500 peak   370 weight  0.10000E+01 volume  0.26093E-03 ppm1      8.877 ppm2      7.739 CV     1
 ASSI {  374}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 68   and name HA  ))
      2.500     0.800     0.800 peak   374 weight  0.10000E+01 volume  0.31283E-02 ppm1      8.878 ppm2      6.000 CV     1
 ASSI {  379}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 68   and name HB1 ))
      3.200     1.200     1.200 peak   379 weight  0.10000E+01 volume  0.13191E-02 ppm1      8.878 ppm2      2.905 CV     1
 OR {  379}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 68   and name HB2 ))
 ASSI {  388}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 32   and name HB2 ))
      4.700     2.700     1.300 peak   388 weight  0.10000E+01 volume  0.97076E-04 ppm1      8.859 ppm2      2.689 CV     1
 ASSI {  391}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 59   and name HN  ))
      3.300     1.400     1.400 peak   391 weight  0.10000E+01 volume  0.69450E-03 ppm1      8.848 ppm2      8.260 CV     1
 ASSI {  395}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 35   and name HA  ))
      5.000     3.100     1.000 peak   395 weight  0.10000E+01 volume  0.13689E-03 ppm1      8.852 ppm2      5.763 CV     1
 ASSI {  396}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 58   and name HA  ))
      4.300     2.400     1.700 peak   396 weight  0.10000E+01 volume  0.28697E-03 ppm1      8.850 ppm2      5.129 CV     1
 ASSI {  397}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 49   and name HA  ))
      2.500     0.800     0.800 peak   397 weight  0.10000E+01 volume  0.29073E-02 ppm1      8.848 ppm2      4.909 CV     1
 ASSI {  400}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 49   and name HB1 ))
      3.500     1.500     1.500 peak   400 weight  0.10000E+01 volume  0.10875E-02 ppm1      8.848 ppm2      3.539 CV     1
 ASSI {  401}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 59   and name HB1 ))
      3.700     1.700     1.700 peak   401 weight  0.10000E+01 volume  0.49389E-03 ppm1      8.850 ppm2      3.380 CV     1
 ASSI {  402}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 59   and name HB2 ))
      3.500     1.500     1.500 peak   402 weight  0.10000E+01 volume  0.56412E-03 ppm1      8.847 ppm2      2.826 CV     1
 ASSI {  407}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 7    and name HN  ))
      3.100     1.200     1.200 peak   407 weight  0.10000E+01 volume  0.10603E-02 ppm1      8.830 ppm2      9.508 CV     1
 ASSI {  408}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 94   and name HN  ))
      2.900     1.100     1.100 peak   408 weight  0.10000E+01 volume  0.17291E-02 ppm1      8.810 ppm2      9.132 CV     1
 ASSI {  410}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 20   and name HN  ))
      4.200     2.200     1.800 peak   410 weight  0.10000E+01 volume  0.42799E-03 ppm1      8.829 ppm2      8.158 CV     1
 ASSI {  417}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 20   and name HB  ))
      2.600     0.900     0.900 peak   417 weight  0.10000E+01 volume  0.30307E-02 ppm1      8.832 ppm2      2.067 CV     1
 ASSI {  418}
   (( segid "    " and resid 21   and name HN  ))
   (  segid "    " and resid 20   and name HG1%)
      3.100     1.200     1.200 peak   418 weight  0.10000E+01 volume  0.28884E-02 ppm1      8.830 ppm2      0.310 CV     1
 ASSI {  419}
   (( segid "    " and resid 21   and name HN  ))
   (  segid "    " and resid 20   and name HG2%)
      3.700     1.700     1.700 peak   419 weight  0.10000E+01 volume  0.81605E-03 ppm1      8.831 ppm2     -0.101 CV     1
 ASSI {  421}
   (( segid "    " and resid 111  and name HN  ))
   (  segid "    " and resid 113  and name HG1%)
      4.800     2.800     1.200 peak   421 weight  0.10000E+01 volume  0.26083E-03 ppm1      8.806 ppm2      0.560 CV     1
 OR {  421}
   (( segid "    " and resid 111  and name HN  ))
   (  segid "    " and resid 113  and name HG2%)
 ASSI {  423}
   (( segid "    " and resid 111  and name HN  ))
   (  segid "    " and resid 93   and name HG1%)
      4.200     2.200     1.800 peak   423 weight  0.10000E+01 volume  0.31707E-03 ppm1      8.805 ppm2      0.896 CV     1
 ASSI {  424}
   (( segid "    " and resid 111  and name HN  ))
   (  segid "    " and resid 6    and name HB% )
      2.900     1.000     1.000 peak   424 weight  0.10000E+01 volume  0.20013E-02 ppm1      8.806 ppm2      1.770 CV     1
 ASSI {  425}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 110  and name HA2 ))
      2.400     0.700     0.700 peak   425 weight  0.10000E+01 volume  0.30883E-02 ppm1      8.804 ppm2      2.649 CV     1
 ASSI {  426}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 94   and name HB2 ))
      3.800     1.800     1.800 peak   426 weight  0.10000E+01 volume  0.70614E-03 ppm1      8.809 ppm2      2.886 CV     1
 OR {  426}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 94   and name HB1 ))
 ASSI {  427}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 110  and name HA1 ))
      2.800     1.000     1.000 peak   427 weight  0.10000E+01 volume  0.38119E-02 ppm1      8.804 ppm2      4.495 CV     1
 ASSI {  430}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 49   and name HN  ))
      2.900     1.100     1.100 peak   430 weight  0.10000E+01 volume  0.12970E-02 ppm1      8.761 ppm2      7.134 CV     1
 ASSI {  432}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 35   and name HA  ))
      2.400     0.700     0.700 peak   432 weight  0.10000E+01 volume  0.37733E-02 ppm1      8.762 ppm2      5.724 CV     1
 ASSI {  434}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 49   and name HB2 ))
      4.100     2.100     1.900 peak   434 weight  0.10000E+01 volume  0.25216E-03 ppm1      8.754 ppm2      3.832 CV     1
 ASSI {  435}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 49   and name HB1 ))
      6.000     5.100     0.000 peak   435 weight  0.10000E+01 volume  0.43697E-04 ppm1      8.760 ppm2      3.511 CV     1
 ASSI {  439}
   (( segid "    " and resid 36   and name HN  ))
   (  segid "    " and resid 35   and name HB% )
      2.700     0.900     0.900 peak   439 weight  0.10000E+01 volume  0.34275E-02 ppm1      8.762 ppm2      1.458 CV     1
 ASSI {  445}
   (( segid "    " and resid 112  and name HN  ))
   (  segid "    " and resid 93   and name HG2%)
      4.300     2.300     1.700 peak   445 weight  0.10000E+01 volume  0.29997E-03 ppm1      8.720 ppm2      0.367 CV     1
 ASSI {  446}
   (( segid "    " and resid 112  and name HN  ))
   (  segid "    " and resid 93   and name HG1%)
      4.400     2.400     1.600 peak   446 weight  0.10000E+01 volume  0.35644E-03 ppm1      8.725 ppm2      0.940 CV     1
 ASSI {  447}
   (( segid "    " and resid 112  and name HN  ))
   (  segid "    " and resid 111  and name HG2%)
      3.500     1.600     1.600 peak   447 weight  0.10000E+01 volume  0.63508E-03 ppm1      8.727 ppm2      1.061 CV     1
 ASSI {  450}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 111  and name HB  ))
      4.100     2.100     1.900 peak   450 weight  0.10000E+01 volume  0.49044E-03 ppm1      8.727 ppm2      3.721 CV     1
 ASSI {  451}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 9    and name HA1 ))
      4.000     2.000     2.000 peak   451 weight  0.10000E+01 volume  0.25394E-03 ppm1      8.736 ppm2      3.911 CV     1
 ASSI {  453}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 111  and name HA  ))
      2.700     0.900     0.900 peak   453 weight  0.10000E+01 volume  0.28395E-02 ppm1      8.726 ppm2      4.865 CV     1
 ASSI {  454}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 41   and name HA  ))
      3.900     1.900     1.900 peak   454 weight  0.10000E+01 volume  0.28345E-03 ppm1      8.700 ppm2      4.315 CV     1
 ASSI {  458}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 24   and name HA  ))
      3.100     1.200     1.200 peak   458 weight  0.10000E+01 volume  0.87014E-03 ppm1      8.677 ppm2      5.083 CV     1
 ASSI {  460}
   (( segid "    " and resid 25   and name HN  ))
   (  segid "    " and resid 24   and name HB% )
      4.100     2.100     1.900 peak   460 weight  0.10000E+01 volume  0.32984E-03 ppm1      8.677 ppm2      1.045 CV     1
 ASSI {  461}
   (( segid "    " and resid 25   and name HN  ))
   (  segid "    " and resid 4    and name HD1%)
      3.800     1.800     1.800 peak   461 weight  0.10000E+01 volume  0.14513E-03 ppm1      8.684 ppm2      0.668 CV     1
 ASSI {  463}
   (( segid "    " and resid 8    and name HN  ))
   (( segid "    " and resid 9    and name HN  ))
      4.400     2.500     1.600 peak   463 weight  0.10000E+01 volume  0.26819E-03 ppm1      8.659 ppm2      8.145 CV     1
 ASSI {  464}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 83   and name HN  ))
      3.100     1.200     1.200 peak   464 weight  0.10000E+01 volume  0.93052E-03 ppm1      8.641 ppm2      8.844 CV     1
 ASSI {  468}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 82   and name HE21))
      3.800     1.800     1.800 peak   468 weight  0.10000E+01 volume  0.36714E-03 ppm1      8.641 ppm2      6.913 CV     1
 OR {  468}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 82   and name HE22))
 ASSI {  469}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 17   and name HA  ))
      2.300     0.700     0.700 peak   469 weight  0.10000E+01 volume  0.41016E-02 ppm1      8.641 ppm2      5.561 CV     1
 ASSI {  472}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 17   and name HB2 ))
      2.900     1.100     1.100 peak   472 weight  0.10000E+01 volume  0.29413E-02 ppm1      8.641 ppm2      3.714 CV     1
 OR {  472}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 17   and name HB1 ))
 ASSI {  473}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 83   and name HB2 ))
      3.000     1.100     1.100 peak   473 weight  0.10000E+01 volume  0.91755E-03 ppm1      8.642 ppm2      1.773 CV     1
 ASSI {  477}
   (( segid "    " and resid 18   and name HN  ))
   (  segid "    " and resid 86   and name HD1%)
      3.100     1.200     1.200 peak   477 weight  0.10000E+01 volume  0.14761E-02 ppm1      8.641 ppm2      0.508 CV     1
 ASSI {  479}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 83   and name HG1 ))
      4.900     3.000     1.100 peak   479 weight  0.10000E+01 volume  0.14901E-03 ppm1      8.642 ppm2     -0.036 CV     1
 ASSI {  480}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 37   and name HN  ))
      4.400     2.500     1.600 peak   480 weight  0.10000E+01 volume  0.23509E-03 ppm1      8.601 ppm2      9.504 CV     1
 ASSI {  481}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 35   and name HN  ))
      3.100     1.200     1.200 peak   481 weight  0.10000E+01 volume  0.98208E-03 ppm1      8.594 ppm2      9.161 CV     1
 ASSI {  482}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 96   and name HN  ))
      3.800     1.800     1.800 peak   482 weight  0.10000E+01 volume  0.80120E-03 ppm1      8.593 ppm2      8.844 CV     1
 ASSI {  483}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 98   and name HN  ))
      4.600     2.600     1.400 peak   483 weight  0.10000E+01 volume  0.23761E-03 ppm1      8.592 ppm2      8.099 CV     1
 ASSI {  485}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 36   and name HA  ))
      3.500     1.500     1.500 peak   485 weight  0.10000E+01 volume  0.71469E-03 ppm1      8.594 ppm2      5.476 CV     1
 ASSI {  487}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 96   and name HB2 ))
      3.400     1.400     1.400 peak   487 weight  0.10000E+01 volume  0.14231E-02 ppm1      8.593 ppm2      2.378 CV     1
 ASSI {  488}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 96   and name HB1 ))
      3.400     1.500     1.500 peak   488 weight  0.10000E+01 volume  0.22228E-02 ppm1      8.594 ppm2      1.792 CV     1
 ASSI {  494}
   (( segid "    " and resid 97   and name HN  ))
   (  segid "    " and resid 104  and name HD2%)
      3.900     1.900     1.900 peak   494 weight  0.10000E+01 volume  0.43719E-03 ppm1      8.593 ppm2      0.400 CV     1
 ASSI {  499}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 22   and name HA  ))
      5.000     3.100     1.000 peak   499 weight  0.10000E+01 volume  0.13940E-03 ppm1      8.585 ppm2      5.374 CV     1
 ASSI {  500}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 5    and name HA  ))
      2.300     0.700     0.700 peak   500 weight  0.10000E+01 volume  0.51454E-02 ppm1      8.585 ppm2      4.864 CV     1
 ASSI {  503}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 5    and name HB1 ))
      3.400     1.500     1.500 peak   503 weight  0.10000E+01 volume  0.13488E-02 ppm1      8.586 ppm2      2.107 CV     1
 OR {  503}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 5    and name HB2 ))
 ASSI {  507}
   (( segid "    " and resid 6    and name HN  ))
   (  segid "    " and resid 111  and name HG2%)
      6.000     6.000     0.000 peak   507 weight  0.10000E+01 volume  0.24239E-04 ppm1      8.583 ppm2      1.070 CV     1
 ASSI {  513}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 80   and name HN  ))
      4.300     2.300     1.700 peak   513 weight  0.10000E+01 volume  0.35353E-03 ppm1      8.523 ppm2      9.189 CV     1
 ASSI {  515}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 20   and name HN  ))
      3.200     1.300     1.300 peak   515 weight  0.10000E+01 volume  0.75148E-03 ppm1      8.520 ppm2      8.175 CV     1
 ASSI {  516}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 36   and name HE1 ))
      5.500     3.800     0.500 peak   516 weight  0.10000E+01 volume  0.52001E-04 ppm1      8.523 ppm2      7.894 CV     1
 ASSI {  518}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 21   and name HA  ))
      3.600     1.600     1.600 peak   518 weight  0.10000E+01 volume  0.66175E-03 ppm1      8.522 ppm2      5.837 CV     1
 ASSI {  519}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 80   and name HA  ))
      2.400     0.700     0.700 peak   519 weight  0.10000E+01 volume  0.36756E-02 ppm1      8.522 ppm2      5.669 CV     1
 ASSI {  521}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 21   and name HB2 ))
      4.600     2.700     1.400 peak   521 weight  0.10000E+01 volume  0.22262E-03 ppm1      8.527 ppm2      3.809 CV     1
 ASSI {  522}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 80   and name HB1 ))
      3.600     1.600     1.600 peak   522 weight  0.10000E+01 volume  0.11641E-02 ppm1      8.524 ppm2      2.968 CV     1
 ASSI {  523}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 80   and name HB2 ))
      3.100     1.200     1.200 peak   523 weight  0.10000E+01 volume  0.12903E-02 ppm1      8.521 ppm2      2.750 CV     1
 ASSI {  525}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 19   and name HG2 ))
      3.400     1.400     1.400 peak   525 weight  0.10000E+01 volume  0.69776E-03 ppm1      8.524 ppm2      1.311 CV     1
 OR {  525}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 19   and name HG1 ))
 ASSI {  529}
   (( segid "    " and resid 81   and name HN  ))
   (  segid "    " and resid 20   and name HG2%)
      3.500     1.500     1.500 peak   529 weight  0.10000E+01 volume  0.11057E-02 ppm1      8.522 ppm2     -0.098 CV     1
 ASSI {  530}
   (( segid "    " and resid 3    and name HN  ))
   (( segid "    " and resid 2    and name HA  ))
      2.500     0.800     0.800 peak   530 weight  0.10000E+01 volume  0.33341E-02 ppm1      8.523 ppm2      4.240 CV     1
 ASSI {  534}
   (( segid "    " and resid 3    and name HN  ))
   (  segid "    " and resid 2    and name HG2%)
      3.300     1.400     1.400 peak   534 weight  0.10000E+01 volume  0.12543E-02 ppm1      8.525 ppm2      0.736 CV     1
 OR {  534}
   (( segid "    " and resid 3    and name HN  ))
   (  segid "    " and resid 2    and name HG1%)
 ASSI {  535}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 99   and name HB2 ))
      3.600     1.600     1.600 peak   535 weight  0.10000E+01 volume  0.78138E-03 ppm1      8.529 ppm2      2.701 CV     1
 OR {  535}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 99   and name HB1 ))
 ASSI {  537}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 99   and name HA  ))
      2.700     0.900     0.900 peak   537 weight  0.10000E+01 volume  0.19762E-02 ppm1      8.525 ppm2      4.964 CV     1
 ASSI {  538}
   (( segid "    " and resid 100  and name HN  ))
   (  segid "    " and resid 99   and name HD% )
      4.600     2.600     1.400 peak   538 weight  0.10000E+01 volume  0.17267E-03 ppm1      8.518 ppm2      6.670 CV     1
 ASSI {  541}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 86   and name HN  ))
      3.000     1.200     1.200 peak   541 weight  0.10000E+01 volume  0.11449E-02 ppm1      8.508 ppm2      8.169 CV     1
 ASSI {  546}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 84   and name HA  ))
      2.500     0.800     0.800 peak   546 weight  0.10000E+01 volume  0.29916E-02 ppm1      8.508 ppm2      5.124 CV     1
 ASSI {  557}
   (( segid "    " and resid 85   and name HN  ))
   (  segid "    " and resid 86   and name HD2%)
      5.100     3.300     0.900 peak   557 weight  0.10000E+01 volume  0.12551E-03 ppm1      8.512 ppm2      0.893 CV     1
 ASSI {  558}
   (( segid "    " and resid 85   and name HN  ))
   (  segid "    " and resid 86   and name HD1%)
      5.100     3.200     0.900 peak   558 weight  0.10000E+01 volume  0.11366E-03 ppm1      8.504 ppm2      0.541 CV     1
 ASSI {  560}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 72   and name HN  ))
      5.000     3.200     1.000 peak   560 weight  0.10000E+01 volume  0.15092E-03 ppm1      8.506 ppm2      9.035 CV     1
 ASSI {  561}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 36   and name HE1 ))
      4.000     2.000     2.000 peak   561 weight  0.10000E+01 volume  0.39766E-03 ppm1      8.508 ppm2      7.886 CV     1
 ASSI {  563}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 70   and name HA  ))
      2.400     0.700     0.700 peak   563 weight  0.10000E+01 volume  0.31068E-02 ppm1      8.506 ppm2      5.352 CV     1
 ASSI {  566}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 80   and name HB1 ))
      3.800     1.800     1.800 peak   566 weight  0.10000E+01 volume  0.27652E-03 ppm1      8.501 ppm2      2.952 CV     1
 ASSI {  567}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 70   and name HG12))
      3.500     1.500     1.500 peak   567 weight  0.10000E+01 volume  0.96097E-03 ppm1      8.505 ppm2      2.217 CV     1
 ASSI {  568}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 70   and name HB  ))
      4.300     2.300     1.700 peak   568 weight  0.10000E+01 volume  0.72219E-03 ppm1      8.506 ppm2      1.966 CV     1
 ASSI {  571}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 70   and name HG11))
      2.700     0.900     0.900 peak   571 weight  0.10000E+01 volume  0.19187E-02 ppm1      8.506 ppm2      1.258 CV     1
 ASSI {  573}
   (( segid "    " and resid 71   and name HN  ))
   (  segid "    " and resid 70   and name HG2%)
      3.200     1.300     1.300 peak   573 weight  0.10000E+01 volume  0.31727E-02 ppm1      8.506 ppm2      1.037 CV     1
 OR {  573}
   (( segid "    " and resid 71   and name HN  ))
   (  segid "    " and resid 70   and name HD1%)
 ASSI {  574}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 81   and name HB2 ))
      4.000     2.000     2.000 peak   574 weight  0.10000E+01 volume  0.56131E-03 ppm1      8.505 ppm2      0.648 CV     1
 OR {  574}
   (( segid "    " and resid 71   and name HN  ))
   (  segid "    " and resid 81   and name HD2%)
 ASSI {  575}
   (( segid "    " and resid 71   and name HN  ))
   (  segid "    " and resid 79   and name HD1%)
      4.900     3.100     1.100 peak   575 weight  0.10000E+01 volume  0.89447E-04 ppm1      8.509 ppm2      0.403 CV     1
 ASSI {  577}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 35   and name HN  ))
      5.000     3.100     1.000 peak   577 weight  0.10000E+01 volume  0.23298E-03 ppm1      8.495 ppm2      9.138 CV     1
 ASSI {  579}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 34   and name HA  ))
      4.100     2.100     1.900 peak   579 weight  0.10000E+01 volume  0.39585E-03 ppm1      8.491 ppm2      5.661 CV     1
 ASSI {  583}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 33   and name HB1 ))
      4.000     2.000     2.000 peak   583 weight  0.10000E+01 volume  0.11703E-03 ppm1      8.493 ppm2      2.887 CV     1
 ASSI {  587}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 98   and name HB2 ))
      3.200     1.200     1.200 peak   587 weight  0.10000E+01 volume  0.13834E-02 ppm1      8.488 ppm2      1.433 CV     1
 OR {  587}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 98   and name HB1 ))
 ASSI {  590}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 104  and name HN  ))
      4.200     2.200     1.800 peak   590 weight  0.10000E+01 volume  0.53951E-03 ppm1      8.488 ppm2      8.149 CV     1
 ASSI {  593}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 99   and name HA  ))
      2.600     0.900     0.900 peak   593 weight  0.10000E+01 volume  0.29223E-02 ppm1      8.486 ppm2      4.972 CV     1
 ASSI {  594}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 104  and name HA  ))
      2.200     0.600     0.600 peak   594 weight  0.10000E+01 volume  0.56996E-02 ppm1      8.488 ppm2      3.917 CV     1
 ASSI {  597}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 106  and name HA  ))
      3.700     1.700     1.700 peak   597 weight  0.10000E+01 volume  0.14066E-02 ppm1      8.489 ppm2      4.199 CV     1
 ASSI {  598}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 104  and name HB1 ))
      2.900     1.100     1.100 peak   598 weight  0.10000E+01 volume  0.23303E-02 ppm1      8.488 ppm2      1.302 CV     1
 OR {  598}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 104  and name HG  ))
 ASSI {  600}
   (( segid "    " and resid 105  and name HN  ))
   (  segid "    " and resid 104  and name HD1%)
      3.200     1.300     1.300 peak   600 weight  0.10000E+01 volume  0.17978E-02 ppm1      8.486 ppm2      0.540 CV     1
 ASSI {  601}
   (( segid "    " and resid 105  and name HN  ))
   (  segid "    " and resid 104  and name HD2%)
      3.400     1.400     1.400 peak   601 weight  0.10000E+01 volume  0.11618E-02 ppm1      8.492 ppm2      0.407 CV     1
 ASSI {  602}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 51   and name HG11))
      2.900     1.000     1.000 peak   602 weight  0.10000E+01 volume  0.21283E-02 ppm1      8.495 ppm2      1.631 CV     1
 OR {  602}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 51   and name HB  ))
 ASSI {  605}
   (( segid "    " and resid 52   and name HN  ))
   (  segid "    " and resid 58   and name HG2%)
      2.800     1.000     1.000 peak   605 weight  0.10000E+01 volume  0.22582E-02 ppm1      8.493 ppm2      1.252 CV     1
 ASSI {  608}
   (( segid "    " and resid 79   and name HN  ))
   (  segid "    " and resid 78   and name HG2%)
      2.800     1.000     1.000 peak   608 weight  0.10000E+01 volume  0.21015E-02 ppm1      8.483 ppm2      0.651 CV     1
 ASSI {  611}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 22   and name HB1 ))
      3.300     1.300     1.300 peak   611 weight  0.10000E+01 volume  0.20062E-02 ppm1      8.487 ppm2      2.937 CV     1
 ASSI {  616}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 58   and name HB  ))
      4.300     2.300     1.700 peak   616 weight  0.10000E+01 volume  0.46151E-03 ppm1      8.491 ppm2      3.824 CV     1
 ASSI {  619}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 51   and name HA  ))
      2.200     0.600     0.600 peak   619 weight  0.10000E+01 volume  0.69491E-02 ppm1      8.496 ppm2      5.229 CV     1
 ASSI {  625}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 78   and name HN  ))
      5.000     3.200     1.000 peak   625 weight  0.10000E+01 volume  0.13942E-03 ppm1      8.486 ppm2      7.503 CV     1
 ASSI {  628}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 51   and name HN  ))
      4.700     2.800     1.300 peak   628 weight  0.10000E+01 volume  0.20304E-03 ppm1      8.492 ppm2      9.350 CV     1
 ASSI {  630}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 12   and name HN  ))
      3.400     1.500     1.500 peak   630 weight  0.10000E+01 volume  0.87966E-03 ppm1      8.473 ppm2      9.024 CV     1
 ASSI {  635}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 13   and name HG2 ))
      4.500     2.600     1.500 peak   635 weight  0.10000E+01 volume  0.52673E-04 ppm1      8.475 ppm2      2.436 CV     1
 OR {  635}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 13   and name HG1 ))
 ASSI {  639}
   (( segid "    " and resid 116  and name HN  ))
   (  segid "    " and resid 114  and name HG2%)
      3.900     1.900     1.900 peak   639 weight  0.10000E+01 volume  0.37415E-03 ppm1      8.475 ppm2      1.115 CV     1
 ASSI {  640}
   (( segid "    " and resid 116  and name HN  ))
   (  segid "    " and resid 11   and name HD2%)
      2.700     0.900     0.900 peak   640 weight  0.10000E+01 volume  0.25221E-02 ppm1      8.474 ppm2      0.823 CV     1
 OR {  640}
   (( segid "    " and resid 116  and name HN  ))
   (  segid "    " and resid 11   and name HD1%)
 ASSI {  641}
   (( segid "    " and resid 116  and name HN  ))
   (  segid "    " and resid 115  and name HG1%)
      3.900     1.900     1.900 peak   641 weight  0.10000E+01 volume  0.11483E-02 ppm1      8.474 ppm2      0.633 CV     1
 ASSI {  642}
   (( segid "    " and resid 116  and name HN  ))
   (  segid "    " and resid 115  and name HG2%)
      3.100     1.200     1.200 peak   642 weight  0.10000E+01 volume  0.17740E-02 ppm1      8.473 ppm2      0.404 CV     1
 ASSI {  643}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 76   and name HN  ))
      3.600     1.600     1.600 peak   643 weight  0.10000E+01 volume  0.49343E-03 ppm1      8.458 ppm2      7.448 CV     1
 ASSI {  645}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 74   and name HB1 ))
      4.100     2.100     1.900 peak   645 weight  0.10000E+01 volume  0.26261E-03 ppm1      8.461 ppm2      2.970 CV     1
 OR {  645}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 74   and name HB2 ))
 ASSI {  647}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 87   and name HN  ))
      3.800     1.800     1.800 peak   647 weight  0.10000E+01 volume  0.40020E-03 ppm1      8.437 ppm2      9.511 CV     1
 ASSI {  649}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 91   and name HN  ))
      2.700     0.900     0.900 peak   649 weight  0.10000E+01 volume  0.23581E-02 ppm1      8.438 ppm2      7.794 CV     1
 ASSI {  650}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 91   and name HG1 ))
      4.300     2.300     1.700 peak   650 weight  0.10000E+01 volume  0.21827E-03 ppm1      8.438 ppm2      5.823 CV     1
 ASSI {  652}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 88   and name HA  ))
      3.700     1.700     1.700 peak   652 weight  0.10000E+01 volume  0.42046E-03 ppm1      8.441 ppm2      4.140 CV     1
 ASSI {  656}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 89   and name HG2 ))
      3.300     1.300     1.300 peak   656 weight  0.10000E+01 volume  0.17496E-02 ppm1      8.439 ppm2      2.245 CV     1
 OR {  656}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 89   and name HG1 ))
 ASSI {  661}
   (( segid "    " and resid 90   and name HN  ))
   (  segid "    " and resid 115  and name HG1%)
      3.400     1.500     1.500 peak   661 weight  0.10000E+01 volume  0.79678E-03 ppm1      8.438 ppm2      0.639 CV     1
 ASSI {  667}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 11   and name HA  ))
      2.900     1.100     1.100 peak   667 weight  0.10000E+01 volume  0.12542E-02 ppm1      8.431 ppm2      5.242 CV     1
 ASSI {  669}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 113  and name HA  ))
      2.100     0.600     0.600 peak   669 weight  0.10000E+01 volume  0.83095E-02 ppm1      8.432 ppm2      4.371 CV     1
 ASSI {  673}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 112  and name HG1 ))
      3.800     1.800     1.800 peak   673 weight  0.10000E+01 volume  0.29001E-03 ppm1      8.427 ppm2      2.012 CV     1
 OR {  673}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 112  and name HB1 ))
 ASSI {  674}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 11   and name HB2 ))
      4.600     2.600     1.400 peak   674 weight  0.10000E+01 volume  0.13979E-03 ppm1      8.427 ppm2      1.649 CV     1
 ASSI {  675}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 11   and name HG  ))
      3.500     1.600     1.600 peak   675 weight  0.10000E+01 volume  0.69643E-03 ppm1      8.434 ppm2      1.468 CV     1
 OR {  675}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 11   and name HB1 ))
 ASSI {  677}
   (( segid "    " and resid 114  and name HN  ))
   (  segid "    " and resid 11   and name HD1%)
      2.900     1.100     1.100 peak   677 weight  0.10000E+01 volume  0.20853E-02 ppm1      8.431 ppm2      0.810 CV     1
 OR {  677}
   (( segid "    " and resid 114  and name HN  ))
   (  segid "    " and resid 11   and name HD2%)
 ASSI {  678}
   (( segid "    " and resid 114  and name HN  ))
   (  segid "    " and resid 113  and name HG2%)
      2.900     1.000     1.000 peak   678 weight  0.10000E+01 volume  0.48143E-02 ppm1      8.431 ppm2      0.601 CV     1
 OR {  678}
   (( segid "    " and resid 114  and name HN  ))
   (  segid "    " and resid 113  and name HG1%)
 ASSI {  679}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 124  and name HA  ))
      3.100     1.200     1.200 peak   679 weight  0.10000E+01 volume  0.10958E-02 ppm1      8.423 ppm2      4.190 CV     1
 ASSI {  681}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 124  and name HB  ))
      5.700     4.000     0.300 peak   681 weight  0.10000E+01 volume  0.44831E-04 ppm1      8.423 ppm2      1.855 CV     1
 ASSI {  682}
   (( segid "    " and resid 125  and name HN  ))
   (  segid "    " and resid 124  and name HG2%)
      4.900     3.000     1.100 peak   682 weight  0.10000E+01 volume  0.12766E-03 ppm1      8.423 ppm2      0.860 CV     1
 OR {  682}
   (( segid "    " and resid 125  and name HN  ))
   (  segid "    " and resid 124  and name HD1%)
 ASSI {  686}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 17   and name HN  ))
      4.300     2.300     1.700 peak   686 weight  0.10000E+01 volume  0.58596E-03 ppm1      8.431 ppm2      7.827 CV     1
 ASSI {  690}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 15   and name HA2 ))
      3.300     1.400     1.400 peak   690 weight  0.10000E+01 volume  0.11367E-02 ppm1      8.428 ppm2      3.524 CV     1
 ASSI {  691}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 13   and name HG2 ))
      3.800     1.800     1.800 peak   691 weight  0.10000E+01 volume  0.14613E-03 ppm1      8.431 ppm2      2.425 CV     1
 OR {  691}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 13   and name HG1 ))
 ASSI {  694}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 86   and name HB2 ))
      3.000     1.200     1.200 peak   694 weight  0.10000E+01 volume  0.87717E-03 ppm1      8.432 ppm2      1.435 CV     1
 ASSI {  695}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 86   and name HB1 ))
      4.000     2.000     2.000 peak   695 weight  0.10000E+01 volume  0.58058E-03 ppm1      8.432 ppm2      1.257 CV     1
 OR {  695}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 86   and name HG  ))
 ASSI {  699}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 91   and name HN  ))
      4.300     2.300     1.700 peak   699 weight  0.10000E+01 volume  0.29246E-03 ppm1      8.407 ppm2      7.785 CV     1
 ASSI {  700}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 91   and name HG1 ))
      2.900     1.000     1.000 peak   700 weight  0.10000E+01 volume  0.17472E-02 ppm1      8.404 ppm2      5.823 CV     1
 ASSI {  702}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 91   and name HA  ))
      2.600     0.800     0.800 peak   702 weight  0.10000E+01 volume  0.28760E-02 ppm1      8.402 ppm2      4.407 CV     1
 OR {  702}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 91   and name HB  ))
 ASSI {  703}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 88   and name HA  ))
      4.000     2.000     2.000 peak   703 weight  0.10000E+01 volume  0.40973E-03 ppm1      8.407 ppm2      4.143 CV     1
 ASSI {  704}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 114  and name HB  ))
      4.000     2.000     2.000 peak   704 weight  0.10000E+01 volume  0.51799E-03 ppm1      8.400 ppm2      3.882 CV     1
 ASSI {  706}
   (( segid "    " and resid 115  and name HN  ))
   (  segid "    " and resid 91   and name HG2%)
      3.000     1.100     1.100 peak   706 weight  0.10000E+01 volume  0.19026E-02 ppm1      8.404 ppm2      1.493 CV     1
 ASSI {  707}
   (( segid "    " and resid 115  and name HN  ))
   (  segid "    " and resid 114  and name HG2%)
      2.800     1.000     1.000 peak   707 weight  0.10000E+01 volume  0.18211E-02 ppm1      8.406 ppm2      1.109 CV     1
 ASSI {  708}
   (( segid "    " and resid 115  and name HN  ))
   (  segid "    " and resid 11   and name HD2%)
      3.900     2.000     2.000 peak   708 weight  0.10000E+01 volume  0.42882E-03 ppm1      8.406 ppm2      0.841 CV     1
 OR {  708}
   (( segid "    " and resid 115  and name HN  ))
   (  segid "    " and resid 11   and name HD1%)
 ASSI {  711}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 56   and name HN  ))
      3.400     1.400     1.400 peak   711 weight  0.10000E+01 volume  0.71708E-03 ppm1      8.396 ppm2      8.027 CV     1
 ASSI {  713}
   (( segid "    " and resid 57   and name HN  ))
   (  segid "    " and resid 29   and name HE% )
      5.000     3.100     1.000 peak   713 weight  0.10000E+01 volume  0.30643E-04 ppm1      8.395 ppm2      7.176 CV     1
 OR {  713}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 29   and name HZ  ))
 OR {  713}
   (( segid "    " and resid 57   and name HN  ))
   (  segid "    " and resid 29   and name HD% )
 ASSI {  714}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 52   and name HD22))
      5.200     3.300     0.800 peak   714 weight  0.10000E+01 volume  0.47743E-04 ppm1      8.397 ppm2      6.917 CV     1
 ASSI {  717}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 56   and name HA1 ))
      3.200     1.300     1.300 peak   717 weight  0.10000E+01 volume  0.17337E-02 ppm1      8.395 ppm2      4.008 CV     1
 ASSI {  718}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 52   and name HB1 ))
      3.100     1.200     1.200 peak   718 weight  0.10000E+01 volume  0.87607E-03 ppm1      8.397 ppm2      3.093 CV     1
 ASSI {  720}
   (( segid "    " and resid 57   and name HN  ))
   (  segid "    " and resid 58   and name HG2%)
      4.100     2.100     1.900 peak   720 weight  0.10000E+01 volume  0.22991E-03 ppm1      8.395 ppm2      1.236 CV     1
 ASSI {  722}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 53   and name HB2 ))
      4.500     2.500     1.500 peak   722 weight  0.10000E+01 volume  0.12337E-03 ppm1      8.383 ppm2      1.847 CV     1
 OR {  722}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 53   and name HB1 ))
 OR {  722}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 53   and name HG2 ))
 ASSI {  727}
   (( segid "    " and resid 23   and name HN  ))
   (  segid "    " and resid 78   and name HG2%)
      4.700     2.800     1.300 peak   727 weight  0.10000E+01 volume  0.18925E-03 ppm1      8.313 ppm2      0.639 CV     1
 ASSI {  730}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 5    and name HB1 ))
      3.700     1.700     1.700 peak   730 weight  0.10000E+01 volume  0.45489E-03 ppm1      8.311 ppm2      2.106 CV     1
 OR {  730}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 5    and name HB2 ))
 ASSI {  731}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 5    and name HG2 ))
      3.400     1.400     1.400 peak   731 weight  0.10000E+01 volume  0.30367E-03 ppm1      8.310 ppm2      2.297 CV     1
 OR {  731}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 5    and name HG1 ))
 ASSI {  732}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 22   and name HB1 ))
      3.000     1.100     1.100 peak   732 weight  0.10000E+01 volume  0.27739E-02 ppm1      8.309 ppm2      3.014 CV     1
 OR {  732}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 22   and name HB2 ))
 ASSI {  735}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 22   and name HA  ))
      2.400     0.700     0.700 peak   735 weight  0.10000E+01 volume  0.38210E-02 ppm1      8.312 ppm2      5.374 CV     1
 ASSI {  736}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 6    and name HA  ))
      3.600     1.700     1.700 peak   736 weight  0.10000E+01 volume  0.70494E-03 ppm1      8.309 ppm2      5.751 CV     1
 ASSI {  740}
   (( segid "    " and resid 5    and name HN  ))
   (  segid "    " and resid 4    and name HD2%)
      3.700     1.700     1.700 peak   740 weight  0.10000E+01 volume  0.10605E-02 ppm1      8.276 ppm2      0.657 CV     1
 OR {  740}
   (( segid "    " and resid 5    and name HN  ))
   (  segid "    " and resid 4    and name HD1%)
 ASSI {  742}
   (( segid "    " and resid 5    and name HN  ))
   (  segid "    " and resid 24   and name HB% )
      4.600     2.700     1.400 peak   742 weight  0.10000E+01 volume  0.24594E-03 ppm1      8.275 ppm2      1.044 CV     1
 ASSI {  743}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 4    and name HB1 ))
      2.900     1.100     1.100 peak   743 weight  0.10000E+01 volume  0.22926E-02 ppm1      8.277 ppm2      1.427 CV     1
 OR {  743}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 4    and name HB2 ))
 OR {  743}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 4    and name HG  ))
 ASSI {  748}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 22   and name HA  ))
      4.800     2.900     1.200 peak   748 weight  0.10000E+01 volume  0.18977E-03 ppm1      8.277 ppm2      5.361 CV     1
 ASSI {  756}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 77   and name HD22))
      4.800     2.800     1.200 peak   756 weight  0.10000E+01 volume  0.12395E-03 ppm1      8.268 ppm2      6.891 CV     1
 ASSI {  760}
   (( segid "    " and resid 24   and name HN  ))
   (  segid "    " and resid 23   and name HB% )
      2.900     1.000     1.000 peak   760 weight  0.10000E+01 volume  0.29068E-02 ppm1      8.215 ppm2      1.404 CV     1
 ASSI {  766}
   (( segid "    " and resid 59   and name HN  ))
   (  segid "    " and resid 58   and name HG2%)
      3.800     1.800     1.800 peak   766 weight  0.10000E+01 volume  0.12912E-02 ppm1      8.274 ppm2      1.241 CV     1
 ASSI {  767}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 51   and name HB  ))
      4.200     2.200     1.800 peak   767 weight  0.10000E+01 volume  0.34979E-03 ppm1      8.273 ppm2      1.628 CV     1
 OR {  767}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 51   and name HG11))
 ASSI {  768}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 65   and name HD2 ))
      4.400     2.400     1.600 peak   768 weight  0.10000E+01 volume  0.24389E-03 ppm1      8.277 ppm2      1.854 CV     1
 OR {  768}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 65   and name HD1 ))
 OR {  768}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 65   and name HB2 ))
 OR {  768}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 65   and name HB1 ))
 ASSI {  771}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 58   and name HB  ))
      3.100     1.200     1.200 peak   771 weight  0.10000E+01 volume  0.17455E-02 ppm1      8.276 ppm2      3.853 CV     1
 ASSI {  772}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 50   and name HB  ))
      4.800     2.900     1.200 peak   772 weight  0.10000E+01 volume  0.79333E-04 ppm1      8.279 ppm2      4.111 CV     1
 ASSI {  773}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 58   and name HA  ))
      2.400     0.700     0.700 peak   773 weight  0.10000E+01 volume  0.42414E-02 ppm1      8.275 ppm2      5.134 CV     1
 ASSI {  778}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 58   and name HN  ))
      5.400     3.600     0.600 peak   778 weight  0.10000E+01 volume  0.93521E-04 ppm1      8.275 ppm2      7.773 CV     1
 ASSI {  779}
   (( segid "    " and resid 24   and name HN  ))
   (  segid "    " and resid 78   and name HG2%)
      4.500     2.500     1.500 peak   779 weight  0.10000E+01 volume  0.42891E-03 ppm1      8.222 ppm2      0.684 CV     1
 ASSI {  781}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 77   and name HB1 ))
      4.700     2.800     1.300 peak   781 weight  0.10000E+01 volume  0.24463E-03 ppm1      8.223 ppm2      2.871 CV     1
 ASSI {  784}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 77   and name HD21))
      4.700     2.800     1.300 peak   784 weight  0.10000E+01 volume  0.12392E-03 ppm1      8.208 ppm2      7.226 CV     1
 ASSI {  785}
   (( segid "    " and resid 130  and name HN  ))
   (( segid "    " and resid 129  and name HA  ))
      4.100     2.100     1.900 peak   785 weight  0.10000E+01 volume  0.20175E-03 ppm1      8.216 ppm2      4.184 CV     1
 ASSI {  787}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 43   and name HG2 ))
      3.600     1.600     1.600 peak   787 weight  0.10000E+01 volume  0.13409E-02 ppm1      8.204 ppm2      1.386 CV     1
 OR {  787}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 43   and name HG1 ))
 ASSI {  788}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 43   and name HD1 ))
      4.600     2.600     1.400 peak   788 weight  0.10000E+01 volume  0.32583E-03 ppm1      8.204 ppm2      1.667 CV     1
 OR {  788}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 43   and name HD2 ))
 ASSI {  789}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 43   and name HB1 ))
      2.400     0.700     0.700 peak   789 weight  0.10000E+01 volume  0.42048E-02 ppm1      8.204 ppm2      1.999 CV     1
 OR {  789}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 43   and name HB2 ))
 ASSI {  796}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 44   and name HA2 ))
      2.800     0.900     0.900 peak   796 weight  0.10000E+01 volume  0.23400E-02 ppm1      8.185 ppm2      3.733 CV     1
 ASSI {  798}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 39   and name HE21))
      4.100     2.100     1.900 peak   798 weight  0.10000E+01 volume  0.20163E-03 ppm1      8.188 ppm2      6.746 CV     1
 ASSI {  800}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 39   and name HE22))
      5.000     3.200     1.000 peak   800 weight  0.10000E+01 volume  0.21073E-03 ppm1      8.189 ppm2      7.648 CV     1
 ASSI {  803}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 62   and name HB1 ))
      4.500     2.600     1.500 peak   803 weight  0.10000E+01 volume  0.16127E-03 ppm1      8.176 ppm2      2.705 CV     1
 OR {  803}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 62   and name HB2 ))
 ASSI {  812}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 19   and name HB1 ))
      4.000     2.000     2.000 peak   812 weight  0.10000E+01 volume  0.10027E-02 ppm1      8.169 ppm2      1.613 CV     1
 ASSI {  814}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 19   and name HB2 ))
      3.700     1.700     1.700 peak   814 weight  0.10000E+01 volume  0.98741E-03 ppm1      8.169 ppm2      1.771 CV     1
 ASSI {  818}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 85   and name HA  ))
      2.500     0.800     0.800 peak   818 weight  0.10000E+01 volume  0.35505E-02 ppm1      8.169 ppm2      3.643 CV     1
 OR {  818}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 85   and name HB2 ))
 ASSI {  822}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 17   and name HA  ))
      3.500     1.600     1.600 peak   822 weight  0.10000E+01 volume  0.43666E-03 ppm1      8.170 ppm2      5.552 CV     1
 ASSI {  826}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 87   and name HN  ))
      4.500     2.500     1.500 peak   826 weight  0.10000E+01 volume  0.44592E-03 ppm1      8.170 ppm2      9.514 CV     1
 ASSI {  827}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 15   and name HN  ))
      3.600     1.600     1.600 peak   827 weight  0.10000E+01 volume  0.52102E-03 ppm1      8.169 ppm2      9.752 CV     1
 ASSI {  830}
   (( segid "    " and resid 13   and name HN  ))
   (  segid "    " and resid 12   and name HG2%)
      2.600     0.900     0.900 peak   830 weight  0.10000E+01 volume  0.38072E-02 ppm1      8.166 ppm2      0.804 CV     1
 OR {  830}
   (( segid "    " and resid 13   and name HN  ))
   (  segid "    " and resid 12   and name HG1%)
 ASSI {  834}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 14   and name HD1 ))
      3.800     1.800     1.800 peak   834 weight  0.10000E+01 volume  0.68171E-03 ppm1      8.165 ppm2      3.520 CV     1
 OR {  834}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 14   and name HD2 ))
 ASSI {  836}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 12   and name HA  ))
      2.000     0.500     0.500 peak   836 weight  0.10000E+01 volume  0.11898E-01 ppm1      8.158 ppm2      4.447 CV     1
 ASSI {  839}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 12   and name HN  ))
      4.400     2.400     1.600 peak   839 weight  0.10000E+01 volume  0.28563E-03 ppm1      8.165 ppm2      9.013 CV     1
 ASSI {  842}
   (( segid "    " and resid 20   and name HN  ))
   (  segid "    " and resid 81   and name HD1%)
      4.400     2.400     1.600 peak   842 weight  0.10000E+01 volume  0.21184E-03 ppm1      8.166 ppm2      0.098 CV     1
 ASSI {  848}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 107  and name HB1 ))
      4.200     2.200     1.800 peak   848 weight  0.10000E+01 volume  0.37676E-03 ppm1      8.134 ppm2      3.091 CV     1
 OR {  848}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 107  and name HB2 ))
 ASSI {  850}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 18   and name HN  ))
      4.900     3.000     1.100 peak   850 weight  0.10000E+01 volume  0.15818E-03 ppm1      8.151 ppm2      8.632 CV     1
 ASSI {  852}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 18   and name HA  ))
      2.300     0.600     0.600 peak   852 weight  0.10000E+01 volume  0.62607E-02 ppm1      8.151 ppm2      4.315 CV     1
 ASSI {  857}
   (( segid "    " and resid 19   and name HN  ))
   (  segid "    " and resid 18   and name HD1%)
      2.900     1.100     1.100 peak   857 weight  0.10000E+01 volume  0.24010E-02 ppm1      8.151 ppm2      0.763 CV     1
 ASSI {  858}
   (( segid "    " and resid 19   and name HN  ))
   (  segid "    " and resid 18   and name HD2%)
      3.300     1.300     1.300 peak   858 weight  0.10000E+01 volume  0.11637E-02 ppm1      8.153 ppm2      0.611 CV     1
 ASSI {  859}
   (( segid "    " and resid 19   and name HN  ))
   (  segid "    " and resid 20   and name HG1%)
      6.000     5.100     0.000 peak   859 weight  0.10000E+01 volume  0.26874E-04 ppm1      8.150 ppm2      0.271 CV     1
 ASSI {  860}
   (( segid "    " and resid 19   and name HN  ))
   (  segid "    " and resid 20   and name HG2%)
      6.000     5.000     0.000 peak   860 weight  0.10000E+01 volume  0.20347E-04 ppm1      8.150 ppm2     -0.085 CV     1
 ASSI {  861}
   (( segid "    " and resid 9    and name HN  ))
   (  segid "    " and resid 20   and name HG2%)
      4.600     2.700     1.400 peak   861 weight  0.10000E+01 volume  0.10611E-03 ppm1      8.130 ppm2     -0.075 CV     1
 ASSI {  862}
   (( segid "    " and resid 9    and name HN  ))
   (  segid "    " and resid 20   and name HG1%)
      3.500     1.600     1.600 peak   862 weight  0.10000E+01 volume  0.89175E-03 ppm1      8.132 ppm2      0.298 CV     1
 ASSI {  863}
   (( segid "    " and resid 9    and name HN  ))
   (  segid "    " and resid 113  and name HG1%)
      4.100     2.100     1.900 peak   863 weight  0.10000E+01 volume  0.48736E-03 ppm1      8.131 ppm2      0.524 CV     1
 ASSI {  864}
   (( segid "    " and resid 9    and name HN  ))
   (  segid "    " and resid 18   and name HD2%)
      3.600     1.600     1.600 peak   864 weight  0.10000E+01 volume  0.68705E-03 ppm1      8.131 ppm2      0.666 CV     1
 ASSI {  866}
   (( segid "    " and resid 9    and name HN  ))
   (  segid "    " and resid 111  and name HG2%)
      2.900     1.100     1.100 peak   866 weight  0.10000E+01 volume  0.15699E-02 ppm1      8.133 ppm2      1.062 CV     1
 ASSI {  871}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 111  and name HB  ))
      3.600     1.700     1.700 peak   871 weight  0.10000E+01 volume  0.80161E-03 ppm1      8.131 ppm2      3.727 CV     1
 ASSI {  872}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 10   and name HN  ))
      4.100     2.100     1.900 peak   872 weight  0.10000E+01 volume  0.35515E-03 ppm1      8.133 ppm2      7.121 CV     1
 ASSI {  880}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 39   and name HG1 ))
      2.900     1.000     1.000 peak   880 weight  0.10000E+01 volume  0.35467E-02 ppm1      8.151 ppm2      2.262 CV     1
 OR {  880}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 39   and name HB1 ))
 ASSI {  885}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 3    and name HB1 ))
      3.400     1.400     1.400 peak   885 weight  0.10000E+01 volume  0.14212E-02 ppm1      8.095 ppm2      2.060 CV     1
 OR {  885}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 3    and name HB2 ))
 ASSI {  887}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 108  and name HA1 ))
      3.200     1.300     1.300 peak   887 weight  0.10000E+01 volume  0.98944E-03 ppm1      8.085 ppm2      4.211 CV     1
 OR {  887}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 108  and name HA2 ))
 ASSI {  894}
   (( segid "    " and resid 124  and name HN  ))
   (( segid "    " and resid 123  and name HA  ))
      2.200     0.600     0.600 peak   894 weight  0.10000E+01 volume  0.71584E-02 ppm1      8.091 ppm2      4.336 CV     1
 ASSI {  896}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 10   and name HN  ))
      4.500     2.600     1.500 peak   896 weight  0.10000E+01 volume  0.31921E-03 ppm1      8.101 ppm2      7.113 CV     1
 ASSI {  898}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 12   and name HN  ))
      4.400     2.400     1.600 peak   898 weight  0.10000E+01 volume  0.34565E-03 ppm1      8.095 ppm2      9.033 CV     1
 ASSI {  902}
   (( segid "    " and resid 56   and name HN  ))
   (  segid "    " and resid 58   and name HG2%)
      6.000     5.000     0.000 peak   902 weight  0.10000E+01 volume  0.24208E-04 ppm1      8.035 ppm2      1.250 CV     1
 ASSI {  903}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 55   and name HB2 ))
      3.900     1.900     1.900 peak   903 weight  0.10000E+01 volume  0.34103E-03 ppm1      8.036 ppm2      2.667 CV     1
 ASSI {  904}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 52   and name HB1 ))
      3.700     1.700     1.700 peak   904 weight  0.10000E+01 volume  0.33959E-03 ppm1      8.038 ppm2      3.049 CV     1
 ASSI {  907}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 57   and name HA  ))
      4.700     2.800     1.300 peak   907 weight  0.10000E+01 volume  0.15144E-03 ppm1      8.032 ppm2      4.372 CV     1
 ASSI {  912}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 128  and name HB1 ))
      3.600     1.700     1.700 peak   912 weight  0.10000E+01 volume  0.65757E-03 ppm1      8.032 ppm2      2.673 CV     1
 OR {  912}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 128  and name HB2 ))
 ASSI {  920}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 33   and name HB1 ))
      2.900     1.100     1.100 peak   920 weight  0.10000E+01 volume  0.17789E-02 ppm1      8.034 ppm2      2.865 CV     1
 ASSI {  922}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 33   and name HB2 ))
      3.900     1.900     1.900 peak   922 weight  0.10000E+01 volume  0.63536E-03 ppm1      8.033 ppm2      3.274 CV     1
 ASSI {  926}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 51   and name HN  ))
      3.400     1.500     1.500 peak   926 weight  0.10000E+01 volume  0.54600E-03 ppm1      8.033 ppm2      9.368 CV     1
 ASSI {  927}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 35   and name HN  ))
      4.900     3.000     1.100 peak   927 weight  0.10000E+01 volume  0.18061E-03 ppm1      8.034 ppm2      9.167 CV     1
 ASSI {  933}
   (( segid "    " and resid 36   and name HE1 ))
   (  segid "    " and resid 79   and name HD2%)
      2.500     0.800     0.800 peak   933 weight  0.10000E+01 volume  0.37914E-02 ppm1      7.913 ppm2      0.884 CV     1
 ASSI {  935}
   (( segid "    " and resid 107  and name HN  ))
   (  segid "    " and resid 4    and name HD1%)
      3.700     1.800     1.800 peak   935 weight  0.10000E+01 volume  0.42922E-03 ppm1      7.944 ppm2      0.587 CV     1
 OR {  935}
   (( segid "    " and resid 107  and name HN  ))
   (  segid "    " and resid 4    and name HD2%)
 ASSI {  936}
   (( segid "    " and resid 107  and name HN  ))
   (  segid "    " and resid 106  and name HB% )
      3.000     1.100     1.100 peak   936 weight  0.10000E+01 volume  0.26861E-02 ppm1      7.942 ppm2      1.028 CV     1
 ASSI {  942}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 42   and name HA1 ))
      3.300     1.400     1.400 peak   942 weight  0.10000E+01 volume  0.12358E-02 ppm1      7.938 ppm2      3.753 CV     1
 ASSI {  944}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 41   and name HA  ))
      4.200     2.200     1.800 peak   944 weight  0.10000E+01 volume  0.49706E-03 ppm1      7.942 ppm2      4.344 CV     1
 ASSI {  953}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 107  and name HA  ))
      2.800     0.900     0.900 peak   953 weight  0.10000E+01 volume  0.21299E-02 ppm1      7.933 ppm2      5.028 CV     1
 ASSI {  955}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 107  and name HB2 ))
      3.100     1.200     1.200 peak   955 weight  0.10000E+01 volume  0.13221E-02 ppm1      7.935 ppm2      3.078 CV     1
 OR {  955}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 107  and name HB1 ))
 ASSI {  956}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 4    and name HB2 ))
      3.800     1.800     1.800 peak   956 weight  0.10000E+01 volume  0.36453E-03 ppm1      7.932 ppm2      1.440 CV     1
 OR {  956}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 4    and name HB1 ))
 ASSI {  958}
   (( segid "    " and resid 108  and name HN  ))
   (  segid "    " and resid 4    and name HD1%)
      3.500     1.500     1.500 peak   958 weight  0.10000E+01 volume  0.59645E-03 ppm1      7.935 ppm2      0.588 CV     1
 OR {  958}
   (( segid "    " and resid 108  and name HN  ))
   (  segid "    " and resid 4    and name HD2%)
 ASSI {  959}
   (( segid "    " and resid 36   and name HE1 ))
   (  segid "    " and resid 20   and name HG2%)
      4.700     2.800     1.300 peak   959 weight  0.10000E+01 volume  0.18524E-03 ppm1      7.898 ppm2     -0.108 CV     1
 ASSI {  961}
   (( segid "    " and resid 36   and name HE1 ))
   (  segid "    " and resid 79   and name HD1%)
      2.900     1.000     1.000 peak   961 weight  0.10000E+01 volume  0.20152E-02 ppm1      7.897 ppm2      0.372 CV     1
 ASSI {  962}
   (( segid "    " and resid 36   and name HE1 ))
   (( segid "    " and resid 81   and name HB2 ))
      2.800     1.000     1.000 peak   962 weight  0.10000E+01 volume  0.17655E-02 ppm1      7.900 ppm2      0.656 CV     1
 OR {  962}
   (( segid "    " and resid 36   and name HE1 ))
   (  segid "    " and resid 81   and name HD2%)
 ASSI {  965}
   (( segid "    " and resid 36   and name HE1 ))
   (( segid "    " and resid 70   and name HG11))
      3.000     1.100     1.100 peak   965 weight  0.10000E+01 volume  0.11345E-02 ppm1      7.899 ppm2      1.256 CV     1
 ASSI {  975}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 47   and name HA  ))
      2.300     0.700     0.700 peak   975 weight  0.10000E+01 volume  0.31104E-02 ppm1      7.922 ppm2      4.438 CV     1
 ASSI {  976}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 37   and name HA  ))
      2.800     1.000     1.000 peak   976 weight  0.10000E+01 volume  0.16767E-02 ppm1      7.921 ppm2      5.106 CV     1
 ASSI {  977}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 49   and name HA  ))
      4.800     2.900     1.200 peak   977 weight  0.10000E+01 volume  0.25424E-03 ppm1      7.920 ppm2      4.886 CV     1
 ASSI {  981}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 49   and name HN  ))
      2.400     0.700     0.700 peak   981 weight  0.10000E+01 volume  0.29254E-02 ppm1      7.919 ppm2      7.129 CV     1
 ASSI {  994}
   (( segid "    " and resid 17   and name HN  ))
   (  segid "    " and resid 86   and name HD1%)
      3.900     1.900     1.900 peak   994 weight  0.10000E+01 volume  0.48382E-03 ppm1      7.850 ppm2      0.522 CV     1
 ASSI {  995}
   (( segid "    " and resid 17   and name HN  ))
   (  segid "    " and resid 12   and name HG2%)
      3.000     1.100     1.100 peak   995 weight  0.10000E+01 volume  0.20728E-02 ppm1      7.851 ppm2      0.821 CV     1
 OR {  995}
   (( segid "    " and resid 17   and name HN  ))
   (  segid "    " and resid 12   and name HG1%)
 ASSI {  997}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 12   and name HB  ))
      4.600     2.600     1.400 peak   997 weight  0.10000E+01 volume  0.19247E-03 ppm1      7.856 ppm2      1.859 CV     1
 ASSI {  999}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 16   and name HA2 ))
      2.200     0.600     0.600 peak   999 weight  0.10000E+01 volume  0.67960E-02 ppm1      7.852 ppm2      4.277 CV     1
 ASSI { 1000}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 84   and name HA  ))
      4.800     2.900     1.200 peak  1000 weight  0.10000E+01 volume  0.21692E-03 ppm1      7.851 ppm2      5.137 CV     1
 ASSI { 1003}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 18   and name HN  ))
      3.900     1.900     1.900 peak  1003 weight  0.10000E+01 volume  0.61958E-03 ppm1      7.853 ppm2      8.626 CV     1
 ASSI { 1006}
   (( segid "    " and resid 91   and name HN  ))
   (  segid "    " and resid 115  and name HG2%)
      4.800     2.900     1.200 peak  1006 weight  0.10000E+01 volume  0.17243E-03 ppm1      7.798 ppm2      0.422 CV     1
 ASSI { 1007}
   (( segid "    " and resid 91   and name HN  ))
   (  segid "    " and resid 115  and name HG1%)
      3.300     1.400     1.400 peak  1007 weight  0.10000E+01 volume  0.99661E-03 ppm1      7.800 ppm2      0.644 CV     1
 ASSI { 1011}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 90   and name HB1 ))
      3.400     1.400     1.400 peak  1011 weight  0.10000E+01 volume  0.88651E-03 ppm1      7.799 ppm2      2.812 CV     1
 ASSI { 1013}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 54   and name HA1 ))
      5.700     4.100     0.300 peak  1013 weight  0.10000E+01 volume  0.30643E-04 ppm1      7.800 ppm2      3.934 CV     1
 OR { 1013}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 54   and name HA2 ))
 ASSI { 1018}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 92   and name HN  ))
      4.000     2.000     2.000 peak  1018 weight  0.10000E+01 volume  0.31728E-03 ppm1      7.798 ppm2      9.092 CV     1
 ASSI { 1021}
   (( segid "    " and resid 58   and name HN  ))
   (  segid "    " and resid 60   and name HE% )
      5.000     3.100     1.000 peak  1021 weight  0.10000E+01 volume  0.11157E-03 ppm1      7.780 ppm2      6.743 CV     1
 ASSI { 1023}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 57   and name HA  ))
      2.300     0.700     0.700 peak  1023 weight  0.10000E+01 volume  0.53763E-02 ppm1      7.790 ppm2      4.326 CV     1
 ASSI { 1027}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 57   and name HN  ))
      3.600     1.600     1.600 peak  1027 weight  0.10000E+01 volume  0.10873E-02 ppm1      7.804 ppm2      8.382 CV     1
 ASSI { 1029}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 38   and name HB1 ))
      3.800     1.800     1.800 peak  1029 weight  0.10000E+01 volume  0.58017E-03 ppm1      7.772 ppm2      0.736 CV     1
 OR { 1029}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 38   and name HB2 ))
 ASSI { 1031}
   (( segid "    " and resid 93   and name HN  ))
   (  segid "    " and resid 92   and name HB% )
      2.300     0.700     0.700 peak  1031 weight  0.10000E+01 volume  0.39834E-02 ppm1      7.767 ppm2      1.106 CV     1
 ASSI { 1032}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 38   and name HG2 ))
      4.500     2.600     1.500 peak  1032 weight  0.10000E+01 volume  0.30030E-03 ppm1      7.766 ppm2      1.323 CV     1
 ASSI { 1033}
   (( segid "    " and resid 93   and name HN  ))
   (  segid "    " and resid 40   and name HB% )
      3.900     1.900     1.900 peak  1033 weight  0.10000E+01 volume  0.75645E-03 ppm1      7.768 ppm2      1.457 CV     1
 ASSI { 1034}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 39   and name HB2 ))
      4.600     2.600     1.400 peak  1034 weight  0.10000E+01 volume  0.22244E-03 ppm1      7.769 ppm2      1.763 CV     1
 ASSI { 1037}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 41   and name HD1 ))
      3.900     1.900     1.900 peak  1037 weight  0.10000E+01 volume  0.14102E-03 ppm1      7.764 ppm2      3.626 CV     1
 ASSI { 1038}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 41   and name HD2 ))
      3.700     1.800     1.800 peak  1038 weight  0.10000E+01 volume  0.16823E-03 ppm1      7.773 ppm2      3.793 CV     1
 ASSI { 1040}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 38   and name HA  ))
      4.300     2.300     1.700 peak  1040 weight  0.10000E+01 volume  0.28566E-03 ppm1      7.764 ppm2      5.800 CV     1
 ASSI { 1043}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 39   and name HN  ))
      2.700     0.900     0.900 peak  1043 weight  0.10000E+01 volume  0.17444E-02 ppm1      7.767 ppm2      9.250 CV     1
 ASSI { 1044}
   (( segid "    " and resid 106  and name HN  ))
   (  segid "    " and resid 104  and name HD2%)
      3.100     1.200     1.200 peak  1044 weight  0.10000E+01 volume  0.56232E-03 ppm1      7.761 ppm2      0.348 CV     1
 ASSI { 1047}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 104  and name HB1 ))
      3.200     1.300     1.300 peak  1047 weight  0.10000E+01 volume  0.13225E-02 ppm1      7.759 ppm2      1.336 CV     1
 OR { 1047}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 104  and name HG  ))
 ASSI { 1048}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 105  and name HB1 ))
      3.100     1.200     1.200 peak  1048 weight  0.10000E+01 volume  0.20321E-02 ppm1      7.761 ppm2      2.395 CV     1
 OR { 1048}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 105  and name HB2 ))
 ASSI { 1049}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 83   and name HB2 ))
      4.200     2.200     1.800 peak  1049 weight  0.10000E+01 volume  0.46754E-03 ppm1      7.756 ppm2      1.703 CV     1
 ASSI { 1052}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 83   and name HA  ))
      2.300     0.700     0.700 peak  1052 weight  0.10000E+01 volume  0.48782E-02 ppm1      7.757 ppm2      3.954 CV     1
 ASSI { 1055}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 68   and name HA  ))
      3.100     1.200     1.200 peak  1055 weight  0.10000E+01 volume  0.11860E-02 ppm1      7.757 ppm2      5.990 CV     1
 ASSI { 1056}
   (( segid "    " and resid 84   and name HN  ))
   (  segid "    " and resid 68   and name HD% )
      3.100     1.200     1.200 peak  1056 weight  0.10000E+01 volume  0.12117E-02 ppm1      7.753 ppm2      6.972 CV     1
 OR { 1056}
   (( segid "    " and resid 84   and name HN  ))
   (  segid "    " and resid 68   and name HE% )
 ASSI { 1058}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 105  and name HN  ))
      2.600     0.900     0.900 peak  1058 weight  0.10000E+01 volume  0.19202E-02 ppm1      7.764 ppm2      8.468 CV     1
 ASSI { 1061}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 83   and name HG1 ))
      4.800     2.900     1.200 peak  1061 weight  0.10000E+01 volume  0.34841E-03 ppm1      7.762 ppm2     -0.039 CV     1
 ASSI { 1066}
   (( segid "    " and resid 67   and name HN  ))
   (  segid "    " and resid 64   and name HG2%)
      4.700     2.700     1.300 peak  1066 weight  0.10000E+01 volume  0.12904E-03 ppm1      7.711 ppm2      0.200 CV     1
 ASSI { 1067}
   (( segid "    " and resid 67   and name HN  ))
   (  segid "    " and resid 64   and name HG1%)
      4.600     2.600     1.400 peak  1067 weight  0.10000E+01 volume  0.21346E-03 ppm1      7.705 ppm2      0.847 CV     1
 ASSI { 1068}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 64   and name HB  ))
      4.500     2.500     1.500 peak  1068 weight  0.10000E+01 volume  0.14629E-03 ppm1      7.706 ppm2      1.044 CV     1
 ASSI { 1073}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 68   and name HB2 ))
      3.600     1.600     1.600 peak  1073 weight  0.10000E+01 volume  0.53542E-03 ppm1      7.705 ppm2      2.889 CV     1
 OR { 1073}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 68   and name HB1 ))
 ASSI { 1075}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 65   and name HA  ))
      3.200     1.300     1.300 peak  1075 weight  0.10000E+01 volume  0.16323E-02 ppm1      7.709 ppm2      3.657 CV     1
 ASSI { 1076}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 64   and name HA  ))
      3.800     1.800     1.800 peak  1076 weight  0.10000E+01 volume  0.33542E-03 ppm1      7.704 ppm2      4.058 CV     1
 ASSI { 1077}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 66   and name HA2 ))
      3.900     1.900     1.900 peak  1077 weight  0.10000E+01 volume  0.70365E-03 ppm1      7.704 ppm2      4.273 CV     1
 ASSI { 1079}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 68   and name HA  ))
      4.700     2.700     1.300 peak  1079 weight  0.10000E+01 volume  0.13480E-03 ppm1      7.714 ppm2      6.012 CV     1
 ASSI { 1080}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 68   and name HN  ))
      2.900     1.000     1.000 peak  1080 weight  0.10000E+01 volume  0.32587E-02 ppm1      7.706 ppm2      7.382 CV     1
 ASSI { 1081}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 66   and name HN  ))
      4.300     2.300     1.700 peak  1081 weight  0.10000E+01 volume  0.15861E-03 ppm1      7.712 ppm2      9.093 CV     1
 ASSI { 1089}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 102  and name HA2 ))
      3.300     1.300     1.300 peak  1089 weight  0.10000E+01 volume  0.65637E-03 ppm1      7.657 ppm2      3.546 CV     1
 ASSI { 1092}
   (( segid "    " and resid 103  and name HN  ))
   (  segid "    " and resid 99   and name HD% )
      4.800     2.800     1.200 peak  1092 weight  0.10000E+01 volume  0.14151E-03 ppm1      7.657 ppm2      6.683 CV     1
 ASSI { 1093}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 99   and name HN  ))
      5.200     3.400     0.800 peak  1093 weight  0.10000E+01 volume  0.15870E-03 ppm1      7.665 ppm2      8.513 CV     1
 ASSI { 1094}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 99   and name HB2 ))
      5.500     3.800     0.500 peak  1094 weight  0.10000E+01 volume  0.28927E-04 ppm1      7.653 ppm2      2.682 CV     1
 OR { 1094}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 99   and name HB1 ))
 ASSI { 1098}
   (( segid "    " and resid 39   and name HE22))
   (( segid "    " and resid 44   and name HA2 ))
      4.300     2.400     1.700 peak  1098 weight  0.10000E+01 volume  0.28057E-03 ppm1      7.653 ppm2      3.730 CV     1
 ASSI { 1101}
   (( segid "    " and resid 39   and name HE22))
   (  segid "    " and resid 45   and name HD1%)
      4.400     2.400     1.600 peak  1101 weight  0.10000E+01 volume  0.26108E-03 ppm1      7.655 ppm2      0.321 CV     1
 OR { 1101}
   (( segid "    " and resid 39   and name HE22))
   (  segid "    " and resid 45   and name HD2%)
 ASSI { 1102}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 60   and name HN  ))
      4.100     2.100     1.900 peak  1102 weight  0.10000E+01 volume  0.44665E-03 ppm1      7.634 ppm2      8.871 CV     1
 ASSI { 1106}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 48   and name HA  ))
      3.200     1.200     1.200 peak  1106 weight  0.10000E+01 volume  0.12816E-02 ppm1      7.634 ppm2      3.894 CV     1
 ASSI { 1107}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 60   and name HB1 ))
      3.100     1.200     1.200 peak  1107 weight  0.10000E+01 volume  0.97610E-03 ppm1      7.635 ppm2      2.931 CV     1
 ASSI { 1109}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 65   and name HD1 ))
      3.900     1.900     1.900 peak  1109 weight  0.10000E+01 volume  0.47830E-03 ppm1      7.633 ppm2      1.808 CV     1
 OR { 1109}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 65   and name HB2 ))
 OR { 1109}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 65   and name HB1 ))
 OR { 1109}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 65   and name HD2 ))
 ASSI { 1113}
   (( segid "    " and resid 61   and name HN  ))
   (  segid "    " and resid 64   and name HG1%)
      2.900     1.100     1.100 peak  1113 weight  0.10000E+01 volume  0.21318E-02 ppm1      7.634 ppm2      0.845 CV     1
 ASSI { 1114}
   (( segid "    " and resid 61   and name HN  ))
   (  segid "    " and resid 64   and name HG2%)
      4.300     2.300     1.700 peak  1114 weight  0.10000E+01 volume  0.19063E-03 ppm1      7.635 ppm2      0.158 CV     1
 ASSI { 1116}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 49   and name HA  ))
      3.400     1.400     1.400 peak  1116 weight  0.10000E+01 volume  0.10333E-02 ppm1      7.635 ppm2      4.916 CV     1
 ASSI { 1125}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 34   and name HG2 ))
      4.800     2.900     1.200 peak  1125 weight  0.10000E+01 volume  0.11945E-03 ppm1      7.534 ppm2      2.457 CV     1
 OR { 1125}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 34   and name HG1 ))
 ASSI { 1128}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 31   and name HB1 ))
      3.500     1.500     1.500 peak  1128 weight  0.10000E+01 volume  0.60997E-03 ppm1      7.534 ppm2      3.653 CV     1
 OR { 1128}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 31   and name HB2 ))
 ASSI { 1129}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 30   and name HA  ))
      5.000     3.200     1.000 peak  1129 weight  0.10000E+01 volume  0.22351E-03 ppm1      7.537 ppm2      4.010 CV     1
 ASSI { 1130}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 29   and name HA  ))
      3.900     1.900     1.900 peak  1130 weight  0.10000E+01 volume  0.27968E-03 ppm1      7.532 ppm2      4.230 CV     1
 ASSI { 1131}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 31   and name HA  ))
      3.800     1.800     1.800 peak  1131 weight  0.10000E+01 volume  0.54558E-03 ppm1      7.534 ppm2      4.413 CV     1
 ASSI { 1136}
   (( segid "    " and resid 13   and name HE22))
   (  segid "    " and resid 12   and name HG2%)
      3.500     1.500     1.500 peak  1136 weight  0.10000E+01 volume  0.24634E-03 ppm1      7.510 ppm2      0.808 CV     1
 OR { 1136}
   (( segid "    " and resid 13   and name HE22))
   (  segid "    " and resid 12   and name HG1%)
 ASSI { 1145}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 77   and name HA  ))
      3.100     1.200     1.200 peak  1145 weight  0.10000E+01 volume  0.10396E-02 ppm1      7.496 ppm2      3.753 CV     1
 ASSI { 1147}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 77   and name HN  ))
      4.600     2.600     1.400 peak  1147 weight  0.10000E+01 volume  0.13872E-03 ppm1      7.495 ppm2      7.964 CV     1
 ASSI { 1148}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 73   and name HN  ))
      4.300     2.300     1.700 peak  1148 weight  0.10000E+01 volume  0.16139E-03 ppm1      7.493 ppm2      8.966 CV     1
 ASSI { 1150}
   (( segid "    " and resid 27   and name HN  ))
   (  segid "    " and resid 2    and name HG2%)
      4.400     2.400     1.600 peak  1150 weight  0.10000E+01 volume  0.16645E-03 ppm1      7.464 ppm2      0.735 CV     1
 ASSI { 1151}
   (( segid "    " and resid 27   and name HN  ))
   (  segid "    " and resid 24   and name HB% )
      3.900     1.900     1.900 peak  1151 weight  0.10000E+01 volume  0.36486E-03 ppm1      7.463 ppm2      1.048 CV     1
 ASSI { 1154}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 26   and name HA1 ))
      3.600     1.600     1.600 peak  1154 weight  0.10000E+01 volume  0.85450E-03 ppm1      7.470 ppm2      3.787 CV     1
 ASSI { 1155}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 26   and name HA2 ))
      4.200     2.200     1.800 peak  1155 weight  0.10000E+01 volume  0.18101E-03 ppm1      7.471 ppm2      4.366 CV     1
 ASSI { 1163}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 77   and name HA  ))
      4.600     2.600     1.400 peak  1163 weight  0.10000E+01 volume  0.15315E-03 ppm1      7.459 ppm2      3.765 CV     1
 ASSI { 1166}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 77   and name HN  ))
      3.400     1.500     1.500 peak  1166 weight  0.10000E+01 volume  0.75778E-03 ppm1      7.458 ppm2      7.963 CV     1
 ASSI { 1173}
   (( segid "    " and resid 68   and name HN  ))
   (  segid "    " and resid 64   and name HG1%)
      4.000     2.000     2.000 peak  1173 weight  0.10000E+01 volume  0.56729E-03 ppm1      7.390 ppm2      0.842 CV     1
 ASSI { 1175}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 67   and name HG2 ))
      3.500     1.500     1.500 peak  1175 weight  0.10000E+01 volume  0.10456E-02 ppm1      7.389 ppm2      1.395 CV     1
 ASSI { 1176}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 67   and name HB1 ))
      3.900     1.900     1.900 peak  1176 weight  0.10000E+01 volume  0.12789E-02 ppm1      7.388 ppm2      1.607 CV     1
 ASSI { 1177}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 67   and name HB2 ))
      4.000     2.000     2.000 peak  1177 weight  0.10000E+01 volume  0.62841E-03 ppm1      7.388 ppm2      2.162 CV     1
 ASSI { 1179}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 67   and name HD2 ))
      4.700     2.700     1.300 peak  1179 weight  0.10000E+01 volume  0.25694E-03 ppm1      7.389 ppm2      3.297 CV     1
 OR { 1179}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 67   and name HD1 ))
 ASSI { 1185}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 69   and name HN  ))
      4.300     2.400     1.700 peak  1185 weight  0.10000E+01 volume  0.33511E-03 ppm1      7.393 ppm2      8.866 CV     1
 ASSI { 1186}
   (( segid "    " and resid 84   and name HD21))
   (( segid "    " and resid 82   and name HG1 ))
      5.200     3.400     0.800 peak  1186 weight  0.10000E+01 volume  0.14452E-03 ppm1      7.348 ppm2      1.880 CV     1
 ASSI { 1187}
   (( segid "    " and resid 84   and name HD21))
   (( segid "    " and resid 82   and name HG2 ))
      4.600     2.700     1.400 peak  1187 weight  0.10000E+01 volume  0.15123E-03 ppm1      7.339 ppm2      2.347 CV     1
 ASSI { 1191}
   (( segid "    " and resid 65   and name HN  ))
   (  segid "    " and resid 64   and name HG2%)
      3.600     1.700     1.700 peak  1191 weight  0.10000E+01 volume  0.57120E-03 ppm1      7.296 ppm2      0.190 CV     1
 ASSI { 1192}
   (( segid "    " and resid 65   and name HN  ))
   (  segid "    " and resid 64   and name HG1%)
      3.500     1.600     1.600 peak  1192 weight  0.10000E+01 volume  0.12876E-02 ppm1      7.295 ppm2      0.842 CV     1
 ASSI { 1193}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 64   and name HB  ))
      4.100     2.100     1.900 peak  1193 weight  0.10000E+01 volume  0.40115E-03 ppm1      7.295 ppm2      1.035 CV     1
 ASSI { 1197}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 60   and name HB2 ))
      3.900     1.900     1.900 peak  1197 weight  0.10000E+01 volume  0.37305E-03 ppm1      7.298 ppm2      2.491 CV     1
 ASSI { 1198}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 62   and name HB1 ))
      4.200     2.200     1.800 peak  1198 weight  0.10000E+01 volume  0.86719E-04 ppm1      7.293 ppm2      2.717 CV     1
 OR { 1198}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 62   and name HB2 ))
 ASSI { 1201}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 63   and name HB2 ))
      3.800     1.800     1.800 peak  1201 weight  0.10000E+01 volume  0.15031E-03 ppm1      7.296 ppm2      3.858 CV     1
 OR { 1201}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 63   and name HB1 ))
 ASSI { 1203}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 62   and name HA  ))
      3.300     1.400     1.400 peak  1203 weight  0.10000E+01 volume  0.76698E-03 ppm1      7.294 ppm2      4.306 CV     1
 ASSI { 1209}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 65   and name HG2 ))
      3.700     1.700     1.700 peak  1209 weight  0.10000E+01 volume  0.12667E-02 ppm1      7.269 ppm2      1.406 CV     1
 OR { 1209}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 65   and name HG1 ))
 ASSI { 1210}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 65   and name HB2 ))
      3.800     1.800     1.800 peak  1210 weight  0.10000E+01 volume  0.12558E-02 ppm1      7.268 ppm2      1.812 CV     1
 OR { 1210}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 65   and name HB1 ))
 OR { 1210}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 65   and name HD2 ))
 ASSI { 1213}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 65   and name HA  ))
      5.200     3.400     0.800 peak  1213 weight  0.10000E+01 volume  0.20053E-03 ppm1      7.276 ppm2      3.615 CV     1
 ASSI { 1214}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 63   and name HB2 ))
      3.500     1.600     1.600 peak  1214 weight  0.10000E+01 volume  0.55625E-03 ppm1      7.269 ppm2      3.853 CV     1
 OR { 1214}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 63   and name HB1 ))
 ASSI { 1216}
   (( segid "    " and resid 77   and name HD21))
   (( segid "    " and resid 28   and name HA  ))
      3.100     1.200     1.200 peak  1216 weight  0.10000E+01 volume  0.12078E-02 ppm1      7.257 ppm2      4.311 CV     1
 ASSI { 1222}
   (( segid "    " and resid 49   and name HN  ))
   (  segid "    " and resid 48   and name HG1%)
      3.200     1.300     1.300 peak  1222 weight  0.10000E+01 volume  0.18782E-02 ppm1      7.149 ppm2      0.861 CV     1
 OR { 1222}
   (( segid "    " and resid 49   and name HN  ))
   (  segid "    " and resid 48   and name HG1%)
 ASSI { 1224}
   (( segid "    " and resid 49   and name HN  ))
   (  segid "    " and resid 35   and name HB% )
      3.600     1.700     1.700 peak  1224 weight  0.10000E+01 volume  0.66235E-03 ppm1      7.152 ppm2      1.448 CV     1
 ASSI { 1225}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 48   and name HB  ))
      2.600     0.800     0.800 peak  1225 weight  0.10000E+01 volume  0.26093E-02 ppm1      7.152 ppm2      1.956 CV     1
 ASSI { 1226}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 36   and name HB1 ))
      3.900     1.900     1.900 peak  1226 weight  0.10000E+01 volume  0.58702E-03 ppm1      7.150 ppm2      2.774 CV     1
 ASSI { 1227}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 36   and name HB2 ))
      3.300     1.400     1.400 peak  1227 weight  0.10000E+01 volume  0.59488E-03 ppm1      7.151 ppm2      3.124 CV     1
 ASSI { 1230}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 47   and name HA  ))
      4.800     2.900     1.200 peak  1230 weight  0.10000E+01 volume  0.45869E-03 ppm1      7.153 ppm2      4.440 CV     1
 ASSI { 1232}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 37   and name HA  ))
      3.900     1.900     1.900 peak  1232 weight  0.10000E+01 volume  0.47453E-03 ppm1      7.154 ppm2      5.089 CV     1
 ASSI { 1233}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 35   and name HA  ))
      4.000     2.000     2.000 peak  1233 weight  0.10000E+01 volume  0.61839E-03 ppm1      7.151 ppm2      5.688 CV     1
 ASSI { 1236}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 47   and name HE1 ))
      4.400     2.400     1.600 peak  1236 weight  0.10000E+01 volume  0.15545E-03 ppm1      7.160 ppm2     10.406 CV     1
 ASSI { 1237}
   (( segid "    " and resid 10   and name HN  ))
   (  segid "    " and resid 20   and name HG1%)
      4.100     2.100     1.900 peak  1237 weight  0.10000E+01 volume  0.37532E-03 ppm1      7.132 ppm2      0.305 CV     1
 ASSI { 1238}
   (( segid "    " and resid 10   and name HN  ))
   (  segid "    " and resid 113  and name HG1%)
      2.700     0.900     0.900 peak  1238 weight  0.10000E+01 volume  0.28988E-02 ppm1      7.132 ppm2      0.568 CV     1
 OR { 1238}
   (( segid "    " and resid 10   and name HN  ))
   (  segid "    " and resid 113  and name HG2%)
 ASSI { 1239}
   (( segid "    " and resid 10   and name HN  ))
   (  segid "    " and resid 18   and name HD1%)
      3.200     1.300     1.300 peak  1239 weight  0.10000E+01 volume  0.90854E-03 ppm1      7.130 ppm2      0.807 CV     1
 ASSI { 1242}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 9    and name HA2 ))
      2.500     0.800     0.800 peak  1242 weight  0.10000E+01 volume  0.26302E-02 ppm1      7.132 ppm2      3.533 CV     1
 ASSI { 1244}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 113  and name HA  ))
      2.600     0.800     0.800 peak  1244 weight  0.10000E+01 volume  0.30031E-02 ppm1      7.133 ppm2      4.368 CV     1
 ASSI { 1246}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 114  and name HN  ))
      3.700     1.700     1.700 peak  1246 weight  0.10000E+01 volume  0.72449E-03 ppm1      7.133 ppm2      8.425 CV     1
 ASSI { 1248}
   (( segid "    " and resid 74   and name HD21))
   (( segid "    " and resid 30   and name HA  ))
      5.000     3.100     1.000 peak  1248 weight  0.10000E+01 volume  0.30643E-04 ppm1      7.013 ppm2      3.996 CV     1
 ASSI { 1250}
   (( segid "    " and resid 112  and name HE22))
   (  segid "    " and resid 93   and name HG1%)
      3.300     1.400     1.400 peak  1250 weight  0.10000E+01 volume  0.34081E-03 ppm1      6.971 ppm2      0.923 CV     1
 ASSI { 1261}
   (( segid "    " and resid 82   and name HE22))
   (( segid "    " and resid 17   and name HB2 ))
      3.000     1.100     1.100 peak  1261 weight  0.10000E+01 volume  0.12533E-02 ppm1      6.960 ppm2      3.719 CV     1
 OR { 1261}
   (( segid "    " and resid 82   and name HE22))
   (( segid "    " and resid 17   and name HB1 ))
 ASSI { 1263}
   (( segid "    " and resid 82   and name HE22))
   (( segid "    " and resid 19   and name HD2 ))
      4.600     2.600     1.400 peak  1263 weight  0.10000E+01 volume  0.51265E-04 ppm1      6.964 ppm2      2.929 CV     1
 OR { 1263}
   (( segid "    " and resid 82   and name HE22))
   (( segid "    " and resid 19   and name HD1 ))
 ASSI { 1269}
   (( segid "    " and resid 77   and name HD22))
   (( segid "    " and resid 28   and name HA  ))
      3.200     1.300     1.300 peak  1269 weight  0.10000E+01 volume  0.85960E-03 ppm1      6.891 ppm2      4.296 CV     1
 ASSI { 1282}
   (( segid "    " and resid 13   and name HE21))
   (  segid "    " and resid 12   and name HG2%)
      3.700     1.700     1.700 peak  1282 weight  0.10000E+01 volume  0.18042E-03 ppm1      6.814 ppm2      0.810 CV     1
 OR { 1282}
   (( segid "    " and resid 13   and name HE21))
   (  segid "    " and resid 12   and name HG1%)
 ASSI { 1285}
   (( segid "    " and resid 84   and name HD22))
   (( segid "    " and resid 82   and name HG1 ))
      3.900     1.900     1.900 peak  1285 weight  0.10000E+01 volume  0.42294E-03 ppm1      6.754 ppm2      1.891 CV     1
 ASSI { 1286}
   (( segid "    " and resid 84   and name HD22))
   (( segid "    " and resid 82   and name HG2 ))
      3.700     1.700     1.700 peak  1286 weight  0.10000E+01 volume  0.29708E-03 ppm1      6.755 ppm2      2.364 CV     1
 ASSI { 1291}
   (( segid "    " and resid 39   and name HE21))
   (( segid "    " and resid 45   and name HA  ))
      3.800     1.800     1.800 peak  1291 weight  0.10000E+01 volume  0.47756E-03 ppm1      6.748 ppm2      4.259 CV     1
 ASSI { 1292}
   (( segid "    " and resid 39   and name HE21))
   (  segid "    " and resid 45   and name HD1%)
      5.400     3.600     0.600 peak  1292 weight  0.10000E+01 volume  0.42809E-04 ppm1      6.748 ppm2      0.328 CV     1
 OR { 1292}
   (( segid "    " and resid 39   and name HE21))
   (  segid "    " and resid 45   and name HD2%)
 ASSI { 1293}
   (( segid "    " and resid 39   and name HE21))
   (( segid "    " and resid 45   and name HB2 ))
      5.700     4.100     0.300 peak  1293 weight  0.10000E+01 volume  0.32359E-04 ppm1      6.749 ppm2      1.242 CV     1
 OR { 1293}
   (( segid "    " and resid 39   and name HE21))
   (( segid "    " and resid 45   and name HG  ))
 ASSI { 1295}
   (( segid "    " and resid 112  and name HE21))
   (  segid "    " and resid 93   and name HG1%)
      3.900     1.900     1.900 peak  1295 weight  0.10000E+01 volume  0.26604E-03 ppm1      6.637 ppm2      0.929 CV     1
 ASSI { 1311}
   (( segid "    " and resid 67   and name HE  ))
   (  segid "    " and resid 64   and name HG2%)
      4.200     2.200     1.800 peak  1311 weight  0.10000E+01 volume  0.79430E-04 ppm1      6.756 ppm2      0.177 CV     1
 ASSI { 1317}
   (( segid "    " and resid 38   and name HE  ))
   (  segid "    " and resid 48   and name HG1%)
      3.900     1.900     1.900 peak  1317 weight  0.10000E+01 volume  0.29334E-03 ppm1      7.301 ppm2      0.869 CV     1
 OR { 1317}
   (( segid "    " and resid 38   and name HE  ))
   (  segid "    " and resid 48   and name HG1%)
 ASSI { 1318}
   (( segid "    " and resid 38   and name HE  ))
   (  segid "    " and resid 48   and name HG2%)
      3.700     1.700     1.700 peak  1318 weight  0.10000E+01 volume  0.42518E-03 ppm1      7.250 ppm2      0.879 CV     1
 OR { 1318}
   (( segid "    " and resid 38   and name HE  ))
   (  segid "    " and resid 48   and name HG2%)
 OR { 1318}
   (( segid "    " and resid 38   and name HE  ))
   (  segid "    " and resid 48   and name HG1%)
 OR { 1318}
   (( segid "    " and resid 38   and name HE  ))
   (  segid "    " and resid 48   and name HG1%)
 ASSI { 1319}
   (( segid "    " and resid 38   and name HE  ))
   (( segid "    " and resid 46   and name HG1 ))
      6.000     4.500     0.000 peak  1319 weight  0.10000E+01 volume  0.42257E-04 ppm1      7.297 ppm2      2.098 CV     1
 OR { 1319}
   (( segid "    " and resid 38   and name HE  ))
   (( segid "    " and resid 46   and name HB1 ))
 ASSI { 1325}
   (( segid "    " and resid 37   and name HN  ))
   (  segid "    " and resid 45   and name HD1%)
      6.000     5.400     0.000 peak  1325 weight  0.10000E+01 volume  0.95209E-04 ppm1      9.523 ppm2      0.335 CV     1
 OR { 1325}
   (( segid "    " and resid 37   and name HN  ))
   (  segid "    " and resid 45   and name HD2%)
 ASSI { 1326}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 108  and name HA2 ))
      5.000     3.100     1.000 peak  1326 weight  0.10000E+01 volume  0.30643E-04 ppm1      8.932 ppm2      4.129 CV     1
 ASSI { 1328}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 112  and name HE21))
      3.400     1.400     1.400 peak  1328 weight  0.10000E+01 volume  0.00000E+00 ppm1      9.096 ppm2      6.636 CV     1
 ASSI { 1334}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 66   and name HA1 ))
      3.400     1.400     1.400 peak  1334 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.707 ppm2      3.547 CV     1
 ASSI { 1338}
   (( segid "    " and resid 82   and name HE22))
   (( segid "    " and resid 18   and name HN  ))
      3.400     1.400     1.400 peak  1338 weight  0.10000E+01 volume  0.00000E+00 ppm1      6.958 ppm2      8.644 CV     1
 ASSI { 1339}
   (( segid "    " and resid 82   and name HE21))
   (( segid "    " and resid 18   and name HN  ))
      3.400     1.400     1.400 peak  1339 weight  0.10000E+01 volume  0.00000E+00 ppm1      6.892 ppm2      8.625 CV     1
 ASSI { 1347}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 47   and name HE1 ))
      3.400     1.400     1.400 peak  1347 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.845 ppm2     10.395 CV     1
 ASSI { 1348}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 47   and name HD1 ))
      3.400     1.400     1.400 peak  1348 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.153 ppm2      6.845 CV     1
 ASSI { 1349}
   (( segid "    " and resid 107  and name HE1 ))
   (  segid "    " and resid 95   and name HE% )
      3.400     1.400     1.400 peak  1349 weight  0.10000E+01 volume  0.00000E+00 ppm1      9.687 ppm2      6.733 CV     1
 ASSI {    3}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 36   and name HB2 ))
      4.500     2.500     1.500 peak     3 weight  0.10000E+01 volume  0.35334E-03 ppm1      5.737 ppm2      2.714 CV     1
 ASSI {    4}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 50   and name HA  ))
      2.500     0.800     0.800 peak     4 weight  0.10000E+01 volume  0.26990E-02 ppm1      5.735 ppm2      5.555 CV     1
 ASSI {   25}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 22   and name HA  ))
      2.700     0.900     0.900 peak    25 weight  0.10000E+01 volume  0.18613E-02 ppm1      5.764 ppm2      5.376 CV     1
 ASSI {   26}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 22   and name HB2 ))
      4.000     2.000     2.000 peak    26 weight  0.10000E+01 volume  0.48543E-03 ppm1      5.755 ppm2      2.985 CV     1
 OR {   26}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 22   and name HB1 ))
 ASSI {   41}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 98   and name HA  ))
      3.000     1.100     1.100 peak    41 weight  0.10000E+01 volume  0.82084E-03 ppm1      5.676 ppm2      5.097 CV     1
 ASSI {   44}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 35   and name HN  ))
      2.500     0.800     0.800 peak    44 weight  0.10000E+01 volume  0.27695E-02 ppm1      5.673 ppm2      9.163 CV     1
 ASSI {   50}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 83   and name HA  ))
      3.100     1.200     1.200 peak    50 weight  0.10000E+01 volume  0.10698E-02 ppm1      6.008 ppm2      3.974 CV     1
 ASSI {   54}
   (( segid "    " and resid 68   and name HA  ))
   (  segid "    " and resid 81   and name HD1%)
      4.500     2.600     1.500 peak    54 weight  0.10000E+01 volume  0.28457E-03 ppm1      6.010 ppm2      0.651 CV     1
 OR {   54}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 81   and name HB1 ))
 ASSI {   62}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 72   and name HA  ))
      3.100     1.200     1.200 peak    62 weight  0.10000E+01 volume  0.92758E-03 ppm1      4.971 ppm2      5.384 CV     1
 ASSI {   63}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 80   and name HN  ))
      2.800     1.000     1.000 peak    63 weight  0.10000E+01 volume  0.15060E-02 ppm1      4.966 ppm2      9.219 CV     1
 ASSI {   74}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 22   and name HA  ))
      5.000     3.100     1.000 peak    74 weight  0.10000E+01 volume  0.13659E-03 ppm1      5.830 ppm2      5.422 CV     1
 ASSI {   79}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 80   and name HB1 ))
      5.100     3.300     0.900 peak    79 weight  0.10000E+01 volume  0.97780E-04 ppm1      5.831 ppm2      2.760 CV     1
 ASSI {   81}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 19   and name HG2 ))
      4.500     2.600     1.500 peak    81 weight  0.10000E+01 volume  0.13118E-03 ppm1      5.829 ppm2      1.326 CV     1
 OR {   81}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 19   and name HG1 ))
 ASSI {   84}
   (( segid "    " and resid 21   and name HA  ))
   (  segid "    " and resid 20   and name HG1%)
      5.000     3.200     1.000 peak    84 weight  0.10000E+01 volume  0.75511E-04 ppm1      5.831 ppm2      0.296 CV     1
 ASSI {   85}
   (( segid "    " and resid 21   and name HA  ))
   (  segid "    " and resid 20   and name HG2%)
      5.200     3.300     0.800 peak    85 weight  0.10000E+01 volume  0.10535E-03 ppm1      5.831 ppm2     -0.093 CV     1
 ASSI {   91}
   (( segid "    " and resid 38   and name HA  ))
   (  segid "    " and resid 92   and name HB% )
      3.700     1.700     1.700 peak    91 weight  0.10000E+01 volume  0.81348E-03 ppm1      5.816 ppm2      1.100 CV     1
 ASSI {   94}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 39   and name HB1 ))
      4.900     2.900     1.100 peak    94 weight  0.10000E+01 volume  0.23227E-03 ppm1      5.812 ppm2      2.248 CV     1
 OR {   94}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 39   and name HG1 ))
 ASSI {   96}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 94   and name HB1 ))
      5.700     4.100     0.300 peak    96 weight  0.10000E+01 volume  0.81849E-04 ppm1      5.809 ppm2      2.921 CV     1
 OR {   96}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 94   and name HB2 ))
 ASSI {   98}
   (( segid "    " and resid 38   and name HA  ))
   (  segid "    " and resid 94   and name HD% )
      3.800     1.800     1.800 peak    98 weight  0.10000E+01 volume  0.49853E-03 ppm1      5.819 ppm2      6.845 CV     1
 OR {   98}
   (( segid "    " and resid 38   and name HA  ))
   (  segid "    " and resid 94   and name HE% )
 ASSI {  102}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 39   and name HB2 ))
      6.000     6.000     0.000 peak   102 weight  0.10000E+01 volume  0.10681E-04 ppm1      5.813 ppm2      1.731 CV     1
 ASSI {  106}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 20   and name HN  ))
      5.100     3.200     0.900 peak   106 weight  0.10000E+01 volume  0.12879E-03 ppm1      5.672 ppm2      8.144 CV     1
 ASSI {  108}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 21   and name HA  ))
      2.300     0.700     0.700 peak   108 weight  0.10000E+01 volume  0.40153E-02 ppm1      5.682 ppm2      5.803 CV     1
 ASSI {  109}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 21   and name HB1 ))
      4.000     2.000     2.000 peak   109 weight  0.10000E+01 volume  0.36963E-03 ppm1      5.682 ppm2      3.764 CV     1
 ASSI {  110}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 21   and name HB2 ))
      5.800     4.300     0.200 peak   110 weight  0.10000E+01 volume  0.98139E-04 ppm1      5.691 ppm2      3.577 CV     1
 ASSI {  114}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 19   and name HG2 ))
      4.300     2.400     1.700 peak   114 weight  0.10000E+01 volume  0.20388E-03 ppm1      5.694 ppm2      1.277 CV     1
 ASSI {  118}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 84   and name HA  ))
      2.900     1.000     1.000 peak   118 weight  0.10000E+01 volume  0.14687E-02 ppm1      5.572 ppm2      5.151 CV     1
 ASSI {  119}
   (( segid "    " and resid 17   and name HA  ))
   (  segid "    " and resid 86   and name HD1%)
      3.100     1.200     1.200 peak   119 weight  0.10000E+01 volume  0.11433E-02 ppm1      5.571 ppm2      0.508 CV     1
 ASSI {  122}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 83   and name HB2 ))
      4.900     3.000     1.100 peak   122 weight  0.10000E+01 volume  0.19683E-03 ppm1      5.571 ppm2      1.802 CV     1
 ASSI {  123}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 84   and name HB1 ))
      6.000     6.000     0.000 peak   123 weight  0.10000E+01 volume  0.29835E-04 ppm1      5.577 ppm2      2.774 CV     1
 ASSI {  126}
   (( segid "    " and resid 17   and name HA  ))
   (  segid "    " and resid 68   and name HE% )
      6.000     5.600     0.000 peak   126 weight  0.10000E+01 volume  0.21202E-04 ppm1      5.575 ppm2      6.949 CV     1
 OR {  126}
   (( segid "    " and resid 17   and name HA  ))
   (  segid "    " and resid 68   and name HD% )
 OR {  126}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 68   and name HZ  ))
 ASSI {  129}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 16   and name HN  ))
      3.700     1.700     1.700 peak   129 weight  0.10000E+01 volume  0.51261E-03 ppm1      5.571 ppm2      8.442 CV     1
 ASSI {  133}
   (( segid "    " and resid 36   and name HA  ))
   (  segid "    " and resid 37   and name HG2%)
      4.600     2.600     1.400 peak   133 weight  0.10000E+01 volume  0.47862E-03 ppm1      5.481 ppm2      0.628 CV     1
 ASSI {  137}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 96   and name HB2 ))
      4.700     2.800     1.300 peak   137 weight  0.10000E+01 volume  0.27786E-03 ppm1      5.487 ppm2      1.812 CV     1
 ASSI {  141}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 96   and name HA  ))
      2.900     1.000     1.000 peak   141 weight  0.10000E+01 volume  0.13890E-02 ppm1      5.480 ppm2      4.936 CV     1
 ASSI {  151}
   (( segid "    " and resid 50   and name HA  ))
   (  segid "    " and resid 35   and name HB% )
      3.500     1.500     1.500 peak   151 weight  0.10000E+01 volume  0.74734E-03 ppm1      5.564 ppm2      1.446 CV     1
 ASSI {  163}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 71   and name HB1 ))
      4.300     2.300     1.700 peak   163 weight  0.10000E+01 volume  0.20237E-03 ppm1      5.381 ppm2      3.953 CV     1
 OR {  163}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 71   and name HB2 ))
 ASSI {  172}
   (( segid "    " and resid 72   and name HA  ))
   (  segid "    " and resid 79   and name HD1%)
      4.400     2.400     1.600 peak   172 weight  0.10000E+01 volume  0.17070E-03 ppm1      5.413 ppm2      0.395 CV     1
 ASSI {  183}
   (( segid "    " and resid 70   and name HA  ))
   (  segid "    " and resid 81   and name HD1%)
      3.300     1.300     1.300 peak   183 weight  0.10000E+01 volume  0.10773E-02 ppm1      5.359 ppm2      0.651 CV     1
 OR {  183}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 81   and name HB1 ))
 ASSI {  184}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 81   and name HG  ))
      4.600     2.600     1.400 peak   184 weight  0.10000E+01 volume  0.12645E-03 ppm1      5.362 ppm2      0.464 CV     1
 ASSI {  187}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 59   and name HN  ))
      4.200     2.200     1.800 peak   187 weight  0.10000E+01 volume  0.29919E-03 ppm1      5.243 ppm2      8.285 CV     1
 ASSI {  200}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 114  and name HB  ))
      3.100     1.200     1.200 peak   200 weight  0.10000E+01 volume  0.13242E-02 ppm1      5.255 ppm2      3.870 CV     1
 ASSI {  203}
   (( segid "    " and resid 11   and name HA  ))
   (  segid "    " and resid 114  and name HG2%)
      3.700     1.700     1.700 peak   203 weight  0.10000E+01 volume  0.70080E-03 ppm1      5.255 ppm2      1.080 CV     1
 ASSI {  208}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 24   and name HN  ))
      2.100     0.600     0.600 peak   208 weight  0.10000E+01 volume  0.80363E-02 ppm1      4.866 ppm2      8.172 CV     1
 ASSI {  212}
   (( segid "    " and resid 96   and name HA  ))
   (( segid "    " and resid 97   and name HN  ))
      2.800     1.000     1.000 peak   212 weight  0.10000E+01 volume  0.13587E-02 ppm1      4.959 ppm2      8.583 CV     1
 ASSI {  216}
   (( segid "    " and resid 96   and name HA  ))
   (  segid "    " and resid 97   and name HB% )
      4.100     2.100     1.900 peak   216 weight  0.10000E+01 volume  0.55621E-03 ppm1      4.955 ppm2      1.090 CV     1
 ASSI {  229}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 99   and name HN  ))
      2.600     0.800     0.800 peak   229 weight  0.10000E+01 volume  0.23295E-02 ppm1      5.101 ppm2      8.479 CV     1
 ASSI {  232}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 99   and name HB1 ))
      4.400     2.400     1.600 peak   232 weight  0.10000E+01 volume  0.31592E-03 ppm1      5.099 ppm2      2.680 CV     1
 OR {  232}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 99   and name HB2 ))
 ASSI {  242}
   (( segid "    " and resid 107  and name HA  ))
   (  segid "    " and resid 4    and name HD1%)
      3.300     1.300     1.300 peak   242 weight  0.10000E+01 volume  0.84365E-03 ppm1      5.044 ppm2      0.589 CV     1
 ASSI {  245}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 47   and name HA  ))
      2.600     0.800     0.800 peak   245 weight  0.10000E+01 volume  0.33008E-02 ppm1      5.097 ppm2      4.467 CV     1
 ASSI {  250}
   (( segid "    " and resid 37   and name HA  ))
   (  segid "    " and resid 45   and name HD1%)
      5.200     3.400     0.800 peak   250 weight  0.10000E+01 volume  0.18809E-03 ppm1      5.094 ppm2      0.295 CV     1
 OR {  250}
   (( segid "    " and resid 37   and name HA  ))
   (  segid "    " and resid 45   and name HD2%)
 ASSI {  252}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 52   and name HN  ))
      3.900     1.900     1.900 peak   252 weight  0.10000E+01 volume  0.45497E-03 ppm1      5.144 ppm2      8.475 CV     1
 ASSI {  254}
   (( segid "    " and resid 58   and name HA  ))
   (  segid "    " and resid 60   and name HD% )
      4.300     2.400     1.700 peak   254 weight  0.10000E+01 volume  0.34130E-03 ppm1      5.157 ppm2      6.999 CV     1
 ASSI {  256}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 59   and name HB1 ))
      5.400     3.600     0.600 peak   256 weight  0.10000E+01 volume  0.11106E-03 ppm1      5.146 ppm2      2.852 CV     1
 ASSI {  257}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 51   and name HG11))
      4.100     2.200     1.900 peak   257 weight  0.10000E+01 volume  0.33807E-03 ppm1      5.146 ppm2      1.625 CV     1
 OR {  257}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 51   and name HB  ))
 ASSI {  267}
   (( segid "    " and resid 69   and name HA  ))
   (  segid "    " and resid 70   and name HG2%)
      4.700     2.700     1.300 peak   267 weight  0.10000E+01 volume  0.52696E-03 ppm1      5.183 ppm2      1.000 CV     1
 ASSI {  269}
   (( segid "    " and resid 78   and name HA  ))
   (( segid "    " and resid 79   and name HN  ))
      2.600     0.900     0.900 peak   269 weight  0.10000E+01 volume  0.21475E-02 ppm1      5.090 ppm2      8.451 CV     1
 ASSI {  272}
   (( segid "    " and resid 78   and name HA  ))
   (  segid "    " and resid 29   and name HD% )
      4.200     2.200     1.800 peak   272 weight  0.10000E+01 volume  0.12769E-03 ppm1      5.092 ppm2      7.202 CV     1
 OR {  272}
   (( segid "    " and resid 78   and name HA  ))
   (  segid "    " and resid 29   and name HE% )
 ASSI {  273}
   (( segid "    " and resid 78   and name HA  ))
   (( segid "    " and resid 23   and name HA  ))
      3.100     1.200     1.200 peak   273 weight  0.10000E+01 volume  0.83725E-03 ppm1      5.088 ppm2      4.872 CV     1
 ASSI {  275}
   (( segid "    " and resid 78   and name HA  ))
   (( segid "    " and resid 79   and name HB1 ))
      4.700     2.800     1.300 peak   275 weight  0.10000E+01 volume  0.18776E-03 ppm1      5.097 ppm2      1.778 CV     1
 OR {  275}
   (( segid "    " and resid 78   and name HA  ))
   (( segid "    " and resid 79   and name HG  ))
 ASSI {  276}
   (( segid "    " and resid 78   and name HA  ))
   (  segid "    " and resid 23   and name HB% )
      5.100     3.300     0.900 peak   276 weight  0.10000E+01 volume  0.16731E-03 ppm1      5.091 ppm2      1.403 CV     1
 ASSI {  287}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 19   and name HA  ))
      4.300     2.300     1.700 peak   287 weight  0.10000E+01 volume  0.36508E-03 ppm1      4.877 ppm2      5.123 CV     1
 ASSI {  302}
   (( segid "    " and resid 128  and name HA  ))
   (( segid "    " and resid 129  and name HN  ))
      3.800     1.800     1.800 peak   302 weight  0.10000E+01 volume  0.34989E-03 ppm1      4.562 ppm2      8.021 CV     1
 ASSI {  304}
   (( segid "    " and resid 92   and name HA  ))
   (  segid "    " and resid 40   and name HB% )
      3.100     1.200     1.200 peak   304 weight  0.10000E+01 volume  0.10894E-02 ppm1      4.511 ppm2      1.463 CV     1
 ASSI {  305}
   (( segid "    " and resid 92   and name HA  ))
   (( segid "    " and resid 41   and name HD1 ))
      4.000     2.000     2.000 peak   305 weight  0.10000E+01 volume  0.31562E-03 ppm1      4.509 ppm2      3.814 CV     1
 ASSI {  306}
   (( segid "    " and resid 92   and name HA  ))
   (( segid "    " and resid 93   and name HN  ))
      3.000     1.200     1.200 peak   306 weight  0.10000E+01 volume  0.15463E-02 ppm1      4.511 ppm2      7.753 CV     1
 ASSI {  308}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 104  and name HN  ))
      2.600     0.800     0.800 peak   308 weight  0.10000E+01 volume  0.33806E-02 ppm1      4.453 ppm2      8.142 CV     1
 ASSI {  313}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 62   and name HB2 ))
      4.300     2.300     1.700 peak   313 weight  0.10000E+01 volume  0.23574E-03 ppm1      4.418 ppm2      2.738 CV     1
 OR {  313}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 62   and name HB1 ))
 ASSI {  314}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 47   and name HH2 ))
      3.000     1.100     1.100 peak   314 weight  0.10000E+01 volume  0.16279E-02 ppm1      4.422 ppm2      6.841 CV     1
 ASSI {  317}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 13   and name HG2 ))
      5.700     4.100     0.300 peak   317 weight  0.10000E+01 volume  0.97104E-04 ppm1      4.464 ppm2      2.425 CV     1
 OR {  317}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 13   and name HG1 ))
 ASSI {  324}
   (( segid "    " and resid 117  and name HA  ))
   (( segid "    " and resid 14   and name HD1 ))
      3.200     1.300     1.300 peak   324 weight  0.10000E+01 volume  0.98732E-03 ppm1      4.526 ppm2      3.512 CV     1
 OR {  324}
   (( segid "    " and resid 117  and name HA  ))
   (( segid "    " and resid 14   and name HD2 ))
 ASSI {  325}
   (( segid "    " and resid 117  and name HA  ))
   (( segid "    " and resid 13   and name HG2 ))
      3.100     1.200     1.200 peak   325 weight  0.10000E+01 volume  0.47752E-03 ppm1      4.526 ppm2      2.435 CV     1
 OR {  325}
   (( segid "    " and resid 117  and name HA  ))
   (( segid "    " and resid 13   and name HG1 ))
 ASSI {  328}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 94   and name HN  ))
      3.400     1.400     1.400 peak   328 weight  0.10000E+01 volume  0.52102E-03 ppm1      4.465 ppm2      9.160 CV     1
 ASSI {  329}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 113  and name HN  ))
      2.500     0.800     0.800 peak   329 weight  0.10000E+01 volume  0.20051E-02 ppm1      4.471 ppm2      8.959 CV     1
 ASSI {  336}
   (( segid "    " and resid 91   and name HB  ))
   (( segid "    " and resid 92   and name HN  ))
      3.300     1.400     1.400 peak   336 weight  0.10000E+01 volume  0.12409E-02 ppm1      4.378 ppm2      9.106 CV     1
 ASSI {  341}
   (( segid "    " and resid 91   and name HB  ))
   (  segid "    " and resid 115  and name HG1%)
      4.400     2.500     1.600 peak   341 weight  0.10000E+01 volume  0.36066E-03 ppm1      4.370 ppm2      0.610 CV     1
 ASSI {  345}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 76   and name HN  ))
      3.800     1.800     1.800 peak   345 weight  0.10000E+01 volume  0.38898E-03 ppm1      4.322 ppm2      7.452 CV     1
 ASSI {  348}
   (( segid "    " and resid 91   and name HA  ))
   (  segid "    " and resid 115  and name HG1%)
      3.600     1.600     1.600 peak   348 weight  0.10000E+01 volume  0.59300E-03 ppm1      4.477 ppm2      0.634 CV     1
 ASSI {  353}
   (( segid "    " and resid 91   and name HA  ))
   (( segid "    " and resid 92   and name HN  ))
      2.600     0.800     0.800 peak   353 weight  0.10000E+01 volume  0.30418E-02 ppm1      4.476 ppm2      9.050 CV     1
 ASSI {  360}
   (( segid "    " and resid 93   and name HA  ))
   (( segid "    " and resid 94   and name HN  ))
      2.500     0.800     0.800 peak   360 weight  0.10000E+01 volume  0.24248E-02 ppm1      4.403 ppm2      9.172 CV     1
 ASSI {  367}
   (( segid "    " and resid 2    and name HA  ))
   (  segid "    " and resid 27   and name HD% )
      4.500     2.500     1.500 peak   367 weight  0.10000E+01 volume  0.25517E-03 ppm1      4.252 ppm2      7.018 CV     1
 OR {  367}
   (( segid "    " and resid 2    and name HA  ))
   (  segid "    " and resid 27   and name HE% )
 OR {  367}
   (( segid "    " and resid 2    and name HA  ))
   (( segid "    " and resid 27   and name HZ  ))
 ASSI {  368}
   (( segid "    " and resid 2    and name HA  ))
   (( segid "    " and resid 26   and name HA1 ))
      3.900     1.900     1.900 peak   368 weight  0.10000E+01 volume  0.25239E-03 ppm1      4.254 ppm2      3.770 CV     1
 ASSI {  380}
   (( segid "    " and resid 57   and name HA  ))
   (  segid "    " and resid 58   and name HG2%)
      4.400     2.400     1.600 peak   380 weight  0.10000E+01 volume  0.29265E-03 ppm1      4.339 ppm2      1.249 CV     1
 ASSI {  384}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 62   and name HB1 ))
      3.400     1.500     1.500 peak   384 weight  0.10000E+01 volume  0.28156E-03 ppm1      4.167 ppm2      2.706 CV     1
 OR {  384}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 62   and name HB2 ))
 ASSI {  385}
   (( segid "    " and resid 63   and name HA  ))
   (  segid "    " and resid 64   and name HG1%)
      4.800     2.900     1.200 peak   385 weight  0.10000E+01 volume  0.21753E-03 ppm1      4.173 ppm2      0.207 CV     1
 ASSI {  390}
   (( segid "    " and resid 127  and name HA  ))
   (( segid "    " and resid 128  and name HN  ))
      3.800     1.800     1.800 peak   390 weight  0.10000E+01 volume  0.36624E-03 ppm1      4.187 ppm2      8.132 CV     1
 ASSI {  393}
   (( segid "    " and resid 120  and name HA  ))
   (( segid "    " and resid 121  and name HN  ))
      4.400     2.500     1.600 peak   393 weight  0.10000E+01 volume  0.12911E-03 ppm1      4.256 ppm2      8.279 CV     1
 ASSI {  413}
   (( segid "    " and resid 1    and name HA  ))
   (  segid "    " and resid 2    and name HG2%)
      4.800     2.900     1.200 peak   413 weight  0.10000E+01 volume  0.15343E-03 ppm1      4.222 ppm2      0.782 CV     1
 OR {  413}
   (( segid "    " and resid 1    and name HA  ))
   (  segid "    " and resid 2    and name HG1%)
 ASSI {  416}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 19   and name HA  ))
      2.800     1.000     1.000 peak   416 weight  0.10000E+01 volume  0.15070E-02 ppm1      4.197 ppm2      5.119 CV     1
 ASSI {  419}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 19   and name HB2 ))
      3.600     1.600     1.600 peak   419 weight  0.10000E+01 volume  0.78887E-03 ppm1      4.204 ppm2      1.710 CV     1
 OR {  419}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 19   and name HB1 ))
 ASSI {  420}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 19   and name HG1 ))
      2.800     1.000     1.000 peak   420 weight  0.10000E+01 volume  0.17562E-02 ppm1      4.196 ppm2      1.299 CV     1
 OR {  420}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 19   and name HG2 ))
 ASSI {  421}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 19   and name HD2 ))
      4.600     2.700     1.400 peak   421 weight  0.10000E+01 volume  0.45554E-04 ppm1      4.197 ppm2      2.854 CV     1
 OR {  421}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 19   and name HD1 ))
 ASSI {  423}
   (( segid "    " and resid 106  and name HA  ))
   (( segid "    " and resid 107  and name HN  ))
      2.600     0.900     0.900 peak   423 weight  0.10000E+01 volume  0.27091E-02 ppm1      4.165 ppm2      7.938 CV     1
 ASSI {  425}
   (( segid "    " and resid 106  and name HA  ))
   (( segid "    " and resid 107  and name HB1 ))
      3.900     1.900     1.900 peak   425 weight  0.10000E+01 volume  0.57571E-03 ppm1      4.159 ppm2      3.110 CV     1
 OR {  425}
   (( segid "    " and resid 106  and name HA  ))
   (( segid "    " and resid 107  and name HB2 ))
 ASSI {  426}
   (( segid "    " and resid 106  and name HA  ))
   (  segid "    " and resid 97   and name HB% )
      3.500     1.500     1.500 peak   426 weight  0.10000E+01 volume  0.10310E-02 ppm1      4.161 ppm2      1.128 CV     1
 ASSI {  428}
   (( segid "    " and resid 106  and name HA  ))
   (  segid "    " and resid 4    and name HD1%)
      4.000     2.000     2.000 peak   428 weight  0.10000E+01 volume  0.42732E-03 ppm1      4.159 ppm2      0.603 CV     1
 ASSI {  429}
   (( segid "    " and resid 66   and name HA1 ))
   (( segid "    " and resid 65   and name HB1 ))
      4.000     2.000     2.000 peak   429 weight  0.10000E+01 volume  0.23690E-03 ppm1      4.270 ppm2      1.807 CV     1
 OR {  429}
   (( segid "    " and resid 66   and name HA1 ))
   (( segid "    " and resid 65   and name HB2 ))
 ASSI {  432}
   (( segid "    " and resid 108  and name HA1 ))
   (( segid "    " and resid 109  and name HN  ))
      3.000     1.100     1.100 peak   432 weight  0.10000E+01 volume  0.23063E-02 ppm1      4.253 ppm2      8.139 CV     1
 ASSI {  435}
   (( segid "    " and resid 108  and name HA2 ))
   (( segid "    " and resid 4    and name HB2 ))
      2.900     1.100     1.100 peak   435 weight  0.10000E+01 volume  0.13765E-02 ppm1      4.162 ppm2      1.452 CV     1
 OR {  435}
   (( segid "    " and resid 108  and name HA2 ))
   (( segid "    " and resid 4    and name HB1 ))
 ASSI {  436}
   (( segid "    " and resid 108  and name HA2 ))
   (( segid "    " and resid 109  and name HN  ))
      2.800     1.000     1.000 peak   436 weight  0.10000E+01 volume  0.18041E-02 ppm1      4.169 ppm2      8.137 CV     1
 ASSI {  440}
   (( segid "    " and resid 56   and name HA2 ))
   (  segid "    " and resid 51   and name HD1%)
      3.800     1.800     1.800 peak   440 weight  0.10000E+01 volume  0.29089E-03 ppm1      3.857 ppm2      0.825 CV     1
 ASSI {  442}
   (( segid "    " and resid 56   and name HA2 ))
   (( segid "    " and resid 51   and name HG11))
      5.100     3.300     0.900 peak   442 weight  0.10000E+01 volume  0.61305E-04 ppm1      3.859 ppm2      1.611 CV     1
 OR {  442}
   (( segid "    " and resid 56   and name HA2 ))
   (( segid "    " and resid 51   and name HB  ))
 ASSI {  445}
   (( segid "    " and resid 56   and name HA2 ))
   (( segid "    " and resid 57   and name HN  ))
      3.600     1.600     1.600 peak   445 weight  0.10000E+01 volume  0.39250E-03 ppm1      3.868 ppm2      8.391 CV     1
 ASSI {  449}
   (( segid "    " and resid 56   and name HA1 ))
   (( segid "    " and resid 51   and name HG11))
      5.100     3.200     0.900 peak   449 weight  0.10000E+01 volume  0.14148E-03 ppm1      4.023 ppm2      1.620 CV     1
 OR {  449}
   (( segid "    " and resid 56   and name HA1 ))
   (( segid "    " and resid 51   and name HB  ))
 ASSI {  452}
   (( segid "    " and resid 56   and name HA1 ))
   (  segid "    " and resid 51   and name HD1%)
      4.200     2.200     1.800 peak   452 weight  0.10000E+01 volume  0.32842E-03 ppm1      4.018 ppm2      0.825 CV     1
 ASSI {  461}
   (( segid "    " and resid 41   and name HD2 ))
   (  segid "    " and resid 40   and name HB% )
      2.700     0.900     0.900 peak   461 weight  0.10000E+01 volume  0.21661E-02 ppm1      3.652 ppm2      1.459 CV     1
 ASSI {  462}
   (( segid "    " and resid 41   and name HD2 ))
   (  segid "    " and resid 92   and name HB% )
      4.600     2.600     1.400 peak   462 weight  0.10000E+01 volume  0.23355E-03 ppm1      3.657 ppm2      1.102 CV     1
 ASSI {  463}
   (( segid "    " and resid 104  and name HA  ))
   (( segid "    " and resid 99   and name HA  ))
      3.000     1.100     1.100 peak   463 weight  0.10000E+01 volume  0.10265E-02 ppm1      3.924 ppm2      4.947 CV     1
 ASSI {  466}
   (( segid "    " and resid 104  and name HA  ))
   (( segid "    " and resid 99   and name HB1 ))
      5.100     3.300     0.900 peak   466 weight  0.10000E+01 volume  0.47655E-04 ppm1      3.928 ppm2      2.731 CV     1
 OR {  466}
   (( segid "    " and resid 104  and name HA  ))
   (( segid "    " and resid 99   and name HB2 ))
 ASSI {  472}
   (( segid "    " and resid 83   and name HA  ))
   (  segid "    " and resid 68   and name HD% )
      3.000     1.100     1.100 peak   472 weight  0.10000E+01 volume  0.15814E-02 ppm1      3.978 ppm2      6.937 CV     1
 OR {  472}
   (( segid "    " and resid 83   and name HA  ))
   (  segid "    " and resid 68   and name HE% )
 ASSI {  476}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 84   and name HB2 ))
      5.000     3.100     1.000 peak   476 weight  0.10000E+01 volume  0.20898E-03 ppm1      3.987 ppm2      3.087 CV     1
 ASSI {  484}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 84   and name HD21))
      3.600     1.600     1.600 peak   484 weight  0.10000E+01 volume  0.54613E-03 ppm1      3.976 ppm2      7.284 CV     1
 ASSI {  489}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 87   and name HB1 ))
      4.300     2.300     1.700 peak   489 weight  0.10000E+01 volume  0.37068E-03 ppm1      3.913 ppm2      1.609 CV     1
 OR {  489}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 87   and name HD2 ))
 OR {  489}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 87   and name HD1 ))
 ASSI {  490}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 67   and name HD1 ))
      3.800     1.800     1.800 peak   490 weight  0.10000E+01 volume  0.14653E-03 ppm1      3.914 ppm2      3.280 CV     1
 OR {  490}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 67   and name HD2 ))
 ASSI {  505}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 67   and name HD2 ))
      3.800     1.800     1.800 peak   505 weight  0.10000E+01 volume  0.39266E-03 ppm1      4.092 ppm2      3.315 CV     1
 OR {  505}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 67   and name HD1 ))
 ASSI {  506}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 68   and name HB2 ))
      4.300     2.300     1.700 peak   506 weight  0.10000E+01 volume  0.28413E-03 ppm1      4.094 ppm2      2.894 CV     1
 OR {  506}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 68   and name HB1 ))
 ASSI {  508}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 67   and name HG2 ))
      4.100     2.100     1.900 peak   508 weight  0.10000E+01 volume  0.28901E-03 ppm1      4.086 ppm2      1.410 CV     1
 OR {  508}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 67   and name HG1 ))
 ASSI {  513}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 91   and name HG1 ))
      3.700     1.700     1.700 peak   513 weight  0.10000E+01 volume  0.38319E-03 ppm1      4.148 ppm2      5.825 CV     1
 ASSI {  518}
   (( segid "    " and resid 88   and name HA  ))
   (  segid "    " and resid 115  and name HG2%)
      3.300     1.300     1.300 peak   518 weight  0.10000E+01 volume  0.88232E-03 ppm1      4.149 ppm2      0.408 CV     1
 ASSI {  520}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 56   and name HA2 ))
      3.000     1.100     1.100 peak   520 weight  0.10000E+01 volume  0.12351E-02 ppm1      4.179 ppm2      3.849 CV     1
 ASSI {  523}
   (( segid "    " and resid 89   and name HA  ))
   (( segid "    " and resid 90   and name HN  ))
      4.000     2.000     2.000 peak   523 weight  0.10000E+01 volume  0.28377E-03 ppm1      4.306 ppm2      8.429 CV     1
 ASSI {  524}
   (( segid "    " and resid 89   and name HA  ))
   (( segid "    " and resid 91   and name HN  ))
      4.000     2.000     2.000 peak   524 weight  0.10000E+01 volume  0.31923E-03 ppm1      4.305 ppm2      7.793 CV     1
 ASSI {  531}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 65   and name HE2 ))
      4.100     2.100     1.900 peak   531 weight  0.10000E+01 volume  0.39332E-03 ppm1      4.315 ppm2      3.087 CV     1
 OR {  531}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 65   and name HE1 ))
 ASSI {  533}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 65   and name HB2 ))
      2.800     0.900     0.900 peak   533 weight  0.10000E+01 volume  0.25195E-02 ppm1      4.313 ppm2      1.805 CV     1
 OR {  533}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 65   and name HD1 ))
 OR {  533}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 65   and name HB1 ))
 OR {  533}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 65   and name HD2 ))
 ASSI {  535}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 53   and name HG1 ))
      3.800     1.800     1.800 peak   535 weight  0.10000E+01 volume  0.39487E-03 ppm1      4.407 ppm2      1.843 CV     1
 OR {  535}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 53   and name HB2 ))
 OR {  535}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 53   and name HB1 ))
 ASSI {  540}
   (( segid "    " and resid 28   and name HA  ))
   (( segid "    " and resid 29   and name HN  ))
      3.000     1.100     1.100 peak   540 weight  0.10000E+01 volume  0.12030E-02 ppm1      4.307 ppm2      8.257 CV     1
 ASSI {  543}
   (( segid "    " and resid 29   and name HA  ))
   (  segid "    " and resid 32   and name HE% )
      3.000     1.100     1.100 peak   543 weight  0.10000E+01 volume  0.18489E-02 ppm1      4.276 ppm2      7.070 CV     1
 ASSI {  548}
   (( segid "    " and resid 85   and name HB1 ))
   (( segid "    " and resid 86   and name HN  ))
      5.300     3.500     0.700 peak   548 weight  0.10000E+01 volume  0.90624E-04 ppm1      4.034 ppm2      8.150 CV     1
 ASSI {  549}
   (( segid "    " and resid 85   and name HB1 ))
   (( segid "    " and resid 67   and name HG1 ))
      3.900     1.900     1.900 peak   549 weight  0.10000E+01 volume  0.53726E-03 ppm1      4.041 ppm2      1.372 CV     1
 OR {  549}
   (( segid "    " and resid 85   and name HB1 ))
   (( segid "    " and resid 67   and name HG2 ))
 ASSI {  557}
   (( segid "    " and resid 117  and name HB1 ))
   (( segid "    " and resid 14   and name HD1 ))
      4.300     2.300     1.700 peak   557 weight  0.10000E+01 volume  0.18136E-03 ppm1      3.989 ppm2      3.507 CV     1
 OR {  557}
   (( segid "    " and resid 117  and name HB1 ))
   (( segid "    " and resid 14   and name HD2 ))
 ASSI {  558}
   (( segid "    " and resid 117  and name HB1 ))
   (( segid "    " and resid 14   and name HG2 ))
      4.200     2.200     1.800 peak   558 weight  0.10000E+01 volume  0.16781E-03 ppm1      3.987 ppm2      2.106 CV     1
 ASSI {  561}
   (( segid "    " and resid 71   and name HB2 ))
   (  segid "    " and resid 69   and name HG2%)
      4.300     2.300     1.700 peak   561 weight  0.10000E+01 volume  0.21038E-03 ppm1      3.961 ppm2      1.183 CV     1
 OR {  561}
   (( segid "    " and resid 71   and name HB1 ))
   (  segid "    " and resid 69   and name HG2%)
 ASSI {  562}
   (( segid "    " and resid 71   and name HB1 ))
   (  segid "    " and resid 51   and name HD1%)
      4.800     2.900     1.200 peak   562 weight  0.10000E+01 volume  0.16026E-03 ppm1      3.961 ppm2      0.818 CV     1
 OR {  562}
   (( segid "    " and resid 71   and name HB2 ))
   (  segid "    " and resid 51   and name HD1%)
 ASSI {  575}
   (( segid "    " and resid 88   and name HB2 ))
   (( segid "    " and resid 91   and name HG1 ))
      4.400     2.400     1.600 peak   575 weight  0.10000E+01 volume  0.23049E-03 ppm1      3.940 ppm2      5.829 CV     1
 OR {  575}
   (( segid "    " and resid 88   and name HB1 ))
   (( segid "    " and resid 91   and name HG1 ))
 ASSI {  580}
   (( segid "    " and resid 88   and name HB1 ))
   (  segid "    " and resid 115  and name HG1%)
      4.600     2.700     1.400 peak   580 weight  0.10000E+01 volume  0.26639E-03 ppm1      3.940 ppm2      0.640 CV     1
 OR {  580}
   (( segid "    " and resid 88   and name HB2 ))
   (  segid "    " and resid 115  and name HG1%)
 ASSI {  581}
   (( segid "    " and resid 88   and name HB2 ))
   (  segid "    " and resid 115  and name HG2%)
      3.800     1.800     1.800 peak   581 weight  0.10000E+01 volume  0.58596E-03 ppm1      3.939 ppm2      0.411 CV     1
 OR {  581}
   (( segid "    " and resid 88   and name HB1 ))
   (  segid "    " and resid 115  and name HG2%)
 ASSI {  583}
   (( segid "    " and resid 48   and name HA  ))
   (  segid "    " and resid 61   and name HB% )
      2.400     0.700     0.700 peak   583 weight  0.10000E+01 volume  0.43496E-02 ppm1      3.906 ppm2      1.396 CV     1
 ASSI {  600}
   (( segid "    " and resid 63   and name HB1 ))
   (  segid "    " and resid 64   and name HG1%)
      4.700     2.700     1.300 peak   600 weight  0.10000E+01 volume  0.20311E-03 ppm1      3.817 ppm2      0.193 CV     1
 ASSI {  610}
   (( segid "    " and resid 114  and name HB  ))
   (( segid "    " and resid 11   and name HG  ))
      3.400     1.400     1.400 peak   610 weight  0.10000E+01 volume  0.68231E-03 ppm1      3.880 ppm2      1.458 CV     1
 ASSI {  612}
   (( segid "    " and resid 114  and name HB  ))
   (  segid "    " and resid 11   and name HD2%)
      2.900     1.000     1.000 peak   612 weight  0.10000E+01 volume  0.17140E-02 ppm1      3.879 ppm2      0.827 CV     1
 OR {  612}
   (( segid "    " and resid 114  and name HB  ))
   (  segid "    " and resid 11   and name HD1%)
 ASSI {  613}
   (( segid "    " and resid 114  and name HB  ))
   (  segid "    " and resid 115  and name HG1%)
      4.700     2.800     1.300 peak   613 weight  0.10000E+01 volume  0.17000E-03 ppm1      3.888 ppm2      0.623 CV     1
 ASSI {  614}
   (( segid "    " and resid 57   and name HB1 ))
   (( segid "    " and resid 58   and name HN  ))
      3.600     1.600     1.600 peak   614 weight  0.10000E+01 volume  0.11945E-02 ppm1      3.857 ppm2      7.792 CV     1
 OR {  614}
   (( segid "    " and resid 57   and name HB2 ))
   (( segid "    " and resid 58   and name HN  ))
 ASSI {  617}
   (( segid "    " and resid 14   and name HA  ))
   (  segid "    " and resid 115  and name HG1%)
      4.400     2.400     1.600 peak   617 weight  0.10000E+01 volume  0.22481E-03 ppm1      3.879 ppm2      0.605 CV     1
 ASSI {  619}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 86   and name HB1 ))
      3.800     1.800     1.800 peak   619 weight  0.10000E+01 volume  0.44681E-03 ppm1      3.881 ppm2      1.391 CV     1
 ASSI {  631}
   (( segid "    " and resid 116  and name HB1 ))
   (( segid "    " and resid 11   and name HG  ))
      4.000     2.000     2.000 peak   631 weight  0.10000E+01 volume  0.11342E-03 ppm1      3.792 ppm2      1.472 CV     1
 OR {  631}
   (( segid "    " and resid 116  and name HB1 ))
   (( segid "    " and resid 11   and name HB1 ))
 ASSI {  632}
   (( segid "    " and resid 116  and name HB1 ))
   (  segid "    " and resid 114  and name HG2%)
      3.500     1.500     1.500 peak   632 weight  0.10000E+01 volume  0.73125E-03 ppm1      3.792 ppm2      1.105 CV     1
 ASSI {  633}
   (( segid "    " and resid 116  and name HB1 ))
   (  segid "    " and resid 11   and name HD2%)
      2.900     1.100     1.100 peak   633 weight  0.10000E+01 volume  0.75263E-03 ppm1      3.792 ppm2      0.829 CV     1
 OR {  633}
   (( segid "    " and resid 116  and name HB1 ))
   (  segid "    " and resid 11   and name HD1%)
 ASSI {  634}
   (( segid "    " and resid 49   and name HB1 ))
   (  segid "    " and resid 81   and name HD1%)
      4.100     2.200     1.900 peak   634 weight  0.10000E+01 volume  0.24316E-03 ppm1      3.823 ppm2      0.650 CV     1
 OR {  634}
   (( segid "    " and resid 49   and name HB1 ))
   (( segid "    " and resid 81   and name HB1 ))
 ASSI {  644}
   (( segid "    " and resid 49   and name HB2 ))
   (  segid "    " and resid 81   and name HD1%)
      3.900     1.900     1.900 peak   644 weight  0.10000E+01 volume  0.42426E-03 ppm1      3.545 ppm2      0.653 CV     1
 OR {  644}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 81   and name HB1 ))
 ASSI {  647}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 48   and name HB  ))
      3.100     1.200     1.200 peak   647 weight  0.10000E+01 volume  0.11451E-02 ppm1      3.546 ppm2      1.864 CV     1
 ASSI {  651}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 50   and name HN  ))
      4.300     2.300     1.700 peak   651 weight  0.10000E+01 volume  0.34804E-03 ppm1      3.547 ppm2      8.835 CV     1
 ASSI {  653}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 36   and name HB2 ))
      3.700     1.700     1.700 peak   653 weight  0.10000E+01 volume  0.15416E-03 ppm1      3.542 ppm2      2.773 CV     1
 ASSI {  656}
   (( segid "    " and resid 21   and name HB2 ))
   (( segid "    " and resid 22   and name HN  ))
      3.400     1.500     1.500 peak   656 weight  0.10000E+01 volume  0.64267E-03 ppm1      3.601 ppm2      9.158 CV     1
 ASSI {  659}
   (( segid "    " and resid 21   and name HB1 ))
   (  segid "    " and resid 80   and name HD% )
      2.600     0.900     0.900 peak   659 weight  0.10000E+01 volume  0.16698E-02 ppm1      3.781 ppm2      6.934 CV     1
 ASSI {  660}
   (( segid "    " and resid 21   and name HB1 ))
   (  segid "    " and resid 80   and name HE% )
      3.300     1.400     1.400 peak   660 weight  0.10000E+01 volume  0.11374E-02 ppm1      3.785 ppm2      6.755 CV     1
 ASSI {  661}
   (( segid "    " and resid 21   and name HB2 ))
   (  segid "    " and resid 80   and name HD% )
      4.200     2.200     1.800 peak   661 weight  0.10000E+01 volume  0.71037E-03 ppm1      3.602 ppm2      6.912 CV     1
 ASSI {  662}
   (( segid "    " and resid 21   and name HB2 ))
   (  segid "    " and resid 80   and name HE% )
      4.100     2.100     1.900 peak   662 weight  0.10000E+01 volume  0.38613E-03 ppm1      3.608 ppm2      6.741 CV     1
 ASSI {  669}
   (( segid "    " and resid 21   and name HB2 ))
   (  segid "    " and resid 78   and name HG2%)
      3.000     1.100     1.100 peak   669 weight  0.10000E+01 volume  0.13850E-02 ppm1      3.601 ppm2      0.655 CV     1
 ASSI {  672}
   (( segid "    " and resid 94   and name HA  ))
   (( segid "    " and resid 38   and name HA  ))
      2.700     0.900     0.900 peak   672 weight  0.10000E+01 volume  0.16357E-02 ppm1      4.904 ppm2      5.784 CV     1
 ASSI {  673}
   (( segid "    " and resid 94   and name HA  ))
   (( segid "    " and resid 95   and name HN  ))
      2.500     0.800     0.800 peak   673 weight  0.10000E+01 volume  0.23801E-02 ppm1      4.902 ppm2      9.376 CV     1
 ASSI {  679}
   (( segid "    " and resid 50   and name HB  ))
   (( segid "    " and resid 59   and name HB1 ))
      3.500     1.500     1.500 peak   679 weight  0.10000E+01 volume  0.67261E-03 ppm1      4.127 ppm2      2.830 CV     1
 ASSI {  683}
   (( segid "    " and resid 58   and name HB  ))
   (  segid "    " and resid 60   and name HE% )
      3.600     1.600     1.600 peak   683 weight  0.10000E+01 volume  0.47756E-03 ppm1      3.866 ppm2      6.753 CV     1
 ASSI {  687}
   (( segid "    " and resid 58   and name HB  ))
   (( segid "    " and resid 51   and name HG11))
      5.400     3.600     0.600 peak   687 weight  0.10000E+01 volume  0.11183E-03 ppm1      3.865 ppm2      1.626 CV     1
 OR {  687}
   (( segid "    " and resid 58   and name HB  ))
   (( segid "    " and resid 51   and name HB  ))
 ASSI {  690}
   (( segid "    " and resid 69   and name HB  ))
   (( segid "    " and resid 82   and name HG1 ))
      4.300     2.300     1.700 peak   690 weight  0.10000E+01 volume  0.21940E-03 ppm1      3.822 ppm2      2.343 CV     1
 ASSI {  691}
   (( segid "    " and resid 69   and name HB  ))
   (( segid "    " and resid 82   and name HB1 ))
      2.500     0.800     0.800 peak   691 weight  0.10000E+01 volume  0.39480E-02 ppm1      3.820 ppm2      1.941 CV     1
 OR {  691}
   (( segid "    " and resid 69   and name HB  ))
   (( segid "    " and resid 82   and name HB2 ))
 OR {  691}
   (( segid "    " and resid 69   and name HB  ))
   (( segid "    " and resid 82   and name HG2 ))
 ASSI {  695}
   (( segid "    " and resid 111  and name HB  ))
   (  segid "    " and resid 6    and name HB% )
      3.200     1.300     1.300 peak   695 weight  0.10000E+01 volume  0.85616E-03 ppm1      3.730 ppm2      1.769 CV     1
 ASSI {  700}
   (( segid "    " and resid 17   and name HB2 ))
   (( segid "    " and resid 18   and name HN  ))
      4.400     2.400     1.600 peak   700 weight  0.10000E+01 volume  0.47844E-03 ppm1      3.769 ppm2      8.632 CV     1
 ASSI {  702}
   (( segid "    " and resid 17   and name HB2 ))
   (( segid "    " and resid 82   and name HE22))
      4.000     2.000     2.000 peak   702 weight  0.10000E+01 volume  0.59029E-03 ppm1      3.770 ppm2      6.919 CV     1
 OR {  702}
   (( segid "    " and resid 17   and name HB2 ))
   (( segid "    " and resid 82   and name HE21))
 ASSI {  705}
   (( segid "    " and resid 17   and name HB2 ))
   (( segid "    " and resid 84   and name HA  ))
      3.200     1.300     1.300 peak   705 weight  0.10000E+01 volume  0.60597E-03 ppm1      3.765 ppm2      5.130 CV     1
 ASSI {  709}
   (( segid "    " and resid 17   and name HB1 ))
   (  segid "    " and resid 86   and name HD1%)
      5.500     3.800     0.500 peak   709 weight  0.10000E+01 volume  0.93351E-04 ppm1      3.674 ppm2      0.512 CV     1
 ASSI {  712}
   (( segid "    " and resid 17   and name HB1 ))
   (( segid "    " and resid 84   and name HA  ))
      4.200     2.300     1.800 peak   712 weight  0.10000E+01 volume  0.39971E-03 ppm1      3.674 ppm2      5.127 CV     1
 ASSI {  714}
   (( segid "    " and resid 17   and name HB1 ))
   (( segid "    " and resid 82   and name HE22))
      3.500     1.500     1.500 peak   714 weight  0.10000E+01 volume  0.46924E-03 ppm1      3.674 ppm2      6.914 CV     1
 OR {  714}
   (( segid "    " and resid 17   and name HB1 ))
   (( segid "    " and resid 82   and name HE21))
 ASSI {  716}
   (( segid "    " and resid 17   and name HB1 ))
   (( segid "    " and resid 18   and name HN  ))
      3.600     1.700     1.700 peak   716 weight  0.10000E+01 volume  0.55234E-03 ppm1      3.675 ppm2      8.632 CV     1
 ASSI {  720}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 39   and name HB2 ))
      2.900     1.100     1.100 peak   720 weight  0.10000E+01 volume  0.96180E-03 ppm1      4.224 ppm2      1.760 CV     1
 ASSI {  723}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 39   and name HG1 ))
      4.200     2.200     1.800 peak   723 weight  0.10000E+01 volume  0.42686E-03 ppm1      4.223 ppm2      2.234 CV     1
 OR {  723}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 39   and name HB1 ))
 ASSI {  724}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 39   and name HA  ))
      3.500     1.500     1.500 peak   724 weight  0.10000E+01 volume  0.50037E-03 ppm1      4.229 ppm2      4.904 CV     1
 ASSI {  737}
   (( segid "    " and resid 44   and name HA2 ))
   (( segid "    " and resid 43   and name HB1 ))
      4.800     2.800     1.200 peak   737 weight  0.10000E+01 volume  0.21618E-03 ppm1      4.258 ppm2      2.002 CV     1
 OR {  737}
   (( segid "    " and resid 44   and name HA2 ))
   (( segid "    " and resid 43   and name HB2 ))
 ASSI {  738}
   (( segid "    " and resid 44   and name HA2 ))
   (( segid "    " and resid 45   and name HB2 ))
      4.500     2.500     1.500 peak   738 weight  0.10000E+01 volume  0.31560E-03 ppm1      4.262 ppm2      1.383 CV     1
 ASSI {  739}
   (( segid "    " and resid 44   and name HA2 ))
   (( segid "    " and resid 39   and name HE21))
      4.400     2.400     1.600 peak   739 weight  0.10000E+01 volume  0.34168E-03 ppm1      4.258 ppm2      7.650 CV     1
 ASSI {  740}
   (( segid "    " and resid 44   and name HA1 ))
   (( segid "    " and resid 43   and name HB1 ))
      4.500     2.600     1.500 peak   740 weight  0.10000E+01 volume  0.28357E-03 ppm1      3.745 ppm2      2.019 CV     1
 ASSI {  741}
   (( segid "    " and resid 44   and name HA1 ))
   (( segid "    " and resid 45   and name HB2 ))
      4.200     2.200     1.800 peak   741 weight  0.10000E+01 volume  0.44715E-03 ppm1      3.737 ppm2      1.388 CV     1
 ASSI {  742}
   (( segid "    " and resid 16   and name HA2 ))
   (  segid "    " and resid 86   and name HD1%)
      4.500     2.500     1.500 peak   742 weight  0.10000E+01 volume  0.30178E-03 ppm1      4.283 ppm2      0.505 CV     1
 ASSI {  743}
   (( segid "    " and resid 16   and name HA2 ))
   (  segid "    " and resid 12   and name HG2%)
      4.300     2.400     1.700 peak   743 weight  0.10000E+01 volume  0.81973E-03 ppm1      4.285 ppm2      0.808 CV     1
 OR {  743}
   (( segid "    " and resid 16   and name HA2 ))
   (  segid "    " and resid 12   and name HG1%)
 ASSI {  747}
   (( segid "    " and resid 16   and name HA1 ))
   (  segid "    " and resid 86   and name HD1%)
      5.000     3.100     1.000 peak   747 weight  0.10000E+01 volume  0.98566E-04 ppm1      3.714 ppm2      0.520 CV     1
 ASSI {  748}
   (( segid "    " and resid 16   and name HA1 ))
   (  segid "    " and resid 12   and name HG2%)
      2.800     1.000     1.000 peak   748 weight  0.10000E+01 volume  0.16111E-02 ppm1      3.715 ppm2      0.812 CV     1
 OR {  748}
   (( segid "    " and resid 16   and name HA1 ))
   (  segid "    " and resid 12   and name HG1%)
 ASSI {  749}
   (( segid "    " and resid 16   and name HA1 ))
   (( segid "    " and resid 12   and name HB  ))
      4.100     2.100     1.900 peak   749 weight  0.10000E+01 volume  0.28272E-03 ppm1      3.716 ppm2      1.858 CV     1
 ASSI {  750}
   (( segid "    " and resid 16   and name HA1 ))
   (( segid "    " and resid 17   and name HN  ))
      2.700     0.900     0.900 peak   750 weight  0.10000E+01 volume  0.20572E-02 ppm1      3.718 ppm2      7.845 CV     1
 ASSI {  755}
   (( segid "    " and resid 102  and name HA1 ))
   (( segid "    " and resid 103  and name HN  ))
      4.300     2.300     1.700 peak   755 weight  0.10000E+01 volume  0.13513E-03 ppm1      3.570 ppm2      7.654 CV     1
 ASSI {  757}
   (( segid "    " and resid 102  and name HA1 ))
   (( segid "    " and resid 99   and name HB2 ))
      5.700     4.000     0.300 peak   757 weight  0.10000E+01 volume  0.39590E-04 ppm1      3.560 ppm2      2.725 CV     1
 OR {  757}
   (( segid "    " and resid 102  and name HA1 ))
   (( segid "    " and resid 99   and name HB1 ))
 ASSI {  765}
   (( segid "    " and resid 10   and name HA2 ))
   (( segid "    " and resid 11   and name HN  ))
      2.600     0.900     0.900 peak   765 weight  0.10000E+01 volume  0.21328E-02 ppm1      4.077 ppm2      8.091 CV     1
 ASSI {  767}
   (( segid "    " and resid 10   and name HA1 ))
   (( segid "    " and resid 11   and name HN  ))
      3.000     1.200     1.200 peak   767 weight  0.10000E+01 volume  0.23915E-02 ppm1      4.003 ppm2      8.092 CV     1
 ASSI {  769}
   (( segid "    " and resid 10   and name HA2 ))
   (( segid "    " and resid 11   and name HB2 ))
      6.000     4.500     0.000 peak   769 weight  0.10000E+01 volume  0.11133E-03 ppm1      4.075 ppm2      1.660 CV     1
 ASSI {  770}
   (( segid "    " and resid 10   and name HA2 ))
   (( segid "    " and resid 11   and name HB1 ))
      4.700     2.800     1.300 peak   770 weight  0.10000E+01 volume  0.20188E-03 ppm1      4.082 ppm2      1.429 CV     1
 OR {  770}
   (( segid "    " and resid 10   and name HA2 ))
   (( segid "    " and resid 11   and name HG  ))
 ASSI {  772}
   (( segid "    " and resid 10   and name HA1 ))
   (  segid "    " and resid 18   and name HD2%)
      3.400     1.500     1.500 peak   772 weight  0.10000E+01 volume  0.48331E-03 ppm1      4.002 ppm2      0.807 CV     1
 ASSI {  773}
   (( segid "    " and resid 10   and name HA1 ))
   (( segid "    " and resid 11   and name HB1 ))
      5.000     3.100     1.000 peak   773 weight  0.10000E+01 volume  0.25672E-03 ppm1      4.003 ppm2      1.437 CV     1
 OR {  773}
   (( segid "    " and resid 10   and name HA1 ))
   (( segid "    " and resid 11   and name HG  ))
 ASSI {  775}
   (( segid "    " and resid 10   and name HA1 ))
   (  segid "    " and resid 18   and name HD1%)
      3.900     1.900     1.900 peak   775 weight  0.10000E+01 volume  0.21856E-03 ppm1      4.022 ppm2      0.651 CV     1
 ASSI {  778}
   (( segid "    " and resid 9    and name HA1 ))
   (( segid "    " and resid 10   and name HN  ))
      3.300     1.400     1.400 peak   778 weight  0.10000E+01 volume  0.12790E-02 ppm1      3.907 ppm2      7.120 CV     1
 ASSI {  781}
   (( segid "    " and resid 9    and name HA1 ))
   (  segid "    " and resid 20   and name HG1%)
      4.000     2.000     2.000 peak   781 weight  0.10000E+01 volume  0.63609E-03 ppm1      3.907 ppm2      0.289 CV     1
 ASSI {  783}
   (( segid "    " and resid 9    and name HA1 ))
   (  segid "    " and resid 113  and name HG1%)
      3.800     1.800     1.800 peak   783 weight  0.10000E+01 volume  0.11206E-02 ppm1      3.910 ppm2      0.519 CV     1
 ASSI {  791}
   (( segid "    " and resid 66   and name HA2 ))
   (( segid "    " and resid 67   and name HD2 ))
      4.600     2.700     1.400 peak   791 weight  0.10000E+01 volume  0.24888E-03 ppm1      3.542 ppm2      3.275 CV     1
 OR {  791}
   (( segid "    " and resid 66   and name HA2 ))
   (( segid "    " and resid 67   and name HD1 ))
 ASSI {  792}
   (( segid "    " and resid 9    and name HA2 ))
   (  segid "    " and resid 20   and name HG1%)
      3.400     1.500     1.500 peak   792 weight  0.10000E+01 volume  0.88660E-03 ppm1      3.541 ppm2      0.299 CV     1
 ASSI {  795}
   (( segid "    " and resid 9    and name HA2 ))
   (  segid "    " and resid 11   and name HD1%)
      3.900     1.900     1.900 peak   795 weight  0.10000E+01 volume  0.55565E-03 ppm1      3.539 ppm2      0.821 CV     1
 OR {  795}
   (( segid "    " and resid 9    and name HA2 ))
   (  segid "    " and resid 11   and name HD2%)
 ASSI {  796}
   (( segid "    " and resid 9    and name HA2 ))
   (  segid "    " and resid 111  and name HG2%)
      3.400     1.500     1.500 peak   796 weight  0.10000E+01 volume  0.77963E-03 ppm1      3.544 ppm2      1.045 CV     1
 ASSI {  799}
   (( segid "    " and resid 66   and name HA2 ))
   (( segid "    " and resid 65   and name HB1 ))
      3.400     1.500     1.500 peak   799 weight  0.10000E+01 volume  0.42664E-03 ppm1      3.535 ppm2      1.811 CV     1
 OR {  799}
   (( segid "    " and resid 66   and name HA2 ))
   (( segid "    " and resid 65   and name HB2 ))
 OR {  799}
   (( segid "    " and resid 66   and name HA2 ))
   (( segid "    " and resid 65   and name HD1 ))
 ASSI {  803}
   (( segid "    " and resid 110  and name HA1 ))
   (  segid "    " and resid 93   and name HG2%)
      3.300     1.300     1.300 peak   803 weight  0.10000E+01 volume  0.80088E-03 ppm1      4.507 ppm2      0.354 CV     1
 ASSI {  811}
   (  segid "    " and resid 70   and name HG2%)
   (  segid "    " and resid 81   and name HD1%)
      4.300     2.300     1.700 peak   811 weight  0.10000E+01 volume  0.40997E-03 ppm1      1.031 ppm2      0.658 CV     1
 OR {  811}
   (  segid "    " and resid 70   and name HG2%)
   (( segid "    " and resid 81   and name HB1 ))
 ASSI {  813}
   (  segid "    " and resid 70   and name HG2%)
   (( segid "    " and resid 71   and name HN  ))
      5.300     3.500     0.700 peak   813 weight  0.10000E+01 volume  0.13598E-03 ppm1      1.031 ppm2      8.511 CV     1
 ASSI {  814}
   (  segid "    " and resid 70   and name HG2%)
   (( segid "    " and resid 59   and name HN  ))
      4.600     2.700     1.400 peak   814 weight  0.10000E+01 volume  0.11165E-03 ppm1      1.031 ppm2      8.250 CV     1
 ASSI {  816}
   (  segid "    " and resid 70   and name HG2%)
   (  segid "    " and resid 60   and name HE% )
      3.400     1.500     1.500 peak   816 weight  0.10000E+01 volume  0.63453E-03 ppm1      1.030 ppm2      6.762 CV     1
 ASSI {  822}
   (  segid "    " and resid 70   and name HG2%)
   (( segid "    " and resid 51   and name HB  ))
      3.000     1.100     1.100 peak   822 weight  0.10000E+01 volume  0.14866E-02 ppm1      1.033 ppm2      1.627 CV     1
 OR {  822}
   (  segid "    " and resid 70   and name HG2%)
   (( segid "    " and resid 51   and name HG11))
 ASSI {  824}
   (  segid "    " and resid 70   and name HG2%)
   (( segid "    " and resid 49   and name HB2 ))
      4.700     2.800     1.300 peak   824 weight  0.10000E+01 volume  0.17785E-03 ppm1      1.039 ppm2      3.572 CV     1
 ASSI {  825}
   (  segid "    " and resid 34   and name HE% )
   (( segid "    " and resid 35   and name HN  ))
      4.400     2.400     1.600 peak   825 weight  0.10000E+01 volume  0.48901E-03 ppm1      1.766 ppm2      9.164 CV     1
 ASSI {  827}
   (  segid "    " and resid 34   and name HE% )
   (( segid "    " and resid 98   and name HN  ))
      4.900     3.000     1.100 peak   827 weight  0.10000E+01 volume  0.21276E-03 ppm1      1.764 ppm2      8.113 CV     1
 ASSI {  828}
   (  segid "    " and resid 34   and name HE% )
   (  segid "    " and resid 29   and name HD% )
      2.700     0.900     0.900 peak   828 weight  0.10000E+01 volume  0.27891E-02 ppm1      1.766 ppm2      7.193 CV     1
 OR {  828}
   (  segid "    " and resid 34   and name HE% )
   (  segid "    " and resid 29   and name HE% )
 ASSI {  830}
   (  segid "    " and resid 34   and name HE% )
   (( segid "    " and resid 98   and name HA  ))
      4.200     2.200     1.800 peak   830 weight  0.10000E+01 volume  0.57851E-03 ppm1      1.765 ppm2      5.082 CV     1
 ASSI {  832}
   (  segid "    " and resid 34   and name HE% )
   (( segid "    " and resid 29   and name HA  ))
      4.100     2.100     1.900 peak   832 weight  0.10000E+01 volume  0.23046E-03 ppm1      1.769 ppm2      4.287 CV     1
 ASSI {  833}
   (  segid "    " and resid 34   and name HE% )
   (( segid "    " and resid 32   and name HB1 ))
      4.600     2.600     1.400 peak   833 weight  0.10000E+01 volume  0.91608E-04 ppm1      1.770 ppm2      3.255 CV     1
 ASSI {  835}
   (  segid "    " and resid 34   and name HE% )
   (( segid "    " and resid 32   and name HB2 ))
      4.900     3.000     1.100 peak   835 weight  0.10000E+01 volume  0.22790E-03 ppm1      1.769 ppm2      2.690 CV     1
 ASSI {  837}
   (  segid "    " and resid 34   and name HE% )
   (( segid "    " and resid 98   and name HB1 ))
      3.000     1.100     1.100 peak   837 weight  0.10000E+01 volume  0.17310E-02 ppm1      1.767 ppm2      1.412 CV     1
 OR {  837}
   (  segid "    " and resid 34   and name HE% )
   (( segid "    " and resid 98   and name HB2 ))
 ASSI {  840}
   (  segid "    " and resid 34   and name HE% )
   (( segid "    " and resid 98   and name HD2 ))
      2.700     0.900     0.900 peak   840 weight  0.10000E+01 volume  0.36845E-02 ppm1      1.766 ppm2      0.640 CV     1
 ASSI {  841}
   (  segid "    " and resid 34   and name HE% )
   (( segid "    " and resid 98   and name HD1 ))
      2.600     0.900     0.900 peak   841 weight  0.10000E+01 volume  0.21480E-02 ppm1      1.766 ppm2      0.402 CV     1
 ASSI {  842}
   (  segid "    " and resid 70   and name HD1%)
   (  segid "    " and resid 81   and name HD2%)
      4.800     2.800     1.200 peak   842 weight  0.10000E+01 volume  0.99813E-04 ppm1      1.078 ppm2      0.161 CV     1
 ASSI {  844}
   (  segid "    " and resid 70   and name HD1%)
   (  segid "    " and resid 81   and name HD1%)
      3.500     1.600     1.600 peak   844 weight  0.10000E+01 volume  0.73263E-03 ppm1      1.079 ppm2      0.648 CV     1
 OR {  844}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 81   and name HB1 ))
 ASSI {  847}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 51   and name HB  ))
      2.700     0.900     0.900 peak   847 weight  0.10000E+01 volume  0.19449E-02 ppm1      1.078 ppm2      1.635 CV     1
 OR {  847}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 51   and name HG11))
 ASSI {  850}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 36   and name HB2 ))
      4.200     2.200     1.800 peak   850 weight  0.10000E+01 volume  0.25803E-03 ppm1      1.077 ppm2      2.771 CV     1
 ASSI {  851}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 49   and name HB2 ))
      3.700     1.700     1.700 peak   851 weight  0.10000E+01 volume  0.50654E-03 ppm1      1.076 ppm2      3.532 CV     1
 ASSI {  852}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 49   and name HB1 ))
      3.500     1.600     1.600 peak   852 weight  0.10000E+01 volume  0.58753E-03 ppm1      1.078 ppm2      3.822 CV     1
 ASSI {  858}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 36   and name HE1 ))
      3.700     1.700     1.700 peak   858 weight  0.10000E+01 volume  0.51900E-03 ppm1      1.079 ppm2      7.895 CV     1
 ASSI {  866}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 34   and name HN  ))
      3.600     1.600     1.600 peak   866 weight  0.10000E+01 volume  0.38099E-03 ppm1      0.968 ppm2      8.032 CV     1
 ASSI {  868}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 36   and name HD1 ))
      5.100     3.300     0.900 peak   868 weight  0.10000E+01 volume  0.14100E-03 ppm1      0.967 ppm2      6.959 CV     1
 ASSI {  870}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 50   and name HA  ))
      4.000     2.000     2.000 peak   870 weight  0.10000E+01 volume  0.74334E-03 ppm1      0.968 ppm2      5.555 CV     1
 ASSI {  876}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 34   and name HG1 ))
      3.500     1.500     1.500 peak   876 weight  0.10000E+01 volume  0.54558E-03 ppm1      0.969 ppm2      2.439 CV     1
 OR {  876}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 34   and name HG2 ))
 ASSI {  877}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 70   and name HG11))
      4.600     2.600     1.400 peak   877 weight  0.10000E+01 volume  0.31857E-03 ppm1      0.969 ppm2      2.204 CV     1
 ASSI {  880}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 70   and name HG12))
      2.700     0.900     0.900 peak   880 weight  0.10000E+01 volume  0.24831E-02 ppm1      0.969 ppm2      1.248 CV     1
 ASSI {  881}
   (  segid "    " and resid 51   and name HG2%)
   (  segid "    " and resid 79   and name HD1%)
      3.500     1.500     1.500 peak   881 weight  0.10000E+01 volume  0.53749E-03 ppm1      0.969 ppm2      0.399 CV     1
 ASSI {  889}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 70   and name HG11))
      4.900     3.000     1.100 peak   889 weight  0.10000E+01 volume  0.26469E-03 ppm1      0.840 ppm2      2.192 CV     1
 ASSI {  907}
   (  segid "    " and resid 83   and name HE% )
   (  segid "    " and resid 81   and name HD2%)
      3.100     1.200     1.200 peak   907 weight  0.10000E+01 volume  0.15249E-02 ppm1      0.952 ppm2      0.135 CV     1
 ASSI {  908}
   (  segid "    " and resid 83   and name HE% )
   (  segid "    " and resid 20   and name HG1%)
      2.600     0.900     0.900 peak   908 weight  0.10000E+01 volume  0.28919E-02 ppm1      0.952 ppm2      0.295 CV     1
 ASSI {  912}
   (  segid "    " and resid 83   and name HE% )
   (( segid "    " and resid 20   and name HB  ))
      4.100     2.100     1.900 peak   912 weight  0.10000E+01 volume  0.59328E-03 ppm1      0.954 ppm2      2.087 CV     1
 ASSI {  913}
   (  segid "    " and resid 83   and name HE% )
   (( segid "    " and resid 113  and name HB  ))
      4.000     2.000     2.000 peak   913 weight  0.10000E+01 volume  0.38852E-03 ppm1      0.952 ppm2      2.335 CV     1
 ASSI {  920}
   (  segid "    " and resid 83   and name HE% )
   (  segid "    " and resid 94   and name HE% )
      3.200     1.300     1.300 peak   920 weight  0.10000E+01 volume  0.92841E-03 ppm1      0.949 ppm2      6.783 CV     1
 ASSI {  921}
   (  segid "    " and resid 83   and name HE% )
   (  segid "    " and resid 94   and name HD% )
      3.100     1.200     1.200 peak   921 weight  0.10000E+01 volume  0.13726E-02 ppm1      0.951 ppm2      6.964 CV     1
 ASSI {  924}
   (  segid "    " and resid 83   and name HE% )
   (( segid "    " and resid 94   and name HH  ))
      4.800     2.900     1.200 peak   924 weight  0.10000E+01 volume  0.15402E-03 ppm1      0.949 ppm2     10.256 CV     1
 ASSI {  925}
   (  segid "    " and resid 83   and name HE% )
   (( segid "    " and resid 19   and name HA  ))
      4.400     2.400     1.600 peak   925 weight  0.10000E+01 volume  0.13556E-03 ppm1      0.953 ppm2      5.136 CV     1
 ASSI {  926}
   (  segid "    " and resid 83   and name HE% )
   (( segid "    " and resid 9    and name HA2 ))
      5.300     3.500     0.700 peak   926 weight  0.10000E+01 volume  0.78432E-04 ppm1      0.955 ppm2      3.529 CV     1
 ASSI {  929}
   (( segid "    " and resid 42   and name HA2 ))
   (( segid "    " and resid 43   and name HN  ))
      3.900     1.900     1.900 peak   929 weight  0.10000E+01 volume  0.32478E-03 ppm1      3.756 ppm2      7.927 CV     1
 ASSI {  933}
   (( segid "    " and resid 26   and name HA1 ))
   (  segid "    " and resid 2    and name HG2%)
      5.400     3.600     0.600 peak   933 weight  0.10000E+01 volume  0.43666E-04 ppm1      3.771 ppm2      0.768 CV     1
 OR {  933}
   (( segid "    " and resid 26   and name HA1 ))
   (  segid "    " and resid 2    and name HG1%)
 ASSI {  934}
   (( segid "    " and resid 42   and name HA2 ))
   (( segid "    " and resid 43   and name HG1 ))
      5.200     3.400     0.800 peak   934 weight  0.10000E+01 volume  0.85183E-04 ppm1      3.760 ppm2      1.428 CV     1
 ASSI {  942}
   (( segid "    " and resid 77   and name HA  ))
   (( segid "    " and resid 76   and name HD1 ))
      5.400     3.600     0.600 peak   942 weight  0.10000E+01 volume  0.84162E-04 ppm1      3.758 ppm2      1.659 CV     1
 OR {  942}
   (( segid "    " and resid 77   and name HA  ))
   (( segid "    " and resid 76   and name HD2 ))
 ASSI {  944}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 86   and name HN  ))
      3.500     1.500     1.500 peak   944 weight  0.10000E+01 volume  0.43839E-03 ppm1      3.635 ppm2      8.190 CV     1
 ASSI {  945}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 15   and name HA2 ))
      3.300     1.400     1.400 peak   945 weight  0.10000E+01 volume  0.53284E-03 ppm1      3.637 ppm2      4.375 CV     1
 ASSI {  946}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 84   and name HA  ))
      5.100     3.200     0.900 peak   946 weight  0.10000E+01 volume  0.36399E-03 ppm1      3.640 ppm2      5.135 CV     1
 ASSI {  948}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 84   and name HB1 ))
      4.800     2.900     1.200 peak   948 weight  0.10000E+01 volume  0.24611E-03 ppm1      3.638 ppm2      2.776 CV     1
 ASSI {  949}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 86   and name HB2 ))
      5.600     3.900     0.400 peak   949 weight  0.10000E+01 volume  0.13063E-03 ppm1      3.642 ppm2      1.281 CV     1
 OR {  949}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 86   and name HG  ))
 ASSI {  951}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 15   and name HN  ))
      5.000     3.200     1.000 peak   951 weight  0.10000E+01 volume  0.83380E-04 ppm1      3.644 ppm2      9.752 CV     1
 ASSI {  952}
   (( segid "    " and resid 65   and name HA  ))
   (  segid "    " and resid 64   and name HG2%)
      4.200     2.200     1.800 peak   952 weight  0.10000E+01 volume  0.42865E-03 ppm1      3.630 ppm2      0.834 CV     1
 ASSI {  953}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 64   and name HB  ))
      4.600     2.700     1.400 peak   953 weight  0.10000E+01 volume  0.15557E-03 ppm1      3.636 ppm2      1.040 CV     1
 ASSI {  956}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 60   and name HB1 ))
      3.800     1.800     1.800 peak   956 weight  0.10000E+01 volume  0.33931E-03 ppm1      3.634 ppm2      2.485 CV     1
 ASSI {  961}
   (( segid "    " and resid 65   and name HA  ))
   (  segid "    " and resid 60   and name HD% )
      3.800     1.800     1.800 peak   961 weight  0.10000E+01 volume  0.35852E-03 ppm1      3.635 ppm2      7.065 CV     1
 ASSI {  965}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 66   and name HN  ))
      3.700     1.700     1.700 peak   965 weight  0.10000E+01 volume  0.37450E-03 ppm1      3.631 ppm2      9.102 CV     1
 ASSI {  968}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 86   and name HN  ))
      6.000     4.900     0.000 peak   968 weight  0.10000E+01 volume  0.28500E-04 ppm1      3.707 ppm2      8.155 CV     1
 ASSI {  969}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 67   and name HE  ))
      5.000     3.200     1.000 peak   969 weight  0.10000E+01 volume  0.82971E-04 ppm1      3.710 ppm2      6.735 CV     1
 ASSI {  970}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 67   and name HG1 ))
      3.200     1.300     1.300 peak   970 weight  0.10000E+01 volume  0.53307E-03 ppm1      3.708 ppm2      1.341 CV     1
 ASSI {  972}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 67   and name HB2 ))
      4.200     2.200     1.800 peak   972 weight  0.10000E+01 volume  0.32708E-03 ppm1      3.709 ppm2      2.191 CV     1
 ASSI {  973}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 67   and name HD1 ))
      3.100     1.200     1.200 peak   973 weight  0.10000E+01 volume  0.10347E-02 ppm1      3.708 ppm2      3.296 CV     1
 OR {  973}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 67   and name HD2 ))
 ASSI {  976}
   (( segid "    " and resid 100  and name HB2 ))
   (( segid "    " and resid 105  and name HB2 ))
      3.300     1.400     1.400 peak   976 weight  0.10000E+01 volume  0.55046E-03 ppm1      3.727 ppm2      2.389 CV     1
 OR {  976}
   (( segid "    " and resid 100  and name HB2 ))
   (( segid "    " and resid 105  and name HB1 ))
 OR {  976}
   (( segid "    " and resid 100  and name HB1 ))
   (( segid "    " and resid 105  and name HB2 ))
 OR {  976}
   (( segid "    " and resid 100  and name HB1 ))
   (( segid "    " and resid 105  and name HB1 ))
 ASSI {  980}
   (( segid "    " and resid 31   and name HB1 ))
   (  segid "    " and resid 32   and name HD% )
      3.900     1.900     1.900 peak   980 weight  0.10000E+01 volume  0.40270E-03 ppm1      3.692 ppm2      7.398 CV     1
 OR {  980}
   (( segid "    " and resid 31   and name HB2 ))
   (  segid "    " and resid 32   and name HD% )
 ASSI {  986}
   (( segid "    " and resid 116  and name HB2 ))
   (  segid "    " and resid 11   and name HD2%)
      2.800     1.000     1.000 peak   986 weight  0.10000E+01 volume  0.89585E-03 ppm1      3.548 ppm2      0.834 CV     1
 OR {  986}
   (( segid "    " and resid 116  and name HB2 ))
   (  segid "    " and resid 11   and name HD1%)
 ASSI {  988}
   (( segid "    " and resid 116  and name HB2 ))
   (( segid "    " and resid 11   and name HG  ))
      3.800     1.800     1.800 peak   988 weight  0.10000E+01 volume  0.16110E-03 ppm1      3.551 ppm2      1.465 CV     1
 OR {  988}
   (( segid "    " and resid 116  and name HB2 ))
   (( segid "    " and resid 11   and name HB1 ))
 ASSI {  991}
   (( segid "    " and resid 116  and name HB2 ))
   (( segid "    " and resid 115  and name HA  ))
      4.300     2.400     1.700 peak   991 weight  0.10000E+01 volume  0.50341E-03 ppm1      3.550 ppm2      4.824 CV     1
 ASSI {  994}
   (( segid "    " and resid 78   and name HB  ))
   (( segid "    " and resid 76   and name HG1 ))
      3.600     1.600     1.600 peak   994 weight  0.10000E+01 volume  0.60045E-03 ppm1      3.485 ppm2      1.425 CV     1
 OR {  994}
   (( segid "    " and resid 78   and name HB  ))
   (( segid "    " and resid 76   and name HG2 ))
 OR {  994}
   (( segid "    " and resid 78   and name HB  ))
   (( segid "    " and resid 76   and name HB2 ))
 ASSI {  995}
   (( segid "    " and resid 78   and name HB  ))
   (( segid "    " and resid 76   and name HD1 ))
      4.900     2.900     1.100 peak   995 weight  0.10000E+01 volume  0.10784E-03 ppm1      3.478 ppm2      1.633 CV     1
 OR {  995}
   (( segid "    " and resid 78   and name HB  ))
   (( segid "    " and resid 76   and name HD2 ))
 ASSI {  997}
   (( segid "    " and resid 78   and name HB  ))
   (( segid "    " and resid 73   and name HB2 ))
      3.700     1.700     1.700 peak   997 weight  0.10000E+01 volume  0.40576E-03 ppm1      3.487 ppm2      2.667 CV     1
 ASSI { 1002}
   (( segid "    " and resid 78   and name HB  ))
   (( segid "    " and resid 79   and name HN  ))
      4.300     2.300     1.700 peak  1002 weight  0.10000E+01 volume  0.24555E-03 ppm1      3.482 ppm2      8.468 CV     1
 ASSI { 1006}
   (( segid "    " and resid 59   and name HB2 ))
   (( segid "    " and resid 50   and name HB  ))
      3.600     1.700     1.700 peak  1006 weight  0.10000E+01 volume  0.38371E-03 ppm1      3.395 ppm2      4.114 CV     1
 ASSI { 1017}
   (( segid "    " and resid 67   and name HD1 ))
   (( segid "    " and resid 85   and name HB1 ))
      3.100     1.200     1.200 peak  1017 weight  0.10000E+01 volume  0.14116E-02 ppm1      3.308 ppm2      4.033 CV     1
 OR { 1017}
   (( segid "    " and resid 67   and name HD2 ))
   (( segid "    " and resid 85   and name HB1 ))
 ASSI { 1021}
   (( segid "    " and resid 67   and name HD2 ))
   (  segid "    " and resid 68   and name HD% )
      4.100     2.100     1.900 peak  1021 weight  0.10000E+01 volume  0.94386E-04 ppm1      3.314 ppm2      6.949 CV     1
 OR { 1021}
   (( segid "    " and resid 67   and name HD1 ))
   (  segid "    " and resid 68   and name HD% )
 OR { 1021}
   (( segid "    " and resid 67   and name HD2 ))
   (  segid "    " and resid 68   and name HE% )
 OR { 1021}
   (( segid "    " and resid 67   and name HD1 ))
   (  segid "    " and resid 68   and name HE% )
 ASSI { 1025}
   (( segid "    " and resid 32   and name HB1 ))
   (( segid "    " and resid 98   and name HB2 ))
      3.900     1.900     1.900 peak  1025 weight  0.10000E+01 volume  0.26275E-03 ppm1      3.280 ppm2      1.424 CV     1
 OR { 1025}
   (( segid "    " and resid 32   and name HB1 ))
   (( segid "    " and resid 98   and name HB1 ))
 ASSI { 1026}
   (( segid "    " and resid 32   and name HB1 ))
   (  segid "    " and resid 34   and name HE% )
      3.800     1.800     1.800 peak  1026 weight  0.10000E+01 volume  0.29524E-03 ppm1      3.281 ppm2      1.736 CV     1
 OR { 1026}
   (( segid "    " and resid 32   and name HB1 ))
   (( segid "    " and resid 34   and name HB2 ))
 ASSI { 1027}
   (( segid "    " and resid 32   and name HB1 ))
   (( segid "    " and resid 34   and name HG2 ))
      4.000     2.000     2.000 peak  1027 weight  0.10000E+01 volume  0.19733E-03 ppm1      3.289 ppm2      2.467 CV     1
 OR { 1027}
   (( segid "    " and resid 32   and name HB1 ))
   (( segid "    " and resid 34   and name HG1 ))
 ASSI { 1038}
   (( segid "    " and resid 72   and name HD2 ))
   (  segid "    " and resid 51   and name HG2%)
      3.100     1.200     1.200 peak  1038 weight  0.10000E+01 volume  0.15146E-02 ppm1      3.267 ppm2      0.973 CV     1
 ASSI { 1039}
   (( segid "    " and resid 72   and name HD2 ))
   (  segid "    " and resid 51   and name HD1%)
      3.200     1.300     1.300 peak  1039 weight  0.10000E+01 volume  0.60463E-03 ppm1      3.267 ppm2      0.851 CV     1
 ASSI { 1040}
   (( segid "    " and resid 22   and name HB2 ))
   (  segid "    " and resid 79   and name HD1%)
      4.300     2.300     1.700 peak  1040 weight  0.10000E+01 volume  0.32991E-03 ppm1      3.049 ppm2      0.393 CV     1
 ASSI { 1042}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 79   and name HB2 ))
      3.400     1.400     1.400 peak  1042 weight  0.10000E+01 volume  0.38820E-03 ppm1      3.052 ppm2      1.075 CV     1
 ASSI { 1047}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 6    and name HA  ))
      4.600     2.600     1.400 peak  1047 weight  0.10000E+01 volume  0.36067E-03 ppm1      3.059 ppm2      5.762 CV     1
 ASSI { 1048}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 36   and name HZ2 ))
      3.400     1.500     1.500 peak  1048 weight  0.10000E+01 volume  0.83298E-03 ppm1      3.048 ppm2      6.943 CV     1
 ASSI { 1049}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 23   and name HN  ))
      4.100     2.100     1.900 peak  1049 weight  0.10000E+01 volume  0.37093E-03 ppm1      3.059 ppm2      8.299 CV     1
 ASSI { 1052}
   (( segid "    " and resid 22   and name HB1 ))
   (  segid "    " and resid 79   and name HD1%)
      4.700     2.800     1.300 peak  1052 weight  0.10000E+01 volume  0.27948E-03 ppm1      2.933 ppm2      0.404 CV     1
 ASSI { 1056}
   (( segid "    " and resid 22   and name HB1 ))
   (( segid "    " and resid 96   and name HB1 ))
      4.200     2.200     1.800 peak  1056 weight  0.10000E+01 volume  0.13799E-03 ppm1      2.942 ppm2      2.334 CV     1
 ASSI { 1058}
   (( segid "    " and resid 22   and name HB1 ))
   (( segid "    " and resid 6    and name HA  ))
      3.900     1.900     1.900 peak  1058 weight  0.10000E+01 volume  0.41250E-03 ppm1      2.934 ppm2      5.763 CV     1
 ASSI { 1059}
   (( segid "    " and resid 22   and name HB1 ))
   (( segid "    " and resid 36   and name HZ2 ))
      3.200     1.300     1.300 peak  1059 weight  0.10000E+01 volume  0.76606E-03 ppm1      2.939 ppm2      6.935 CV     1
 ASSI { 1060}
   (( segid "    " and resid 22   and name HB1 ))
   (( segid "    " and resid 23   and name HN  ))
      4.800     2.900     1.200 peak  1060 weight  0.10000E+01 volume  0.21123E-03 ppm1      2.920 ppm2      8.291 CV     1
 ASSI { 1070}
   (( segid "    " and resid 90   and name HB1 ))
   (( segid "    " and resid 94   and name HH  ))
      4.600     2.700     1.400 peak  1070 weight  0.10000E+01 volume  0.28361E-03 ppm1      3.065 ppm2     10.256 CV     1
 ASSI { 1071}
   (( segid "    " and resid 90   and name HB1 ))
   (( segid "    " and resid 87   and name HN  ))
      3.500     1.600     1.600 peak  1071 weight  0.10000E+01 volume  0.39170E-03 ppm1      3.066 ppm2      9.510 CV     1
 ASSI { 1073}
   (( segid "    " and resid 65   and name HE1 ))
   (  segid "    " and resid 60   and name HD% )
      3.900     1.900     1.900 peak  1073 weight  0.10000E+01 volume  0.12604E-03 ppm1      3.082 ppm2      7.067 CV     1
 OR { 1073}
   (( segid "    " and resid 65   and name HE2 ))
   (  segid "    " and resid 60   and name HD% )
 ASSI { 1097}
   (( segid "    " and resid 59   and name HB1 ))
   (  segid "    " and resid 50   and name HG2%)
      3.300     1.400     1.400 peak  1097 weight  0.10000E+01 volume  0.35909E-03 ppm1      2.833 ppm2      1.192 CV     1
 ASSI { 1098}
   (( segid "    " and resid 90   and name HB2 ))
   (( segid "    " and resid 94   and name HH  ))
      3.400     1.400     1.400 peak  1098 weight  0.10000E+01 volume  0.57451E-03 ppm1      2.821 ppm2     10.255 CV     1
 ASSI { 1101}
   (( segid "    " and resid 90   and name HB2 ))
   (( segid "    " and resid 91   and name HN  ))
      5.200     3.400     0.800 peak  1101 weight  0.10000E+01 volume  0.56251E-04 ppm1      2.828 ppm2      7.806 CV     1
 ASSI { 1109}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 61   and name HN  ))
      3.700     1.700     1.700 peak  1109 weight  0.10000E+01 volume  0.36165E-03 ppm1      2.943 ppm2      7.620 CV     1
 ASSI { 1112}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 65   and name HA  ))
      3.800     1.800     1.800 peak  1112 weight  0.10000E+01 volume  0.34670E-03 ppm1      2.944 ppm2      3.612 CV     1
 ASSI { 1114}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 65   and name HD1 ))
      2.900     1.000     1.000 peak  1114 weight  0.10000E+01 volume  0.31142E-02 ppm1      2.945 ppm2      1.805 CV     1
 OR { 1114}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 65   and name HD2 ))
 OR { 1114}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 65   and name HB2 ))
 OR { 1114}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 65   and name HB1 ))
 ASSI { 1116}
   (( segid "    " and resid 60   and name HB2 ))
   (  segid "    " and resid 64   and name HG2%)
      3.400     1.400     1.400 peak  1116 weight  0.10000E+01 volume  0.88237E-03 ppm1      2.948 ppm2      0.842 CV     1
 ASSI { 1122}
   (( segid "    " and resid 72   and name HD1 ))
   (  segid "    " and resid 51   and name HD1%)
      3.300     1.400     1.400 peak  1122 weight  0.10000E+01 volume  0.95549E-03 ppm1      3.013 ppm2      0.853 CV     1
 ASSI { 1123}
   (( segid "    " and resid 72   and name HD1 ))
   (  segid "    " and resid 51   and name HG2%)
      2.900     1.100     1.100 peak  1123 weight  0.10000E+01 volume  0.15879E-02 ppm1      3.012 ppm2      0.964 CV     1
 ASSI { 1133}
   (( segid "    " and resid 74   and name HB1 ))
   (( segid "    " and resid 75   and name HN  ))
      5.200     3.300     0.800 peak  1133 weight  0.10000E+01 volume  0.77080E-04 ppm1      3.017 ppm2      8.485 CV     1
 ASSI { 1136}
   (( segid "    " and resid 74   and name HB1 ))
   (( segid "    " and resid 30   and name HB2 ))
      4.700     2.700     1.300 peak  1136 weight  0.10000E+01 volume  0.14202E-03 ppm1      3.016 ppm2      3.891 CV     1
 OR { 1136}
   (( segid "    " and resid 74   and name HB1 ))
   (( segid "    " and resid 30   and name HB1 ))
 ASSI { 1137}
   (( segid "    " and resid 74   and name HB1 ))
   (  segid "    " and resid 75   and name HB% )
      5.300     3.500     0.700 peak  1137 weight  0.10000E+01 volume  0.10903E-03 ppm1      3.028 ppm2      1.562 CV     1
 ASSI { 1141}
   (( segid "    " and resid 52   and name HB1 ))
   (( segid "    " and resid 51   and name HA  ))
      5.400     3.700     0.600 peak  1141 weight  0.10000E+01 volume  0.93742E-04 ppm1      3.100 ppm2      5.234 CV     1
 ASSI { 1148}
   (( segid "    " and resid 27   and name HB1 ))
   (  segid "    " and resid 2    and name HG2%)
      3.400     1.500     1.500 peak  1148 weight  0.10000E+01 volume  0.11847E-02 ppm1      3.087 ppm2      0.776 CV     1
 OR { 1148}
   (( segid "    " and resid 27   and name HB1 ))
   (  segid "    " and resid 2    and name HG1%)
 ASSI { 1149}
   (( segid "    " and resid 84   and name HB2 ))
   (( segid "    " and resid 85   and name HN  ))
      4.100     2.100     1.900 peak  1149 weight  0.10000E+01 volume  0.58532E-03 ppm1      3.094 ppm2      8.494 CV     1
 ASSI { 1157}
   (( segid "    " and resid 84   and name HB2 ))
   (( segid "    " and resid 67   and name HB2 ))
      5.100     3.300     0.900 peak  1157 weight  0.10000E+01 volume  0.96713E-04 ppm1      3.094 ppm2      2.200 CV     1
 ASSI { 1159}
   (( segid "    " and resid 95   and name HB2 ))
   (( segid "    " and resid 96   and name HN  ))
      4.500     2.500     1.500 peak  1159 weight  0.10000E+01 volume  0.39884E-03 ppm1      3.155 ppm2      8.884 CV     1
 ASSI { 1163}
   (( segid "    " and resid 95   and name HB2 ))
   (  segid "    " and resid 93   and name HG1%)
      3.900     1.900     1.900 peak  1163 weight  0.10000E+01 volume  0.35573E-03 ppm1      3.157 ppm2      0.950 CV     1
 ASSI { 1170}
   (( segid "    " and resid 68   and name HB2 ))
   (  segid "    " and resid 64   and name HG2%)
      3.100     1.200     1.200 peak  1170 weight  0.10000E+01 volume  0.19730E-02 ppm1      2.914 ppm2      0.848 CV     1
 OR { 1170}
   (( segid "    " and resid 68   and name HB1 ))
   (  segid "    " and resid 64   and name HG2%)
 ASSI { 1171}
   (( segid "    " and resid 68   and name HB1 ))
   (  segid "    " and resid 81   and name HD1%)
      3.000     1.100     1.100 peak  1171 weight  0.10000E+01 volume  0.20818E-02 ppm1      2.916 ppm2      0.653 CV     1
 OR { 1171}
   (( segid "    " and resid 68   and name HB2 ))
   (  segid "    " and resid 81   and name HD1%)
 OR { 1171}
   (( segid "    " and resid 68   and name HB1 ))
   (( segid "    " and resid 81   and name HB1 ))
 ASSI { 1172}
   (( segid "    " and resid 68   and name HB2 ))
   (  segid "    " and resid 64   and name HG1%)
      3.300     1.400     1.400 peak  1172 weight  0.10000E+01 volume  0.85620E-03 ppm1      2.913 ppm2      0.164 CV     1
 OR { 1172}
   (( segid "    " and resid 68   and name HB1 ))
   (  segid "    " and resid 64   and name HG1%)
 ASSI { 1177}
   (( segid "    " and resid 94   and name HB2 ))
   (( segid "    " and resid 95   and name HN  ))
      4.900     2.900     1.100 peak  1177 weight  0.10000E+01 volume  0.28741E-03 ppm1      2.922 ppm2      9.390 CV     1
 ASSI { 1180}
   (( segid "    " and resid 94   and name HB1 ))
   (( segid "    " and resid 36   and name HE3 ))
      3.400     1.400     1.400 peak  1180 weight  0.10000E+01 volume  0.52962E-03 ppm1      2.869 ppm2      7.626 CV     1
 ASSI { 1185}
   (( segid "    " and resid 94   and name HB1 ))
   (  segid "    " and resid 111  and name HG2%)
      3.700     1.700     1.700 peak  1185 weight  0.10000E+01 volume  0.84516E-03 ppm1      2.881 ppm2      1.050 CV     1
 ASSI { 1189}
   (( segid "    " and resid 29   and name HB1 ))
   (( segid "    " and resid 30   and name HN  ))
      5.400     3.600     0.600 peak  1189 weight  0.10000E+01 volume  0.14284E-03 ppm1      2.867 ppm2      8.484 CV     1
 ASSI { 1193}
   (( segid "    " and resid 74   and name HB2 ))
   (  segid "    " and resid 75   and name HB% )
      4.300     2.300     1.700 peak  1193 weight  0.10000E+01 volume  0.24792E-03 ppm1      2.920 ppm2      1.546 CV     1
 ASSI { 1194}
   (( segid "    " and resid 74   and name HB2 ))
   (( segid "    " and resid 30   and name HB2 ))
      4.500     2.500     1.500 peak  1194 weight  0.10000E+01 volume  0.18866E-03 ppm1      2.926 ppm2      3.888 CV     1
 OR { 1194}
   (( segid "    " and resid 74   and name HB2 ))
   (( segid "    " and resid 30   and name HB1 ))
 ASSI { 1203}
   (( segid "    " and resid 77   and name HB2 ))
   (  segid "    " and resid 24   and name HB% )
      3.900     1.900     1.900 peak  1203 weight  0.10000E+01 volume  0.36240E-03 ppm1      2.859 ppm2      1.034 CV     1
 ASSI { 1204}
   (( segid "    " and resid 77   and name HB2 ))
   (( segid "    " and resid 76   and name HG2 ))
      5.300     3.500     0.700 peak  1204 weight  0.10000E+01 volume  0.82084E-04 ppm1      2.854 ppm2      1.462 CV     1
 OR { 1204}
   (( segid "    " and resid 77   and name HB2 ))
   (( segid "    " and resid 76   and name HB2 ))
 ASSI { 1210}
   (( segid "    " and resid 80   and name HB1 ))
   (( segid "    " and resid 19   and name HG2 ))
      3.200     1.300     1.300 peak  1210 weight  0.10000E+01 volume  0.64078E-03 ppm1      2.755 ppm2      1.301 CV     1
 OR { 1210}
   (( segid "    " and resid 80   and name HB1 ))
   (( segid "    " and resid 19   and name HG1 ))
 ASSI { 1213}
   (( segid "    " and resid 110  and name HA2 ))
   (  segid "    " and resid 95   and name HE% )
      3.500     1.500     1.500 peak  1213 weight  0.10000E+01 volume  0.76684E-03 ppm1      2.661 ppm2      6.716 CV     1
 ASSI { 1214}
   (( segid "    " and resid 110  and name HA2 ))
   (  segid "    " and resid 95   and name HD% )
      3.300     1.400     1.400 peak  1214 weight  0.10000E+01 volume  0.66281E-03 ppm1      2.661 ppm2      6.906 CV     1
 ASSI { 1218}
   (( segid "    " and resid 110  and name HA2 ))
   (  segid "    " and resid 6    and name HB% )
      3.400     1.400     1.400 peak  1218 weight  0.10000E+01 volume  0.59852E-03 ppm1      2.665 ppm2      1.768 CV     1
 ASSI { 1219}
   (( segid "    " and resid 110  and name HA2 ))
   (  segid "    " and resid 111  and name HG2%)
      4.500     2.500     1.500 peak  1219 weight  0.10000E+01 volume  0.48336E-03 ppm1      2.666 ppm2      0.972 CV     1
 ASSI { 1220}
   (( segid "    " and resid 110  and name HA2 ))
   (  segid "    " and resid 93   and name HG2%)
      3.100     1.200     1.200 peak  1220 weight  0.10000E+01 volume  0.19270E-02 ppm1      2.662 ppm2      0.372 CV     1
 ASSI { 1221}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 76   and name HB2 ))
      3.900     1.900     1.900 peak  1221 weight  0.10000E+01 volume  0.44590E-03 ppm1      2.683 ppm2      1.438 CV     1
 OR { 1221}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 76   and name HG2 ))
 ASSI { 1225}
   (( segid "    " and resid 73   and name HB2 ))
   (  segid "    " and resid 80   and name HE% )
      3.200     1.300     1.300 peak  1225 weight  0.10000E+01 volume  0.76620E-03 ppm1      2.682 ppm2      6.694 CV     1
 ASSI { 1237}
   (( segid "    " and resid 99   and name HB2 ))
   (( segid "    " and resid 104  and name HA  ))
      3.700     1.700     1.700 peak  1237 weight  0.10000E+01 volume  0.37662E-03 ppm1      2.722 ppm2      3.916 CV     1
 ASSI { 1238}
   (( segid "    " and resid 62   and name HB1 ))
   (( segid "    " and resid 65   and name HD1 ))
      3.900     1.900     1.900 peak  1238 weight  0.10000E+01 volume  0.59475E-03 ppm1      2.721 ppm2      1.808 CV     1
 OR { 1238}
   (( segid "    " and resid 62   and name HB1 ))
   (( segid "    " and resid 65   and name HB2 ))
 OR { 1238}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 65   and name HD1 ))
 OR { 1238}
   (( segid "    " and resid 62   and name HB1 ))
   (( segid "    " and resid 65   and name HB1 ))
 OR { 1238}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 65   and name HB2 ))
 OR { 1238}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 65   and name HB1 ))
 OR { 1238}
   (( segid "    " and resid 62   and name HB1 ))
   (( segid "    " and resid 65   and name HD2 ))
 OR { 1238}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 65   and name HD2 ))
 ASSI { 1240}
   (( segid "    " and resid 99   and name HB1 ))
   (  segid "    " and resid 104  and name HD2%)
      3.700     1.700     1.700 peak  1240 weight  0.10000E+01 volume  0.56292E-03 ppm1      2.700 ppm2      0.386 CV     1
 OR { 1240}
   (( segid "    " and resid 99   and name HB2 ))
   (  segid "    " and resid 104  and name HD2%)
 ASSI { 1241}
   (( segid "    " and resid 99   and name HB2 ))
   (( segid "    " and resid 104  and name HB2 ))
      3.500     1.500     1.500 peak  1241 weight  0.10000E+01 volume  0.91705E-03 ppm1      2.722 ppm2      1.215 CV     1
 ASSI { 1242}
   (( segid "    " and resid 62   and name HB1 ))
   (( segid "    " and resid 65   and name HG1 ))
      3.500     1.500     1.500 peak  1242 weight  0.10000E+01 volume  0.12064E-02 ppm1      2.721 ppm2      1.433 CV     1
 OR { 1242}
   (( segid "    " and resid 62   and name HB1 ))
   (( segid "    " and resid 65   and name HG2 ))
 OR { 1242}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 65   and name HG1 ))
 OR { 1242}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 65   and name HG2 ))
 ASSI { 1249}
   (( segid "    " and resid 128  and name HB2 ))
   (  segid "    " and resid 124  and name HD1%)
      3.300     1.400     1.400 peak  1249 weight  0.10000E+01 volume  0.33000E-03 ppm1      2.732 ppm2      0.873 CV     1
 OR { 1249}
   (( segid "    " and resid 128  and name HB2 ))
   (  segid "    " and resid 124  and name HG2%)
 ASSI { 1256}
   (( segid "    " and resid 84   and name HB1 ))
   (( segid "    " and resid 85   and name HB2 ))
      3.600     1.700     1.700 peak  1256 weight  0.10000E+01 volume  0.68102E-03 ppm1      2.774 ppm2      3.658 CV     1
 OR { 1256}
   (( segid "    " and resid 84   and name HB1 ))
   (( segid "    " and resid 85   and name HA  ))
 ASSI { 1262}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 51   and name HA  ))
      4.800     2.900     1.200 peak  1262 weight  0.10000E+01 volume  0.23046E-03 ppm1      2.736 ppm2      5.228 CV     1
 ASSI { 1274}
   (( segid "    " and resid 77   and name HB1 ))
   (  segid "    " and resid 24   and name HB% )
      4.600     2.700     1.400 peak  1274 weight  0.10000E+01 volume  0.28234E-03 ppm1      2.671 ppm2      1.037 CV     1
 ASSI { 1285}
   (( segid "    " and resid 47   and name HB2 ))
   (( segid "    " and resid 48   and name HN  ))
      4.500     2.500     1.500 peak  1285 weight  0.10000E+01 volume  0.38462E-03 ppm1      3.222 ppm2      7.915 CV     1
 OR { 1285}
   (( segid "    " and resid 47   and name HB1 ))
   (( segid "    " and resid 48   and name HN  ))
 ASSI { 1290}
   (( segid "    " and resid 47   and name HB1 ))
   (  segid "    " and resid 48   and name HG2%)
      3.700     1.700     1.700 peak  1290 weight  0.10000E+01 volume  0.11498E-02 ppm1      3.221 ppm2      0.844 CV     1
 OR { 1290}
   (( segid "    " and resid 47   and name HB1 ))
   (  segid "    " and resid 48   and name HG2%)
 OR { 1290}
   (( segid "    " and resid 47   and name HB2 ))
   (  segid "    " and resid 48   and name HG2%)
 OR { 1290}
   (( segid "    " and resid 47   and name HB2 ))
   (  segid "    " and resid 48   and name HG2%)
 ASSI { 1291}
   (( segid "    " and resid 47   and name HB2 ))
   (  segid "    " and resid 104  and name HD1%)
      3.400     1.400     1.400 peak  1291 weight  0.10000E+01 volume  0.29719E-03 ppm1      3.219 ppm2      0.511 CV     1
 OR { 1291}
   (( segid "    " and resid 47   and name HB1 ))
   (  segid "    " and resid 104  and name HD1%)
 ASSI { 1293}
   (( segid "    " and resid 107  and name HB2 ))
   (  segid "    " and resid 4    and name HD1%)
      3.600     1.600     1.600 peak  1293 weight  0.10000E+01 volume  0.58651E-03 ppm1      3.112 ppm2      0.592 CV     1
 OR { 1293}
   (( segid "    " and resid 107  and name HB2 ))
   (  segid "    " and resid 4    and name HD2%)
 ASSI { 1294}
   (( segid "    " and resid 107  and name HB2 ))
   (  segid "    " and resid 97   and name HB% )
      3.800     1.800     1.800 peak  1294 weight  0.10000E+01 volume  0.70402E-03 ppm1      3.114 ppm2      1.115 CV     1
 ASSI { 1317}
   (( segid "    " and resid 107  and name HB1 ))
   (  segid "    " and resid 97   and name HB% )
      3.700     1.700     1.700 peak  1317 weight  0.10000E+01 volume  0.40204E-03 ppm1      3.049 ppm2      1.114 CV     1
 ASSI { 1318}
   (( segid "    " and resid 107  and name HB1 ))
   (  segid "    " and resid 4    and name HD2%)
      4.200     2.200     1.800 peak  1318 weight  0.10000E+01 volume  0.30777E-03 ppm1      3.041 ppm2      0.614 CV     1
 OR { 1318}
   (( segid "    " and resid 107  and name HB1 ))
   (  segid "    " and resid 4    and name HD1%)
 ASSI { 1322}
   (( segid "    " and resid 33   and name HB2 ))
   (  segid "    " and resid 50   and name HG2%)
      3.500     1.500     1.500 peak  1322 weight  0.10000E+01 volume  0.82208E-03 ppm1      2.881 ppm2      1.189 CV     1
 ASSI { 1329}
   (( segid "    " and resid 36   and name HB2 ))
   (( segid "    " and resid 37   and name HN  ))
      4.900     3.100     1.100 peak  1329 weight  0.10000E+01 volume  0.21335E-03 ppm1      2.771 ppm2      9.512 CV     1
 ASSI { 1341}
   (( segid "    " and resid 109  and name HG2 ))
   (( segid "    " and resid 110  and name HN  ))
      4.100     2.100     1.900 peak  1341 weight  0.10000E+01 volume  0.44555E-03 ppm1      2.612 ppm2      8.921 CV     1
 OR { 1341}
   (( segid "    " and resid 109  and name HG1 ))
   (( segid "    " and resid 110  and name HN  ))
 ASSI { 1346}
   (( segid "    " and resid 109  and name HG1 ))
   (( segid "    " and resid 5    and name HA  ))
      3.400     1.400     1.400 peak  1346 weight  0.10000E+01 volume  0.63048E-03 ppm1      2.610 ppm2      4.839 CV     1
 OR { 1346}
   (( segid "    " and resid 109  and name HG2 ))
   (( segid "    " and resid 5    and name HA  ))
 ASSI { 1347}
   (( segid "    " and resid 109  and name HG2 ))
   (( segid "    " and resid 108  and name HA2 ))
      4.000     2.000     2.000 peak  1347 weight  0.10000E+01 volume  0.35904E-03 ppm1      2.616 ppm2      4.151 CV     1
 OR { 1347}
   (( segid "    " and resid 109  and name HG1 ))
   (( segid "    " and resid 108  and name HA2 ))
 ASSI { 1348}
   (( segid "    " and resid 109  and name HG1 ))
   (( segid "    " and resid 5    and name HB1 ))
      3.200     1.300     1.300 peak  1348 weight  0.10000E+01 volume  0.75461E-03 ppm1      2.614 ppm2      2.054 CV     1
 OR { 1348}
   (( segid "    " and resid 109  and name HG1 ))
   (( segid "    " and resid 5    and name HB2 ))
 OR { 1348}
   (( segid "    " and resid 109  and name HG2 ))
   (( segid "    " and resid 5    and name HB2 ))
 OR { 1348}
   (( segid "    " and resid 109  and name HG2 ))
   (( segid "    " and resid 5    and name HB1 ))
 ASSI { 1352}
   (( segid "    " and resid 34   and name HG1 ))
   (  segid "    " and resid 29   and name HE% )
      4.400     2.500     1.600 peak  1352 weight  0.10000E+01 volume  0.10056E-03 ppm1      2.489 ppm2      7.187 CV     1
 OR { 1352}
   (( segid "    " and resid 34   and name HG1 ))
   (( segid "    " and resid 29   and name HZ  ))
 OR { 1352}
   (( segid "    " and resid 34   and name HG1 ))
   (  segid "    " and resid 29   and name HD% )
 ASSI { 1353}
   (( segid "    " and resid 34   and name HG2 ))
   (  segid "    " and resid 29   and name HE% )
      3.900     1.900     1.900 peak  1353 weight  0.10000E+01 volume  0.55308E-03 ppm1      2.422 ppm2      7.177 CV     1
 OR { 1353}
   (( segid "    " and resid 34   and name HG2 ))
   (  segid "    " and resid 29   and name HD% )
 ASSI { 1363}
   (( segid "    " and resid 34   and name HG1 ))
   (  segid "    " and resid 79   and name HD1%)
      3.700     1.700     1.700 peak  1363 weight  0.10000E+01 volume  0.47733E-03 ppm1      2.469 ppm2      0.398 CV     1
 ASSI { 1364}
   (( segid "    " and resid 34   and name HG2 ))
   (  segid "    " and resid 79   and name HD1%)
      4.700     2.800     1.300 peak  1364 weight  0.10000E+01 volume  0.26036E-03 ppm1      2.428 ppm2      0.395 CV     1
 ASSI { 1366}
   (( segid "    " and resid 13   and name HG2 ))
   (  segid "    " and resid 115  and name HG2%)
      4.500     2.600     1.500 peak  1366 weight  0.10000E+01 volume  0.20226E-03 ppm1      2.437 ppm2      0.401 CV     1
 OR { 1366}
   (( segid "    " and resid 13   and name HG1 ))
   (  segid "    " and resid 115  and name HG2%)
 ASSI { 1367}
   (( segid "    " and resid 13   and name HG2 ))
   (  segid "    " and resid 115  and name HG1%)
      4.600     2.600     1.400 peak  1367 weight  0.10000E+01 volume  0.21376E-03 ppm1      2.441 ppm2      0.586 CV     1
 OR { 1367}
   (( segid "    " and resid 13   and name HG1 ))
   (  segid "    " and resid 115  and name HG1%)
 ASSI { 1368}
   (( segid "    " and resid 13   and name HG2 ))
   (  segid "    " and resid 12   and name HG2%)
      3.800     1.800     1.800 peak  1368 weight  0.10000E+01 volume  0.56655E-03 ppm1      2.437 ppm2      0.822 CV     1
 OR { 1368}
   (( segid "    " and resid 13   and name HG1 ))
   (  segid "    " and resid 12   and name HG2%)
 OR { 1368}
   (( segid "    " and resid 13   and name HG2 ))
   (  segid "    " and resid 12   and name HG1%)
 OR { 1368}
   (( segid "    " and resid 13   and name HG1 ))
   (  segid "    " and resid 12   and name HG1%)
 ASSI { 1371}
   (( segid "    " and resid 13   and name HG1 ))
   (( segid "    " and resid 14   and name HD2 ))
      3.200     1.300     1.300 peak  1371 weight  0.10000E+01 volume  0.11458E-02 ppm1      2.436 ppm2      3.520 CV     1
 OR { 1371}
   (( segid "    " and resid 13   and name HG2 ))
   (( segid "    " and resid 14   and name HD2 ))
 OR { 1371}
   (( segid "    " and resid 13   and name HG1 ))
   (( segid "    " and resid 14   and name HD1 ))
 OR { 1371}
   (( segid "    " and resid 13   and name HG2 ))
   (( segid "    " and resid 14   and name HD1 ))
 ASSI { 1375}
   (( segid "    " and resid 13   and name HG2 ))
   (( segid "    " and resid 16   and name HA2 ))
      4.800     2.900     1.200 peak  1375 weight  0.10000E+01 volume  0.15428E-03 ppm1      2.441 ppm2      4.276 CV     1
 OR { 1375}
   (( segid "    " and resid 13   and name HG1 ))
   (( segid "    " and resid 16   and name HA2 ))
 ASSI { 1377}
   (( segid "    " and resid 13   and name HG2 ))
   (( segid "    " and resid 118  and name HE21))
      4.000     2.000     2.000 peak  1377 weight  0.10000E+01 volume  0.27551E-03 ppm1      2.436 ppm2      6.959 CV     1
 OR { 1377}
   (( segid "    " and resid 13   and name HG1 ))
   (( segid "    " and resid 118  and name HE21))
 ASSI { 1381}
   (( segid "    " and resid 39   and name HG1 ))
   (( segid "    " and resid 40   and name HN  ))
      4.000     2.000     2.000 peak  1381 weight  0.10000E+01 volume  0.28539E-03 ppm1      2.223 ppm2      9.516 CV     1
 ASSI { 1389}
   (( segid "    " and resid 95   and name HB1 ))
   (( segid "    " and resid 96   and name HN  ))
      4.000     2.000     2.000 peak  1389 weight  0.10000E+01 volume  0.26396E-03 ppm1      2.490 ppm2      8.885 CV     1
 ASSI { 1401}
   (( segid "    " and resid 105  and name HB1 ))
   (( segid "    " and resid 106  and name HA  ))
      4.800     2.900     1.200 peak  1401 weight  0.10000E+01 volume  0.11350E-03 ppm1      2.409 ppm2      4.132 CV     1
 OR { 1401}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 106  and name HA  ))
 ASSI { 1402}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 104  and name HA  ))
      4.400     2.500     1.600 peak  1402 weight  0.10000E+01 volume  0.29257E-03 ppm1      2.396 ppm2      3.919 CV     1
 OR { 1402}
   (( segid "    " and resid 105  and name HB1 ))
   (( segid "    " and resid 104  and name HA  ))
 ASSI { 1403}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 100  and name HB2 ))
      3.200     1.300     1.300 peak  1403 weight  0.10000E+01 volume  0.42399E-03 ppm1      2.398 ppm2      3.717 CV     1
 OR { 1403}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 100  and name HB1 ))
 OR { 1403}
   (( segid "    " and resid 105  and name HB1 ))
   (( segid "    " and resid 100  and name HB1 ))
 ASSI { 1409}
   (( segid "    " and resid 96   and name HB1 ))
   (( segid "    " and resid 36   and name HZ2 ))
      4.200     2.300     1.800 peak  1409 weight  0.10000E+01 volume  0.16778E-03 ppm1      2.384 ppm2      6.973 CV     1
 OR { 1409}
   (( segid "    " and resid 96   and name HB1 ))
   (( segid "    " and resid 36   and name HD1 ))
 ASSI { 1412}
   (( segid "    " and resid 96   and name HB1 ))
   (( segid "    " and resid 22   and name HB2 ))
      3.400     1.400     1.400 peak  1412 weight  0.10000E+01 volume  0.85919E-03 ppm1      2.389 ppm2      3.035 CV     1
 ASSI { 1424}
   (( segid "    " and resid 60   and name HB1 ))
   (( segid "    " and resid 65   and name HB2 ))
      3.200     1.300     1.300 peak  1424 weight  0.10000E+01 volume  0.80685E-03 ppm1      2.493 ppm2      1.809 CV     1
 OR { 1424}
   (( segid "    " and resid 60   and name HB1 ))
   (( segid "    " and resid 65   and name HD1 ))
 OR { 1424}
   (( segid "    " and resid 60   and name HB1 ))
   (( segid "    " and resid 65   and name HB1 ))
 OR { 1424}
   (( segid "    " and resid 60   and name HB1 ))
   (( segid "    " and resid 65   and name HD2 ))
 ASSI { 1426}
   (( segid "    " and resid 60   and name HB1 ))
   (  segid "    " and resid 64   and name HG2%)
      4.200     2.200     1.800 peak  1426 weight  0.10000E+01 volume  0.70457E-03 ppm1      2.492 ppm2      0.840 CV     1
 ASSI { 1427}
   (( segid "    " and resid 38   and name HD2 ))
   (( segid "    " and resid 94   and name HH  ))
      4.000     2.000     2.000 peak  1427 weight  0.10000E+01 volume  0.30222E-03 ppm1      2.546 ppm2     10.249 CV     1
 OR { 1427}
   (( segid "    " and resid 38   and name HD1 ))
   (( segid "    " and resid 94   and name HH  ))
 ASSI { 1429}
   (( segid "    " and resid 38   and name HD2 ))
   (( segid "    " and resid 39   and name HN  ))
      5.800     4.200     0.200 peak  1429 weight  0.10000E+01 volume  0.77793E-04 ppm1      2.545 ppm2      9.223 CV     1
 OR { 1429}
   (( segid "    " and resid 38   and name HD1 ))
   (( segid "    " and resid 39   and name HN  ))
 ASSI { 1432}
   (( segid "    " and resid 38   and name HD2 ))
   (  segid "    " and resid 94   and name HE% )
      2.700     0.900     0.900 peak  1432 weight  0.10000E+01 volume  0.25046E-02 ppm1      2.551 ppm2      6.784 CV     1
 OR { 1432}
   (( segid "    " and resid 38   and name HD1 ))
   (  segid "    " and resid 94   and name HE% )
 ASSI { 1434}
   (( segid "    " and resid 38   and name HD1 ))
   (( segid "    " and resid 46   and name HG2 ))
      4.100     2.100     1.900 peak  1434 weight  0.10000E+01 volume  0.37579E-03 ppm1      2.561 ppm2      2.132 CV     1
 OR { 1434}
   (( segid "    " and resid 38   and name HD2 ))
   (( segid "    " and resid 46   and name HG2 ))
 OR { 1434}
   (( segid "    " and resid 38   and name HD1 ))
   (( segid "    " and resid 46   and name HB2 ))
 OR { 1434}
   (( segid "    " and resid 38   and name HD2 ))
   (( segid "    " and resid 46   and name HB2 ))
 ASSI { 1437}
   (( segid "    " and resid 38   and name HD1 ))
   (  segid "    " and resid 48   and name HG2%)
      2.700     0.900     0.900 peak  1437 weight  0.10000E+01 volume  0.32054E-02 ppm1      2.556 ppm2      0.873 CV     1
 OR { 1437}
   (( segid "    " and resid 38   and name HD1 ))
   (  segid "    " and resid 48   and name HG2%)
 OR { 1437}
   (( segid "    " and resid 38   and name HD2 ))
   (  segid "    " and resid 48   and name HG2%)
 OR { 1437}
   (( segid "    " and resid 38   and name HD2 ))
   (  segid "    " and resid 48   and name HG2%)
 OR { 1437}
   (( segid "    " and resid 38   and name HD2 ))
   (  segid "    " and resid 48   and name HG1%)
 ASSI { 1441}
   (( segid "    " and resid 96   and name HB2 ))
   (( segid "    " and resid 36   and name HZ2 ))
      4.900     3.000     1.100 peak  1441 weight  0.10000E+01 volume  0.15083E-03 ppm1      1.824 ppm2      6.975 CV     1
 ASSI { 1444}
   (( segid "    " and resid 96   and name HB2 ))
   (( segid "    " and resid 22   and name HB2 ))
      3.500     1.500     1.500 peak  1444 weight  0.10000E+01 volume  0.58435E-03 ppm1      1.814 ppm2      3.061 CV     1
 ASSI { 1445}
   (( segid "    " and resid 96   and name HB2 ))
   (( segid "    " and resid 22   and name HB1 ))
      4.000     2.000     2.000 peak  1445 weight  0.10000E+01 volume  0.31925E-03 ppm1      1.824 ppm2      2.934 CV     1
 ASSI { 1464}
   (( segid "    " and resid 70   and name HB  ))
   (( segid "    " and resid 49   and name HB2 ))
      4.500     2.500     1.500 peak  1464 weight  0.10000E+01 volume  0.17184E-03 ppm1      1.983 ppm2      3.528 CV     1
 ASSI { 1469}
   (( segid "    " and resid 70   and name HB  ))
   (  segid "    " and resid 81   and name HD2%)
      5.000     3.100     1.000 peak  1469 weight  0.10000E+01 volume  0.71170E-04 ppm1      1.978 ppm2      0.160 CV     1
 ASSI { 1481}
   (( segid "    " and resid 46   and name HG1 ))
   (( segid "    " and resid 49   and name HN  ))
      4.400     2.400     1.600 peak  1481 weight  0.10000E+01 volume  0.47149E-03 ppm1      2.246 ppm2      7.143 CV     1
 ASSI { 1486}
   (( segid "    " and resid 87   and name HB2 ))
   (( segid "    " and resid 90   and name HN  ))
      5.300     3.500     0.700 peak  1486 weight  0.10000E+01 volume  0.59866E-04 ppm1      2.141 ppm2      8.412 CV     1
 ASSI { 1492}
   (( segid "    " and resid 46   and name HG2 ))
   (( segid "    " and resid 47   and name HN  ))
      4.800     2.900     1.200 peak  1492 weight  0.10000E+01 volume  0.29621E-03 ppm1      2.151 ppm2      8.956 CV     1
 ASSI { 1497}
   (( segid "    " and resid 46   and name HG1 ))
   (( segid "    " and resid 47   and name HN  ))
      3.700     1.700     1.700 peak  1497 weight  0.10000E+01 volume  0.31647E-03 ppm1      2.257 ppm2      8.962 CV     1
 ASSI { 1501}
   (( segid "    " and resid 109  and name HB1 ))
   (( segid "    " and resid 110  and name HN  ))
      3.900     1.900     1.900 peak  1501 weight  0.10000E+01 volume  0.46234E-03 ppm1      2.315 ppm2      8.921 CV     1
 ASSI { 1502}
   (( segid "    " and resid 109  and name HB1 ))
   (( segid "    " and resid 6    and name HN  ))
      4.600     2.600     1.400 peak  1502 weight  0.10000E+01 volume  0.21305E-03 ppm1      2.313 ppm2      8.583 CV     1
 ASSI { 1504}
   (( segid "    " and resid 109  and name HB1 ))
   (( segid "    " and resid 5    and name HA  ))
      3.600     1.600     1.600 peak  1504 weight  0.10000E+01 volume  0.87391E-03 ppm1      2.317 ppm2      4.864 CV     1
 ASSI { 1505}
   (( segid "    " and resid 109  and name HB1 ))
   (( segid "    " and resid 108  and name HA1 ))
      5.000     3.200     1.000 peak  1505 weight  0.10000E+01 volume  0.16125E-03 ppm1      2.310 ppm2      4.155 CV     1
 OR { 1505}
   (( segid "    " and resid 109  and name HB1 ))
   (( segid "    " and resid 108  and name HA2 ))
 ASSI { 1511}
   (( segid "    " and resid 39   and name HB1 ))
   (( segid "    " and resid 40   and name HN  ))
      4.500     2.500     1.500 peak  1511 weight  0.10000E+01 volume  0.26412E-03 ppm1      2.287 ppm2      9.506 CV     1
 ASSI { 1515}
   (( segid "    " and resid 39   and name HB1 ))
   (( segid "    " and resid 45   and name HA  ))
      4.000     2.000     2.000 peak  1515 weight  0.10000E+01 volume  0.62073E-03 ppm1      2.272 ppm2      4.299 CV     1
 ASSI { 1518}
   (( segid "    " and resid 109  and name HB2 ))
   (( segid "    " and resid 110  and name HN  ))
      3.800     1.800     1.800 peak  1518 weight  0.10000E+01 volume  0.38200E-03 ppm1      2.239 ppm2      8.916 CV     1
 ASSI { 1522}
   (( segid "    " and resid 109  and name HB2 ))
   (( segid "    " and resid 6    and name HN  ))
      4.300     2.400     1.700 peak  1522 weight  0.10000E+01 volume  0.13878E-03 ppm1      2.240 ppm2      8.571 CV     1
 ASSI { 1523}
   (( segid "    " and resid 14   and name HB1 ))
   (( segid "    " and resid 15   and name HN  ))
      3.800     1.800     1.800 peak  1523 weight  0.10000E+01 volume  0.51035E-03 ppm1      2.219 ppm2      9.762 CV     1
 ASSI { 1526}
   (( segid "    " and resid 14   and name HB1 ))
   (  segid "    " and resid 115  and name HG2%)
      4.200     2.200     1.800 peak  1526 weight  0.10000E+01 volume  0.56453E-03 ppm1      2.221 ppm2      0.398 CV     1
 ASSI { 1527}
   (( segid "    " and resid 14   and name HB1 ))
   (  segid "    " and resid 115  and name HG1%)
      5.600     3.900     0.400 peak  1527 weight  0.10000E+01 volume  0.12450E-03 ppm1      2.218 ppm2      0.603 CV     1
 ASSI { 1531}
   (( segid "    " and resid 67   and name HB2 ))
   (  segid "    " and resid 68   and name HD% )
      3.900     1.900     1.900 peak  1531 weight  0.10000E+01 volume  0.65545E-03 ppm1      2.182 ppm2      7.013 CV     1
 OR { 1531}
   (( segid "    " and resid 67   and name HB2 ))
   (  segid "    " and resid 68   and name HE% )
 ASSI { 1534}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 85   and name HB2 ))
      4.600     2.600     1.400 peak  1534 weight  0.10000E+01 volume  0.20190E-03 ppm1      2.177 ppm2      3.692 CV     1
 OR { 1534}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 85   and name HA  ))
 ASSI { 1536}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 68   and name HB2 ))
      5.000     3.100     1.000 peak  1536 weight  0.10000E+01 volume  0.16043E-03 ppm1      2.185 ppm2      2.908 CV     1
 OR { 1536}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 68   and name HB1 ))
 ASSI { 1541}
   (( segid "    " and resid 70   and name HG11))
   (( segid "    " and resid 36   and name HD1 ))
      4.200     2.200     1.800 peak  1541 weight  0.10000E+01 volume  0.35142E-03 ppm1      2.226 ppm2      6.925 CV     1
 OR { 1541}
   (( segid "    " and resid 70   and name HG11))
   (( segid "    " and resid 36   and name HZ2 ))
 ASSI { 1545}
   (( segid "    " and resid 14   and name HG2 ))
   (  segid "    " and resid 115  and name HG2%)
      4.000     2.000     2.000 peak  1545 weight  0.10000E+01 volume  0.66907E-03 ppm1      2.120 ppm2      0.399 CV     1
 ASSI { 1546}
   (( segid "    " and resid 41   and name HG2 ))
   (  segid "    " and resid 40   and name HB% )
      3.600     1.600     1.600 peak  1546 weight  0.10000E+01 volume  0.22074E-02 ppm1      2.130 ppm2      1.518 CV     1
 ASSI { 1554}
   (( segid "    " and resid 13   and name HB2 ))
   (( segid "    " and resid 14   and name HD2 ))
      2.800     1.000     1.000 peak  1554 weight  0.10000E+01 volume  0.22348E-02 ppm1      2.066 ppm2      3.521 CV     1
 OR { 1554}
   (( segid "    " and resid 13   and name HB2 ))
   (( segid "    " and resid 14   and name HD1 ))
 ASSI { 1558}
   (( segid "    " and resid 13   and name HB2 ))
   (  segid "    " and resid 12   and name HG2%)
      5.100     3.200     0.900 peak  1558 weight  0.10000E+01 volume  0.14145E-03 ppm1      2.070 ppm2      0.813 CV     1
 OR { 1558}
   (( segid "    " and resid 13   and name HB2 ))
   (  segid "    " and resid 12   and name HG1%)
 ASSI { 1562}
   (( segid "    " and resid 41   and name HG1 ))
   (  segid "    " and resid 40   and name HB% )
      5.700     4.000     0.300 peak  1562 weight  0.10000E+01 volume  0.13102E-03 ppm1      1.979 ppm2      1.478 CV     1
 ASSI { 1564}
   (( segid "    " and resid 13   and name HB1 ))
   (( segid "    " and resid 12   and name HA  ))
      5.200     3.400     0.800 peak  1564 weight  0.10000E+01 volume  0.17862E-03 ppm1      1.873 ppm2      4.442 CV     1
 ASSI { 1565}
   (( segid "    " and resid 13   and name HB1 ))
   (( segid "    " and resid 14   and name HD2 ))
      3.300     1.400     1.400 peak  1565 weight  0.10000E+01 volume  0.13937E-02 ppm1      1.874 ppm2      3.520 CV     1
 OR { 1565}
   (( segid "    " and resid 13   and name HB1 ))
   (( segid "    " and resid 14   and name HD1 ))
 ASSI { 1568}
   (( segid "    " and resid 13   and name HB1 ))
   (  segid "    " and resid 12   and name HG2%)
      4.700     2.800     1.300 peak  1568 weight  0.10000E+01 volume  0.18255E-03 ppm1      1.867 ppm2      0.803 CV     1
 OR { 1568}
   (( segid "    " and resid 13   and name HB1 ))
   (  segid "    " and resid 12   and name HG1%)
 ASSI { 1569}
   (( segid "    " and resid 43   and name HB1 ))
   (( segid "    " and resid 40   and name HN  ))
      4.800     2.800     1.200 peak  1569 weight  0.10000E+01 volume  0.14189E-03 ppm1      2.028 ppm2      9.519 CV     1
 ASSI { 1576}
   (( segid "    " and resid 43   and name HB1 ))
   (( segid "    " and resid 39   and name HG1 ))
      3.000     1.100     1.100 peak  1576 weight  0.10000E+01 volume  0.20760E-02 ppm1      2.027 ppm2      2.244 CV     1
 OR { 1576}
   (( segid "    " and resid 43   and name HB1 ))
   (( segid "    " and resid 39   and name HB1 ))
 ASSI { 1590}
   (( segid "    " and resid 37   and name HB  ))
   (( segid "    " and resid 47   and name HA  ))
      4.300     2.300     1.700 peak  1590 weight  0.10000E+01 volume  0.36830E-03 ppm1      1.943 ppm2      4.441 CV     1
 ASSI { 1592}
   (( segid "    " and resid 37   and name HB  ))
   (  segid "    " and resid 45   and name HD1%)
      3.000     1.100     1.100 peak  1592 weight  0.10000E+01 volume  0.23634E-02 ppm1      1.945 ppm2      0.339 CV     1
 OR { 1592}
   (( segid "    " and resid 37   and name HB  ))
   (  segid "    " and resid 45   and name HD2%)
 ASSI { 1604}
   (( segid "    " and resid 12   and name HB  ))
   (( segid "    " and resid 13   and name HN  ))
      3.500     1.500     1.500 peak  1604 weight  0.10000E+01 volume  0.11334E-02 ppm1      1.861 ppm2      8.151 CV     1
 ASSI { 1607}
   (( segid "    " and resid 12   and name HB  ))
   (( segid "    " and resid 115  and name HA  ))
      4.200     2.200     1.800 peak  1607 weight  0.10000E+01 volume  0.30837E-03 ppm1      1.861 ppm2      4.802 CV     1
 ASSI { 1609}
   (( segid "    " and resid 12   and name HB  ))
   (( segid "    " and resid 16   and name HA2 ))
      5.800     4.200     0.200 peak  1609 weight  0.10000E+01 volume  0.14887E-03 ppm1      1.860 ppm2      4.250 CV     1
 ASSI { 1631}
   (( segid "    " and resid 39   and name HG2 ))
   (( segid "    " and resid 40   and name HN  ))
      4.400     2.400     1.600 peak  1631 weight  0.10000E+01 volume  0.34976E-03 ppm1      2.140 ppm2      9.513 CV     1
 ASSI { 1649}
   (( segid "    " and resid 20   and name HB  ))
   (( segid "    " and resid 36   and name HH2 ))
      3.800     1.800     1.800 peak  1649 weight  0.10000E+01 volume  0.31722E-03 ppm1      2.076 ppm2      6.786 CV     1
 OR { 1649}
   (( segid "    " and resid 20   and name HB  ))
   (( segid "    " and resid 36   and name HZ3 ))
 ASSI { 1655}
   (( segid "    " and resid 112  and name HB1 ))
   (( segid "    " and resid 113  and name HN  ))
      4.200     2.200     1.800 peak  1655 weight  0.10000E+01 volume  0.54338E-03 ppm1      2.062 ppm2      8.941 CV     1
 OR { 1655}
   (( segid "    " and resid 112  and name HB2 ))
   (( segid "    " and resid 113  and name HN  ))
 ASSI { 1659}
   (( segid "    " and resid 112  and name HB2 ))
   (( segid "    " and resid 111  and name HA  ))
      3.900     1.900     1.900 peak  1659 weight  0.10000E+01 volume  0.43614E-03 ppm1      2.062 ppm2      4.883 CV     1
 OR { 1659}
   (( segid "    " and resid 112  and name HB1 ))
   (( segid "    " and resid 111  and name HA  ))
 ASSI { 1662}
   (( segid "    " and resid 112  and name HB2 ))
   (  segid "    " and resid 93   and name HG1%)
      3.500     1.500     1.500 peak  1662 weight  0.10000E+01 volume  0.83150E-03 ppm1      2.057 ppm2      0.926 CV     1
 OR { 1662}
   (( segid "    " and resid 112  and name HB1 ))
   (  segid "    " and resid 93   and name HG1%)
 ASSI { 1663}
   (( segid "    " and resid 112  and name HB2 ))
   (  segid "    " and resid 93   and name HG2%)
      4.100     2.100     1.900 peak  1663 weight  0.10000E+01 volume  0.33780E-03 ppm1      2.063 ppm2      0.376 CV     1
 OR { 1663}
   (( segid "    " and resid 112  and name HB1 ))
   (  segid "    " and resid 93   and name HG2%)
 ASSI { 1664}
   (( segid "    " and resid 5    and name HB1 ))
   (  segid "    " and resid 23   and name HB% )
      3.300     1.400     1.400 peak  1664 weight  0.10000E+01 volume  0.92946E-03 ppm1      2.124 ppm2      1.394 CV     1
 OR { 1664}
   (( segid "    " and resid 5    and name HB2 ))
   (  segid "    " and resid 23   and name HB% )
 ASSI { 1671}
   (( segid "    " and resid 3    and name HB1 ))
   (( segid "    " and resid 4    and name HN  ))
      4.600     2.700     1.400 peak  1671 weight  0.10000E+01 volume  0.15243E-03 ppm1      2.081 ppm2      8.072 CV     1
 ASSI { 1673}
   (( segid "    " and resid 3    and name HB1 ))
   (( segid "    " and resid 25   and name HB2 ))
      4.600     2.700     1.400 peak  1673 weight  0.10000E+01 volume  0.11112E-03 ppm1      2.073 ppm2      3.832 CV     1
 OR { 1673}
   (( segid "    " and resid 3    and name HB1 ))
   (( segid "    " and resid 25   and name HB1 ))
 ASSI { 1676}
   (( segid "    " and resid 65   and name HD1 ))
   (( segid "    " and resid 62   and name HA  ))
      3.300     1.300     1.300 peak  1676 weight  0.10000E+01 volume  0.86940E-03 ppm1      1.804 ppm2      4.311 CV     1
 OR { 1676}
   (( segid "    " and resid 65   and name HD2 ))
   (( segid "    " and resid 62   and name HA  ))
 ASSI { 1679}
   (( segid "    " and resid 65   and name HD1 ))
   (( segid "    " and resid 62   and name HB1 ))
      3.500     1.500     1.500 peak  1679 weight  0.10000E+01 volume  0.25342E-03 ppm1      1.809 ppm2      2.718 CV     1
 OR { 1679}
   (( segid "    " and resid 65   and name HD1 ))
   (( segid "    " and resid 62   and name HB2 ))
 OR { 1679}
   (( segid "    " and resid 65   and name HD2 ))
   (( segid "    " and resid 62   and name HB1 ))
 OR { 1679}
   (( segid "    " and resid 65   and name HD2 ))
   (( segid "    " and resid 62   and name HB2 ))
 ASSI { 1696}
   (( segid "    " and resid 65   and name HB2 ))
   (( segid "    " and resid 62   and name HB1 ))
      3.300     1.400     1.400 peak  1696 weight  0.10000E+01 volume  0.34184E-03 ppm1      1.824 ppm2      2.717 CV     1
 OR { 1696}
   (( segid "    " and resid 65   and name HB1 ))
   (( segid "    " and resid 62   and name HB1 ))
 OR { 1696}
   (( segid "    " and resid 65   and name HB2 ))
   (( segid "    " and resid 62   and name HB2 ))
 OR { 1696}
   (( segid "    " and resid 65   and name HB1 ))
   (( segid "    " and resid 62   and name HB2 ))
 ASSI { 1697}
   (( segid "    " and resid 65   and name HB2 ))
   (( segid "    " and resid 60   and name HB1 ))
      3.400     1.400     1.400 peak  1697 weight  0.10000E+01 volume  0.67362E-03 ppm1      1.823 ppm2      2.489 CV     1
 OR { 1697}
   (( segid "    " and resid 65   and name HB1 ))
   (( segid "    " and resid 60   and name HB1 ))
 ASSI { 1710}
   (( segid "    " and resid 79   and name HG  ))
   (( segid "    " and resid 80   and name HN  ))
      4.300     2.300     1.700 peak  1710 weight  0.10000E+01 volume  0.31316E-03 ppm1      1.746 ppm2      9.227 CV     1
 ASSI { 1712}
   (( segid "    " and resid 79   and name HG  ))
   (( segid "    " and resid 36   and name HE1 ))
      3.600     1.600     1.600 peak  1712 weight  0.10000E+01 volume  0.84590E-03 ppm1      1.748 ppm2      7.889 CV     1
 ASSI { 1723}
   (  segid "    " and resid 6    and name HB% )
   (  segid "    " and resid 20   and name HG2%)
      4.600     2.700     1.400 peak  1723 weight  0.10000E+01 volume  0.17324E-03 ppm1      1.780 ppm2     -0.098 CV     1
 ASSI { 1726}
   (  segid "    " and resid 6    and name HB% )
   (  segid "    " and resid 111  and name HG2%)
      2.500     0.800     0.800 peak  1726 weight  0.10000E+01 volume  0.41340E-02 ppm1      1.783 ppm2      1.058 CV     1
 ASSI { 1732}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 110  and name HA1 ))
      3.700     1.700     1.700 peak  1732 weight  0.10000E+01 volume  0.13081E-02 ppm1      1.782 ppm2      4.496 CV     1
 ASSI { 1734}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 22   and name HA  ))
      3.800     1.800     1.800 peak  1734 weight  0.10000E+01 volume  0.62565E-03 ppm1      1.782 ppm2      5.377 CV     1
 ASSI { 1738}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 36   and name HE3 ))
      4.500     2.600     1.500 peak  1738 weight  0.10000E+01 volume  0.23102E-03 ppm1      1.785 ppm2      7.609 CV     1
 ASSI { 1760}
   (( segid "    " and resid 82   and name HB2 ))
   (( segid "    " and resid 19   and name HA  ))
      5.200     3.300     0.800 peak  1760 weight  0.10000E+01 volume  0.10907E-03 ppm1      1.909 ppm2      5.170 CV     1
 ASSI { 1762}
   (( segid "    " and resid 82   and name HB2 ))
   (( segid "    " and resid 69   and name HB  ))
      4.400     2.400     1.600 peak  1762 weight  0.10000E+01 volume  0.56472E-03 ppm1      1.904 ppm2      3.809 CV     1
 ASSI { 1769}
   (( segid "    " and resid 82   and name HB1 ))
   (( segid "    " and resid 69   and name HB  ))
      2.700     0.900     0.900 peak  1769 weight  0.10000E+01 volume  0.14070E-02 ppm1      1.981 ppm2      3.826 CV     1
 ASSI { 1771}
   (( segid "    " and resid 82   and name HB1 ))
   (  segid "    " and resid 69   and name HG2%)
      3.500     1.600     1.600 peak  1771 weight  0.10000E+01 volume  0.44751E-03 ppm1      1.977 ppm2      1.227 CV     1
 ASSI { 1775}
   (( segid "    " and resid 82   and name HG2 ))
   (( segid "    " and resid 69   and name HB  ))
      4.100     2.100     1.900 peak  1775 weight  0.10000E+01 volume  0.48699E-03 ppm1      1.894 ppm2      3.812 CV     1
 ASSI { 1777}
   (( segid "    " and resid 82   and name HG2 ))
   (  segid "    " and resid 69   and name HG2%)
      5.000     3.100     1.000 peak  1777 weight  0.10000E+01 volume  0.14509E-03 ppm1      1.893 ppm2      1.226 CV     1
 ASSI { 1780}
   (( segid "    " and resid 46   and name HB1 ))
   (( segid "    " and resid 38   and name HE  ))
      4.900     3.000     1.100 peak  1780 weight  0.10000E+01 volume  0.79540E-04 ppm1      1.863 ppm2      7.260 CV     1
 ASSI { 1784}
   (( segid "    " and resid 46   and name HB1 ))
   (( segid "    " and resid 38   and name HG1 ))
      3.300     1.400     1.400 peak  1784 weight  0.10000E+01 volume  0.69450E-03 ppm1      1.854 ppm2      1.398 CV     1
 OR { 1784}
   (( segid "    " and resid 46   and name HB1 ))
   (( segid "    " and resid 38   and name HG2 ))
 ASSI { 1786}
   (( segid "    " and resid 113  and name HB  ))
   (( segid "    " and resid 94   and name HH  ))
      4.800     2.900     1.200 peak  1786 weight  0.10000E+01 volume  0.16675E-03 ppm1      2.357 ppm2     10.241 CV     1
 ASSI { 1804}
   (( segid "    " and resid 112  and name HG2 ))
   (  segid "    " and resid 93   and name HG1%)
      3.500     1.500     1.500 peak  1804 weight  0.10000E+01 volume  0.56600E-03 ppm1      2.258 ppm2      0.933 CV     1
 ASSI { 1806}
   (( segid "    " and resid 3    and name HG2 ))
   (( segid "    " and resid 4    and name HN  ))
      3.400     1.500     1.500 peak  1806 weight  0.10000E+01 volume  0.74730E-03 ppm1      2.310 ppm2      8.100 CV     1
 OR { 1806}
   (( segid "    " and resid 3    and name HG1 ))
   (( segid "    " and resid 4    and name HN  ))
 ASSI { 1809}
   (( segid "    " and resid 3    and name HG2 ))
   (( segid "    " and resid 107  and name HE3 ))
      3.300     1.400     1.400 peak  1809 weight  0.10000E+01 volume  0.10238E-02 ppm1      2.322 ppm2      7.074 CV     1
 OR { 1809}
   (( segid "    " and resid 3    and name HG1 ))
   (( segid "    " and resid 107  and name HE3 ))
 ASSI { 1818}
   (( segid "    " and resid 34   and name HB2 ))
   (  segid "    " and resid 79   and name HD1%)
      3.400     1.400     1.400 peak  1818 weight  0.10000E+01 volume  0.11716E-02 ppm1      1.735 ppm2      0.410 CV     1
 ASSI { 1820}
   (( segid "    " and resid 48   and name HB  ))
   (( segid "    " and resid 36   and name HN  ))
      4.600     2.700     1.400 peak  1820 weight  0.10000E+01 volume  0.23154E-03 ppm1      1.967 ppm2      8.759 CV     1
 ASSI { 1824}
   (( segid "    " and resid 48   and name HB  ))
   (( segid "    " and resid 37   and name HA  ))
      4.800     2.800     1.200 peak  1824 weight  0.10000E+01 volume  0.14641E-03 ppm1      1.974 ppm2      5.077 CV     1
 ASSI { 1826}
   (( segid "    " and resid 48   and name HB  ))
   (( segid "    " and resid 36   and name HB1 ))
      3.600     1.600     1.600 peak  1826 weight  0.10000E+01 volume  0.56674E-03 ppm1      1.967 ppm2      3.117 CV     1
 ASSI { 1827}
   (( segid "    " and resid 48   and name HB  ))
   (( segid "    " and resid 36   and name HB2 ))
      3.800     1.800     1.800 peak  1827 weight  0.10000E+01 volume  0.42280E-03 ppm1      1.967 ppm2      2.766 CV     1
 ASSI { 1834}
   (( segid "    " and resid 76   and name HB1 ))
   (( segid "    " and resid 78   and name HB  ))
      5.100     3.200     0.900 peak  1834 weight  0.10000E+01 volume  0.13904E-03 ppm1      2.005 ppm2      3.478 CV     1
 ASSI { 1839}
   (( segid "    " and resid 112  and name HG1 ))
   (( segid "    " and resid 113  and name HN  ))
      4.000     2.000     2.000 peak  1839 weight  0.10000E+01 volume  0.30645E-03 ppm1      2.019 ppm2      8.969 CV     1
 ASSI { 1846}
   (( segid "    " and resid 2    and name HB  ))
   (( segid "    " and resid 3    and name HN  ))
      4.600     2.700     1.400 peak  1846 weight  0.10000E+01 volume  0.19190E-03 ppm1      1.955 ppm2      8.511 CV     1
 ASSI { 1847}
   (( segid "    " and resid 2    and name HB  ))
   (  segid "    " and resid 27   and name HD% )
      4.500     2.500     1.500 peak  1847 weight  0.10000E+01 volume  0.16283E-03 ppm1      1.956 ppm2      7.021 CV     1
 OR { 1847}
   (( segid "    " and resid 2    and name HB  ))
   (  segid "    " and resid 27   and name HE% )
 OR { 1847}
   (( segid "    " and resid 2    and name HB  ))
   (( segid "    " and resid 27   and name HZ  ))
 ASSI { 1853}
   (( segid "    " and resid 14   and name HB2 ))
   (( segid "    " and resid 15   and name HN  ))
      4.400     2.400     1.600 peak  1853 weight  0.10000E+01 volume  0.33273E-03 ppm1      1.889 ppm2      9.765 CV     1
 ASSI { 1858}
   (( segid "    " and resid 115  and name HB  ))
   (( segid "    " and resid 91   and name HN  ))
      4.000     2.000     2.000 peak  1858 weight  0.10000E+01 volume  0.31989E-03 ppm1      1.916 ppm2      7.772 CV     1
 ASSI { 1859}
   (( segid "    " and resid 115  and name HB  ))
   (( segid "    " and resid 91   and name HG1 ))
      3.900     1.900     1.900 peak  1859 weight  0.10000E+01 volume  0.27699E-03 ppm1      1.930 ppm2      5.822 CV     1
 ASSI { 1861}
   (( segid "    " and resid 115  and name HB  ))
   (( segid "    " and resid 88   and name HA  ))
      2.800     0.900     0.900 peak  1861 weight  0.10000E+01 volume  0.20174E-02 ppm1      1.915 ppm2      4.140 CV     1
 ASSI { 1874}
   (( segid "    " and resid 93   and name HB  ))
   (( segid "    " and resid 39   and name HN  ))
      3.700     1.700     1.700 peak  1874 weight  0.10000E+01 volume  0.58228E-03 ppm1      1.968 ppm2      9.243 CV     1
 ASSI { 1892}
   (( segid "    " and resid 11   and name HB2 ))
   (( segid "    " and resid 10   and name HA1 ))
      5.000     3.100     1.000 peak  1892 weight  0.10000E+01 volume  0.40537E-03 ppm1      1.658 ppm2      4.045 CV     1
 ASSI { 1893}
   (( segid "    " and resid 11   and name HB2 ))
   (( segid "    " and resid 114  and name HB  ))
      4.700     2.800     1.300 peak  1893 weight  0.10000E+01 volume  0.18052E-03 ppm1      1.662 ppm2      3.854 CV     1
 ASSI { 1904}
   (( segid "    " and resid 51   and name HB  ))
   (( segid "    " and resid 52   and name HN  ))
      4.700     2.700     1.300 peak  1904 weight  0.10000E+01 volume  0.24226E-03 ppm1      1.643 ppm2      8.478 CV     1
 ASSI { 1907}
   (( segid "    " and resid 51   and name HB  ))
   (( segid "    " and resid 58   and name HB  ))
      4.400     2.400     1.600 peak  1907 weight  0.10000E+01 volume  0.28258E-03 ppm1      1.638 ppm2      3.888 CV     1
 ASSI { 1909}
   (( segid "    " and resid 51   and name HB  ))
   (  segid "    " and resid 58   and name HG2%)
      3.000     1.100     1.100 peak  1909 weight  0.10000E+01 volume  0.20677E-02 ppm1      1.651 ppm2      1.239 CV     1
 ASSI { 1917}
   (( segid "    " and resid 4    and name HB1 ))
   (( segid "    " and resid 5    and name HN  ))
      3.200     1.200     1.200 peak  1917 weight  0.10000E+01 volume  0.13488E-02 ppm1      1.470 ppm2      8.276 CV     1
 OR { 1917}
   (( segid "    " and resid 4    and name HB2 ))
   (( segid "    " and resid 5    and name HN  ))
 ASSI { 1919}
   (( segid "    " and resid 4    and name HB2 ))
   (( segid "    " and resid 108  and name HA1 ))
      3.200     1.300     1.300 peak  1919 weight  0.10000E+01 volume  0.12336E-02 ppm1      1.469 ppm2      4.214 CV     1
 OR { 1919}
   (( segid "    " and resid 4    and name HB2 ))
   (( segid "    " and resid 108  and name HA2 ))
 OR { 1919}
   (( segid "    " and resid 4    and name HB1 ))
   (( segid "    " and resid 108  and name HA1 ))
 OR { 1919}
   (( segid "    " and resid 4    and name HB1 ))
   (( segid "    " and resid 108  and name HA2 ))
 ASSI { 1922}
   (( segid "    " and resid 11   and name HB1 ))
   (( segid "    " and resid 12   and name HN  ))
      4.800     2.900     1.200 peak  1922 weight  0.10000E+01 volume  0.31624E-03 ppm1      1.454 ppm2      9.028 CV     1
 ASSI { 1925}
   (( segid "    " and resid 11   and name HB1 ))
   (( segid "    " and resid 10   and name HA1 ))
      3.900     1.900     1.900 peak  1925 weight  0.10000E+01 volume  0.11149E-02 ppm1      1.452 ppm2      4.047 CV     1
 ASSI { 1928}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 83   and name HB1 ))
      3.900     1.900     1.900 peak  1928 weight  0.10000E+01 volume  0.53091E-03 ppm1      1.458 ppm2      1.029 CV     1
 ASSI { 1938}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 87   and name HN  ))
      4.500     2.600     1.500 peak  1938 weight  0.10000E+01 volume  0.33159E-03 ppm1      1.429 ppm2      9.507 CV     1
 ASSI { 1940}
   (( segid "    " and resid 104  and name HB1 ))
   (( segid "    " and resid 105  and name HN  ))
      4.400     2.400     1.600 peak  1940 weight  0.10000E+01 volume  0.18420E-03 ppm1      1.351 ppm2      8.488 CV     1
 ASSI { 1942}
   (( segid "    " and resid 104  and name HB1 ))
   (( segid "    " and resid 103  and name HA  ))
      4.700     2.700     1.300 peak  1942 weight  0.10000E+01 volume  0.20030E-03 ppm1      1.350 ppm2      4.438 CV     1
 ASSI { 1949}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 77   and name HN  ))
      5.000     3.200     1.000 peak  1949 weight  0.10000E+01 volume  0.14056E-03 ppm1      1.054 ppm2      8.005 CV     1
 ASSI { 1950}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 77   and name HD21))
      2.600     0.800     0.800 peak  1950 weight  0.10000E+01 volume  0.41582E-02 ppm1      1.054 ppm2      7.207 CV     1
 ASSI { 1951}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 77   and name HD22))
      2.800     1.000     1.000 peak  1951 weight  0.10000E+01 volume  0.22596E-02 ppm1      1.054 ppm2      6.915 CV     1
 ASSI { 1964}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 23   and name HA  ))
      3.700     1.700     1.700 peak  1964 weight  0.10000E+01 volume  0.10667E-02 ppm1      1.060 ppm2      4.875 CV     1
 ASSI { 1965}
   (( segid "    " and resid 18   and name HB1 ))
   (( segid "    " and resid 83   and name HN  ))
      4.600     2.600     1.400 peak  1965 weight  0.10000E+01 volume  0.14677E-03 ppm1      1.295 ppm2      8.835 CV     1
 OR { 1965}
   (( segid "    " and resid 18   and name HB2 ))
   (( segid "    " and resid 83   and name HN  ))
 ASSI { 1967}
   (( segid "    " and resid 18   and name HB1 ))
   (( segid "    " and resid 19   and name HN  ))
      3.500     1.600     1.600 peak  1967 weight  0.10000E+01 volume  0.83804E-03 ppm1      1.298 ppm2      8.140 CV     1
 OR { 1967}
   (( segid "    " and resid 18   and name HB2 ))
   (( segid "    " and resid 19   and name HN  ))
 ASSI { 1974}
   (( segid "    " and resid 18   and name HB1 ))
   (  segid "    " and resid 20   and name HG1%)
      4.100     2.100     1.900 peak  1974 weight  0.10000E+01 volume  0.43752E-03 ppm1      1.298 ppm2      0.296 CV     1
 OR { 1974}
   (( segid "    " and resid 18   and name HB2 ))
   (  segid "    " and resid 20   and name HG1%)
 ASSI { 1975}
   (( segid "    " and resid 98   and name HB1 ))
   (( segid "    " and resid 99   and name HN  ))
      4.400     2.500     1.600 peak  1975 weight  0.10000E+01 volume  0.27567E-03 ppm1      1.471 ppm2      8.493 CV     1
 ASSI { 1976}
   (( segid "    " and resid 98   and name HB2 ))
   (( segid "    " and resid 99   and name HN  ))
      3.800     1.800     1.800 peak  1976 weight  0.10000E+01 volume  0.33666E-03 ppm1      1.378 ppm2      8.485 CV     1
 ASSI { 1981}
   (( segid "    " and resid 98   and name HB1 ))
   (( segid "    " and resid 106  and name HN  ))
      6.000     6.000     0.000 peak  1981 weight  0.10000E+01 volume  0.20703E-04 ppm1      1.475 ppm2      7.762 CV     1
 ASSI { 1984}
   (( segid "    " and resid 98   and name HB2 ))
   (( segid "    " and resid 34   and name HA  ))
      5.700     4.000     0.300 peak  1984 weight  0.10000E+01 volume  0.57322E-04 ppm1      1.385 ppm2      5.658 CV     1
 ASSI { 1985}
   (( segid "    " and resid 98   and name HB1 ))
   (( segid "    " and resid 97   and name HA  ))
      4.900     2.900     1.100 peak  1985 weight  0.10000E+01 volume  0.15678E-03 ppm1      1.487 ppm2      4.864 CV     1
 ASSI { 1986}
   (( segid "    " and resid 98   and name HB2 ))
   (( segid "    " and resid 97   and name HA  ))
      6.000     5.000     0.000 peak  1986 weight  0.10000E+01 volume  0.51127E-04 ppm1      1.379 ppm2      4.872 CV     1
 ASSI { 1987}
   (( segid "    " and resid 98   and name HB1 ))
   (( segid "    " and resid 34   and name HG2 ))
      3.500     1.600     1.600 peak  1987 weight  0.10000E+01 volume  0.30581E-03 ppm1      1.476 ppm2      2.396 CV     1
 ASSI { 1988}
   (( segid "    " and resid 98   and name HB2 ))
   (( segid "    " and resid 34   and name HG2 ))
      4.200     2.200     1.800 peak  1988 weight  0.10000E+01 volume  0.21598E-03 ppm1      1.388 ppm2      2.394 CV     1
 ASSI { 2005}
   (( segid "    " and resid 19   and name HB2 ))
   (( segid "    " and resid 82   and name HA  ))
      4.100     2.100     1.900 peak  2005 weight  0.10000E+01 volume  0.26711E-03 ppm1      1.646 ppm2      4.199 CV     1
 ASSI { 2014}
   (( segid "    " and resid 83   and name HG1 ))
   (  segid "    " and resid 68   and name HE% )
      5.300     3.600     0.700 peak  2014 weight  0.10000E+01 volume  0.98189E-04 ppm1      1.345 ppm2      6.993 CV     1
 OR { 2014}
   (( segid "    " and resid 83   and name HG1 ))
   (( segid "    " and resid 68   and name HZ  ))
 OR { 2014}
   (( segid "    " and resid 83   and name HG1 ))
   (  segid "    " and resid 68   and name HD% )
 ASSI { 2016}
   (( segid "    " and resid 83   and name HG1 ))
   (( segid "    " and resid 82   and name HA  ))
      4.500     2.600     1.500 peak  2016 weight  0.10000E+01 volume  0.13397E-03 ppm1      1.350 ppm2      4.197 CV     1
 ASSI { 2021}
   (( segid "    " and resid 83   and name HG1 ))
   (  segid "    " and resid 81   and name HD2%)
      3.100     1.200     1.200 peak  2021 weight  0.10000E+01 volume  0.15259E-02 ppm1      1.347 ppm2      0.148 CV     1
 ASSI { 2026}
   (( segid "    " and resid 67   and name HB1 ))
   (( segid "    " and resid 85   and name HB2 ))
      4.700     2.700     1.300 peak  2026 weight  0.10000E+01 volume  0.14661E-03 ppm1      1.628 ppm2      3.682 CV     1
 OR { 2026}
   (( segid "    " and resid 67   and name HB1 ))
   (( segid "    " and resid 85   and name HA  ))
 ASSI { 2031}
   (( segid "    " and resid 70   and name HG12))
   (( segid "    " and resid 36   and name HE1 ))
      5.300     3.500     0.700 peak  2031 weight  0.10000E+01 volume  0.13931E-03 ppm1      1.264 ppm2      7.876 CV     1
 ASSI { 2054}
   (( segid "    " and resid 72   and name HG2 ))
   (  segid "    " and resid 51   and name HD1%)
      4.000     2.000     2.000 peak  2054 weight  0.10000E+01 volume  0.35532E-03 ppm1      1.673 ppm2      0.839 CV     1
 ASSI { 2063}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 47   and name HD1 ))
      2.600     0.800     0.800 peak  2063 weight  0.10000E+01 volume  0.34616E-02 ppm1      1.468 ppm2      6.772 CV     1
 ASSI { 2074}
   (  segid "    " and resid 35   and name HB% )
   (  segid "    " and resid 104  and name HD2%)
      2.900     1.000     1.000 peak  2074 weight  0.10000E+01 volume  0.18351E-02 ppm1      1.468 ppm2      0.399 CV     1
 ASSI { 2102}
   (( segid "    " and resid 11   and name HG  ))
   (( segid "    " and resid 12   and name HN  ))
      4.300     2.300     1.700 peak  2102 weight  0.10000E+01 volume  0.40128E-03 ppm1      1.449 ppm2      9.027 CV     1
 ASSI { 2127}
   (( segid "    " and resid 45   and name HG  ))
   (  segid "    " and resid 37   and name HG2%)
      2.300     0.700     0.700 peak  2127 weight  0.10000E+01 volume  0.45822E-02 ppm1      1.263 ppm2      0.646 CV     1
 ASSI { 2131}
   (( segid "    " and resid 67   and name HG2 ))
   (  segid "    " and resid 68   and name HD% )
      4.100     2.100     1.900 peak  2131 weight  0.10000E+01 volume  0.17497E-03 ppm1      1.452 ppm2      6.962 CV     1
 OR { 2131}
   (( segid "    " and resid 67   and name HG2 ))
   (  segid "    " and resid 68   and name HE% )
 ASSI { 2132}
   (( segid "    " and resid 67   and name HG1 ))
   (  segid "    " and resid 68   and name HD% )
      5.300     3.500     0.700 peak  2132 weight  0.10000E+01 volume  0.73309E-04 ppm1      1.348 ppm2      6.977 CV     1
 OR { 2132}
   (( segid "    " and resid 67   and name HG1 ))
   (  segid "    " and resid 68   and name HE% )
 ASSI { 2133}
   (( segid "    " and resid 67   and name HG1 ))
   (( segid "    " and resid 85   and name HB1 ))
      4.000     2.000     2.000 peak  2133 weight  0.10000E+01 volume  0.36078E-03 ppm1      1.345 ppm2      4.038 CV     1
 ASSI { 2135}
   (( segid "    " and resid 67   and name HG2 ))
   (( segid "    " and resid 85   and name HB2 ))
      4.400     2.500     1.600 peak  2135 weight  0.10000E+01 volume  0.20621E-03 ppm1      1.441 ppm2      3.699 CV     1
 ASSI { 2136}
   (( segid "    " and resid 67   and name HG1 ))
   (( segid "    " and resid 85   and name HB2 ))
      3.300     1.300     1.300 peak  2136 weight  0.10000E+01 volume  0.55147E-03 ppm1      1.346 ppm2      3.680 CV     1
 OR { 2136}
   (( segid "    " and resid 67   and name HG1 ))
   (( segid "    " and resid 85   and name HA  ))
 ASSI { 2141}
   (( segid "    " and resid 67   and name HG2 ))
   (  segid "    " and resid 64   and name HG2%)
      3.800     1.800     1.800 peak  2141 weight  0.10000E+01 volume  0.41127E-03 ppm1      1.444 ppm2      0.833 CV     1
 ASSI { 2143}
   (( segid "    " and resid 86   and name HG  ))
   (( segid "    " and resid 87   and name HN  ))
      4.600     2.700     1.400 peak  2143 weight  0.10000E+01 volume  0.16646E-03 ppm1      1.284 ppm2      9.507 CV     1
 ASSI { 2150}
   (( segid "    " and resid 86   and name HG  ))
   (  segid "    " and resid 115  and name HG1%)
      3.600     1.600     1.600 peak  2150 weight  0.10000E+01 volume  0.52438E-03 ppm1      1.287 ppm2      0.673 CV     1
 ASSI { 2155}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 6    and name HA  ))
      4.100     2.100     1.900 peak  2155 weight  0.10000E+01 volume  0.99725E-04 ppm1      1.409 ppm2      5.760 CV     1
 ASSI { 2156}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 22   and name HA  ))
      4.500     2.500     1.500 peak  2156 weight  0.10000E+01 volume  0.40678E-03 ppm1      1.411 ppm2      5.369 CV     1
 ASSI { 2159}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 78   and name HB  ))
      6.000     6.000     0.000 peak  2159 weight  0.10000E+01 volume  0.24548E-04 ppm1      1.414 ppm2      3.483 CV     1
 ASSI { 2160}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 22   and name HB2 ))
      5.400     3.600     0.600 peak  2160 weight  0.10000E+01 volume  0.10905E-03 ppm1      1.415 ppm2      3.045 CV     1
 ASSI { 2162}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 5    and name HG2 ))
      2.800     1.000     1.000 peak  2162 weight  0.10000E+01 volume  0.99978E-03 ppm1      1.410 ppm2      2.295 CV     1
 OR { 2162}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 5    and name HG1 ))
 ASSI { 2165}
   (  segid "    " and resid 23   and name HB% )
   (  segid "    " and resid 24   and name HB% )
      4.600     2.700     1.400 peak  2165 weight  0.10000E+01 volume  0.35167E-03 ppm1      1.410 ppm2      1.033 CV     1
 ASSI { 2171}
   (  segid "    " and resid 91   and name HG2%)
   (( segid "    " and resid 112  and name HE21))
      3.800     1.800     1.800 peak  2171 weight  0.10000E+01 volume  0.49030E-03 ppm1      1.505 ppm2      6.624 CV     1
 ASSI { 2179}
   (  segid "    " and resid 91   and name HG2%)
   (  segid "    " and resid 114  and name HG2%)
      2.700     0.900     0.900 peak  2179 weight  0.10000E+01 volume  0.25887E-02 ppm1      1.505 ppm2      1.113 CV     1
 ASSI { 2181}
   (  segid "    " and resid 91   and name HG2%)
   (  segid "    " and resid 115  and name HG1%)
      4.100     2.100     1.900 peak  2181 weight  0.10000E+01 volume  0.59576E-03 ppm1      1.508 ppm2      0.623 CV     1
 ASSI { 2182}
   (  segid "    " and resid 91   and name HG2%)
   (  segid "    " and resid 115  and name HG2%)
      5.000     3.200     1.000 peak  2182 weight  0.10000E+01 volume  0.16383E-03 ppm1      1.505 ppm2      0.420 CV     1
 ASSI { 2183}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 70   and name HN  ))
      5.300     3.600     0.700 peak  2183 weight  0.10000E+01 volume  0.11651E-03 ppm1      1.264 ppm2      9.253 CV     1
 ASSI { 2189}
   (  segid "    " and resid 58   and name HG2%)
   (  segid "    " and resid 60   and name HE% )
      4.300     2.300     1.700 peak  2189 weight  0.10000E+01 volume  0.35674E-03 ppm1      1.266 ppm2      6.756 CV     1
 ASSI { 2193}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 70   and name HG11))
      5.500     3.800     0.500 peak  2193 weight  0.10000E+01 volume  0.15276E-03 ppm1      1.267 ppm2      2.207 CV     1
 ASSI { 2195}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 51   and name HG11))
      3.100     1.200     1.200 peak  2195 weight  0.10000E+01 volume  0.22466E-02 ppm1      1.264 ppm2      1.631 CV     1
 OR { 2195}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 51   and name HB  ))
 ASSI { 2198}
   (  segid "    " and resid 58   and name HG2%)
   (  segid "    " and resid 51   and name HD1%)
      2.900     1.100     1.100 peak  2198 weight  0.10000E+01 volume  0.21080E-02 ppm1      1.268 ppm2      0.827 CV     1
 ASSI { 2200}
   (  segid "    " and resid 103  and name HB% )
   (( segid "    " and resid 104  and name HN  ))
      3.300     1.300     1.300 peak  2200 weight  0.10000E+01 volume  0.11404E-02 ppm1      1.295 ppm2      8.136 CV     1
 ASSI { 2206}
   (  segid "    " and resid 103  and name HB% )
   (( segid "    " and resid 105  and name HB2 ))
      4.300     2.400     1.700 peak  2206 weight  0.10000E+01 volume  0.20023E-03 ppm1      1.299 ppm2      2.385 CV     1
 OR { 2206}
   (  segid "    " and resid 103  and name HB% )
   (( segid "    " and resid 105  and name HB1 ))
 ASSI { 2211}
   (( segid "    " and resid 38   and name HG1 ))
   (( segid "    " and resid 92   and name HN  ))
      5.300     3.600     0.700 peak  2211 weight  0.10000E+01 volume  0.85353E-04 ppm1      1.304 ppm2      9.033 CV     1
 ASSI { 2228}
   (  segid "    " and resid 75   and name HB% )
   (( segid "    " and resid 76   and name HN  ))
      3.400     1.500     1.500 peak  2228 weight  0.10000E+01 volume  0.97205E-03 ppm1      1.554 ppm2      7.444 CV     1
 ASSI { 2231}
   (  segid "    " and resid 75   and name HB% )
   (( segid "    " and resid 76   and name HB1 ))
      3.400     1.500     1.500 peak  2231 weight  0.10000E+01 volume  0.67518E-03 ppm1      1.560 ppm2      1.987 CV     1
 ASSI { 2236}
   (  segid "    " and resid 40   and name HB% )
   (( segid "    " and resid 38   and name HD2 ))
      4.800     2.800     1.200 peak  2236 weight  0.10000E+01 volume  0.29009E-03 ppm1      1.467 ppm2      2.483 CV     1
 OR { 2236}
   (  segid "    " and resid 40   and name HB% )
   (( segid "    " and resid 38   and name HD1 ))
 ASSI { 2237}
   (  segid "    " and resid 40   and name HB% )
   (( segid "    " and resid 43   and name HE2 ))
      3.700     1.700     1.700 peak  2237 weight  0.10000E+01 volume  0.48258E-03 ppm1      1.458 ppm2      2.987 CV     1
 OR { 2237}
   (  segid "    " and resid 40   and name HB% )
   (( segid "    " and resid 43   and name HE1 ))
 ASSI { 2239}
   (  segid "    " and resid 40   and name HB% )
   (( segid "    " and resid 41   and name HD1 ))
      2.500     0.800     0.800 peak  2239 weight  0.10000E+01 volume  0.43521E-02 ppm1      1.457 ppm2      3.809 CV     1
 ASSI { 2244}
   (  segid "    " and resid 40   and name HB% )
   (( segid "    " and resid 41   and name HG1 ))
      3.300     1.300     1.300 peak  2244 weight  0.10000E+01 volume  0.30477E-02 ppm1      1.457 ppm2      1.966 CV     1
 OR { 2244}
   (  segid "    " and resid 40   and name HB% )
   (( segid "    " and resid 41   and name HB2 ))
 ASSI { 2245}
   (  segid "    " and resid 61   and name HB% )
   (( segid "    " and resid 62   and name HN  ))
      4.200     2.200     1.800 peak  2245 weight  0.10000E+01 volume  0.23988E-03 ppm1      1.408 ppm2      8.993 CV     1
 ASSI { 2247}
   (  segid "    " and resid 61   and name HB% )
   (( segid "    " and resid 47   and name HE3 ))
      3.000     1.100     1.100 peak  2247 weight  0.10000E+01 volume  0.14625E-02 ppm1      1.409 ppm2      7.453 CV     1
 ASSI { 2250}
   (  segid "    " and resid 61   and name HB% )
   (( segid "    " and resid 47   and name HH2 ))
      3.400     1.500     1.500 peak  2250 weight  0.10000E+01 volume  0.15048E-02 ppm1      1.410 ppm2      6.831 CV     1
 ASSI { 2253}
   (  segid "    " and resid 61   and name HB% )
   (( segid "    " and resid 47   and name HB1 ))
      3.500     1.500     1.500 peak  2253 weight  0.10000E+01 volume  0.26193E-03 ppm1      1.415 ppm2      3.219 CV     1
 OR { 2253}
   (  segid "    " and resid 61   and name HB% )
   (( segid "    " and resid 47   and name HB2 ))
 ASSI { 2254}
   (  segid "    " and resid 61   and name HB% )
   (( segid "    " and resid 62   and name HB2 ))
      4.300     2.400     1.700 peak  2254 weight  0.10000E+01 volume  0.22487E-03 ppm1      1.410 ppm2      2.723 CV     1
 OR { 2254}
   (  segid "    " and resid 61   and name HB% )
   (( segid "    " and resid 62   and name HB1 ))
 ASSI { 2256}
   (  segid "    " and resid 61   and name HB% )
   (  segid "    " and resid 48   and name HG1%)
      3.100     1.200     1.200 peak  2256 weight  0.10000E+01 volume  0.18668E-02 ppm1      1.412 ppm2      1.026 CV     1
 OR { 2256}
   (  segid "    " and resid 61   and name HB% )
   (  segid "    " and resid 48   and name HG1%)
 ASSI { 2258}
   (  segid "    " and resid 61   and name HB% )
   (  segid "    " and resid 64   and name HG1%)
      3.800     1.900     1.900 peak  2258 weight  0.10000E+01 volume  0.60707E-03 ppm1      1.411 ppm2      0.181 CV     1
 ASSI { 2259}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 51   and name HN  ))
      3.200     1.300     1.300 peak  2259 weight  0.10000E+01 volume  0.10736E-02 ppm1      1.202 ppm2      9.363 CV     1
 ASSI { 2262}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 34   and name HN  ))
      4.100     2.100     1.900 peak  2262 weight  0.10000E+01 volume  0.26378E-03 ppm1      1.202 ppm2      8.012 CV     1
 ASSI { 2267}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 35   and name HA  ))
      3.500     1.500     1.500 peak  2267 weight  0.10000E+01 volume  0.12410E-02 ppm1      1.203 ppm2      5.734 CV     1
 ASSI { 2272}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 33   and name HB1 ))
      3.200     1.300     1.300 peak  2272 weight  0.10000E+01 volume  0.68461E-03 ppm1      1.203 ppm2      3.268 CV     1
 ASSI { 2277}
   (  segid "    " and resid 28   and name HG2%)
   (( segid "    " and resid 30   and name HN  ))
      4.500     2.500     1.500 peak  2277 weight  0.10000E+01 volume  0.15553E-03 ppm1      1.234 ppm2      8.489 CV     1
 ASSI { 2278}
   (  segid "    " and resid 28   and name HG2%)
   (( segid "    " and resid 29   and name HN  ))
      3.500     1.600     1.600 peak  2278 weight  0.10000E+01 volume  0.63655E-03 ppm1      1.231 ppm2      8.245 CV     1
 ASSI { 2279}
   (  segid "    " and resid 28   and name HG2%)
   (( segid "    " and resid 31   and name HN  ))
      6.000     5.800     0.000 peak  2279 weight  0.10000E+01 volume  0.13387E-04 ppm1      1.238 ppm2      7.774 CV     1
 ASSI { 2281}
   (  segid "    " and resid 28   and name HG2%)
   (( segid "    " and resid 77   and name HD21))
      4.800     2.900     1.200 peak  2281 weight  0.10000E+01 volume  0.18588E-03 ppm1      1.232 ppm2      7.240 CV     1
 ASSI { 2282}
   (  segid "    " and resid 28   and name HG2%)
   (( segid "    " and resid 77   and name HD22))
      4.800     2.900     1.200 peak  2282 weight  0.10000E+01 volume  0.18455E-03 ppm1      1.232 ppm2      6.886 CV     1
 ASSI { 2284}
   (  segid "    " and resid 28   and name HG2%)
   (( segid "    " and resid 30   and name HA  ))
      3.900     1.900     1.900 peak  2284 weight  0.10000E+01 volume  0.62694E-03 ppm1      1.231 ppm2      4.027 CV     1
 ASSI { 2286}
   (  segid "    " and resid 28   and name HG2%)
   (( segid "    " and resid 31   and name HB2 ))
      3.800     1.800     1.800 peak  2286 weight  0.10000E+01 volume  0.42778E-03 ppm1      1.232 ppm2      3.669 CV     1
 OR { 2286}
   (  segid "    " and resid 28   and name HG2%)
   (( segid "    " and resid 31   and name HB1 ))
 ASSI { 2289}
   (  segid "    " and resid 69   and name HG2%)
   (( segid "    " and resid 70   and name HN  ))
      3.400     1.400     1.400 peak  2289 weight  0.10000E+01 volume  0.69478E-03 ppm1      1.189 ppm2      9.245 CV     1
 ASSI { 2291}
   (  segid "    " and resid 69   and name HG2%)
   (( segid "    " and resid 72   and name HN  ))
      5.000     3.200     1.000 peak  2291 weight  0.10000E+01 volume  0.15078E-03 ppm1      1.191 ppm2      9.057 CV     1
 ASSI { 2296}
   (  segid "    " and resid 69   and name HG2%)
   (( segid "    " and resid 83   and name HA  ))
      4.300     2.300     1.700 peak  2296 weight  0.10000E+01 volume  0.35316E-03 ppm1      1.187 ppm2      3.991 CV     1
 ASSI { 2297}
   (  segid "    " and resid 69   and name HG2%)
   (( segid "    " and resid 82   and name HG1 ))
      5.100     3.200     0.900 peak  2297 weight  0.10000E+01 volume  0.14653E-03 ppm1      1.189 ppm2      2.355 CV     1
 ASSI { 2299}
   (  segid "    " and resid 69   and name HG2%)
   (( segid "    " and resid 82   and name HB1 ))
      3.200     1.300     1.300 peak  2299 weight  0.10000E+01 volume  0.11454E-02 ppm1      1.190 ppm2      1.946 CV     1
 OR { 2299}
   (  segid "    " and resid 69   and name HG2%)
   (( segid "    " and resid 82   and name HB2 ))
 OR { 2299}
   (  segid "    " and resid 69   and name HG2%)
   (( segid "    " and resid 82   and name HG2 ))
 ASSI { 2301}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 35   and name HN  ))
      4.200     2.200     1.800 peak  2301 weight  0.10000E+01 volume  0.23135E-03 ppm1      1.129 ppm2      9.152 CV     1
 ASSI { 2305}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 98   and name HN  ))
      3.100     1.200     1.200 peak  2305 weight  0.10000E+01 volume  0.14037E-02 ppm1      1.128 ppm2      8.125 CV     1
 ASSI { 2307}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 106  and name HN  ))
      4.300     2.300     1.700 peak  2307 weight  0.10000E+01 volume  0.15724E-03 ppm1      1.127 ppm2      7.749 CV     1
 ASSI { 2308}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 107  and name HE3 ))
      3.700     1.700     1.700 peak  2308 weight  0.10000E+01 volume  0.74679E-03 ppm1      1.128 ppm2      7.090 CV     1
 OR { 2308}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 107  and name HZ2 ))
 OR { 2308}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 107  and name HZ3 ))
 ASSI { 2311}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 36   and name HA  ))
      3.400     1.500     1.500 peak  2311 weight  0.10000E+01 volume  0.29141E-03 ppm1      1.128 ppm2      5.498 CV     1
 ASSI { 2315}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 104  and name HA  ))
      4.200     2.200     1.800 peak  2315 weight  0.10000E+01 volume  0.29226E-03 ppm1      1.126 ppm2      3.936 CV     1
 ASSI { 2316}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 107  and name HB1 ))
      3.200     1.300     1.300 peak  2316 weight  0.10000E+01 volume  0.12501E-02 ppm1      1.129 ppm2      3.083 CV     1
 OR { 2316}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 107  and name HB2 ))
 ASSI { 2318}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 99   and name HB1 ))
      5.000     3.100     1.000 peak  2318 weight  0.10000E+01 volume  0.15877E-03 ppm1      1.127 ppm2      2.687 CV     1
 OR { 2318}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 99   and name HB2 ))
 ASSI { 2323}
   (  segid "    " and resid 97   and name HB% )
   (  segid "    " and resid 104  and name HD1%)
      2.300     0.700     0.700 peak  2323 weight  0.10000E+01 volume  0.61811E-02 ppm1      1.128 ppm2      0.590 CV     1
 ASSI { 2324}
   (  segid "    " and resid 97   and name HB% )
   (  segid "    " and resid 104  and name HD2%)
      2.700     0.900     0.900 peak  2324 weight  0.10000E+01 volume  0.25400E-02 ppm1      1.128 ppm2      0.407 CV     1
 ASSI { 2330}
   (( segid "    " and resid 51   and name HG12))
   (( segid "    " and resid 52   and name HN  ))
      3.800     1.800     1.800 peak  2330 weight  0.10000E+01 volume  0.26636E-03 ppm1      1.075 ppm2      8.495 CV     1
 ASSI { 2336}
   (( segid "    " and resid 64   and name HB  ))
   (  segid "    " and resid 68   and name HD% )
      4.000     2.000     2.000 peak  2336 weight  0.10000E+01 volume  0.31473E-03 ppm1      1.044 ppm2      6.950 CV     1
 OR { 2336}
   (( segid "    " and resid 64   and name HB  ))
   (  segid "    " and resid 68   and name HE% )
 OR { 2336}
   (( segid "    " and resid 64   and name HB  ))
   (( segid "    " and resid 68   and name HZ  ))
 ASSI { 2342}
   (( segid "    " and resid 83   and name HB1 ))
   (( segid "    " and resid 18   and name HN  ))
      4.100     2.100     1.900 peak  2342 weight  0.10000E+01 volume  0.11936E-03 ppm1      1.009 ppm2      8.643 CV     1
 ASSI { 2343}
   (( segid "    " and resid 83   and name HB1 ))
   (( segid "    " and resid 84   and name HN  ))
      5.800     4.300     0.200 peak  2343 weight  0.10000E+01 volume  0.63407E-04 ppm1      1.010 ppm2      7.739 CV     1
 ASSI { 2344}
   (( segid "    " and resid 83   and name HB1 ))
   (  segid "    " and resid 68   and name HE% )
      5.500     3.700     0.500 peak  2344 weight  0.10000E+01 volume  0.16888E-03 ppm1      1.020 ppm2      7.011 CV     1
 OR { 2344}
   (( segid "    " and resid 83   and name HB1 ))
   (  segid "    " and resid 68   and name HD% )
 OR { 2344}
   (( segid "    " and resid 83   and name HB1 ))
   (( segid "    " and resid 68   and name HZ  ))
 ASSI { 2349}
   (( segid "    " and resid 83   and name HB1 ))
   (  segid "    " and resid 86   and name HD1%)
      3.100     1.200     1.200 peak  2349 weight  0.10000E+01 volume  0.10115E-02 ppm1      1.011 ppm2      0.506 CV     1
 ASSI { 2357}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 91   and name HA  ))
      3.300     1.300     1.300 peak  2357 weight  0.10000E+01 volume  0.13926E-02 ppm1      1.114 ppm2      4.392 CV     1
 OR { 2357}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 91   and name HB  ))
 ASSI { 2359}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 116  and name HB2 ))
      3.400     1.400     1.400 peak  2359 weight  0.10000E+01 volume  0.66966E-03 ppm1      1.115 ppm2      3.532 CV     1
 ASSI { 2361}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 115  and name HB  ))
      4.000     2.000     2.000 peak  2361 weight  0.10000E+01 volume  0.77871E-03 ppm1      1.116 ppm2      1.920 CV     1
 ASSI { 2363}
   (  segid "    " and resid 114  and name HG2%)
   (  segid "    " and resid 11   and name HD2%)
      2.600     0.900     0.900 peak  2363 weight  0.10000E+01 volume  0.44767E-02 ppm1      1.114 ppm2      0.835 CV     1
 OR { 2363}
   (  segid "    " and resid 114  and name HG2%)
   (  segid "    " and resid 11   and name HD1%)
 ASSI { 2364}
   (  segid "    " and resid 92   and name HB% )
   (( segid "    " and resid 94   and name HH  ))
      4.300     2.300     1.700 peak  2364 weight  0.10000E+01 volume  0.28667E-03 ppm1      1.115 ppm2     10.267 CV     1
 ASSI { 2369}
   (  segid "    " and resid 92   and name HB% )
   (  segid "    " and resid 94   and name HE% )
      2.800     1.000     1.000 peak  2369 weight  0.10000E+01 volume  0.21301E-02 ppm1      1.114 ppm2      6.748 CV     1
 ASSI { 2371}
   (  segid "    " and resid 92   and name HB% )
   (( segid "    " and resid 38   and name HE  ))
      3.200     1.300     1.300 peak  2371 weight  0.10000E+01 volume  0.39038E-03 ppm1      1.112 ppm2      7.254 CV     1
 ASSI { 2376}
   (  segid "    " and resid 92   and name HB% )
   (( segid "    " and resid 38   and name HD2 ))
      2.800     1.000     1.000 peak  2376 weight  0.10000E+01 volume  0.17887E-02 ppm1      1.113 ppm2      2.541 CV     1
 OR { 2376}
   (  segid "    " and resid 92   and name HB% )
   (( segid "    " and resid 38   and name HD1 ))
 ASSI { 2377}
   (  segid "    " and resid 92   and name HB% )
   (( segid "    " and resid 39   and name HB1 ))
      3.200     1.300     1.300 peak  2377 weight  0.10000E+01 volume  0.12804E-02 ppm1      1.113 ppm2      2.300 CV     1
 OR { 2377}
   (  segid "    " and resid 92   and name HB% )
   (( segid "    " and resid 39   and name HG1 ))
 ASSI { 2378}
   (  segid "    " and resid 92   and name HB% )
   (( segid "    " and resid 93   and name HB  ))
      4.200     2.200     1.800 peak  2378 weight  0.10000E+01 volume  0.65329E-03 ppm1      1.114 ppm2      1.969 CV     1
 ASSI { 2379}
   (  segid "    " and resid 92   and name HB% )
   (  segid "    " and resid 40   and name HB% )
      2.400     0.700     0.700 peak  2379 weight  0.10000E+01 volume  0.47563E-02 ppm1      1.113 ppm2      1.438 CV     1
 ASSI { 2380}
   (  segid "    " and resid 92   and name HB% )
   (( segid "    " and resid 38   and name HB2 ))
      2.500     0.800     0.800 peak  2380 weight  0.10000E+01 volume  0.33610E-02 ppm1      1.113 ppm2      0.699 CV     1
 OR { 2380}
   (  segid "    " and resid 92   and name HB% )
   (( segid "    " and resid 38   and name HB1 ))
 ASSI { 2381}
   (  segid "    " and resid 92   and name HB% )
   (  segid "    " and resid 93   and name HG2%)
      4.000     2.000     2.000 peak  2381 weight  0.10000E+01 volume  0.89893E-03 ppm1      1.112 ppm2      0.386 CV     1
 ASSI { 2383}
   (  segid "    " and resid 111  and name HG2%)
   (( segid "    " and resid 94   and name HN  ))
      3.800     1.800     1.800 peak  2383 weight  0.10000E+01 volume  0.32110E-03 ppm1      1.066 ppm2      9.147 CV     1
 ASSI { 2386}
   (  segid "    " and resid 111  and name HG2%)
   (  segid "    " and resid 94   and name HD% )
      3.900     1.900     1.900 peak  2386 weight  0.10000E+01 volume  0.72251E-03 ppm1      1.067 ppm2      6.969 CV     1
 ASSI { 2391}
   (  segid "    " and resid 111  and name HG2%)
   (( segid "    " and resid 9    and name HA1 ))
      3.200     1.300     1.300 peak  2391 weight  0.10000E+01 volume  0.12171E-02 ppm1      1.067 ppm2      3.904 CV     1
 ASSI { 2394}
   (  segid "    " and resid 111  and name HG2%)
   (( segid "    " and resid 94   and name HB2 ))
      3.100     1.200     1.200 peak  2394 weight  0.10000E+01 volume  0.10832E-02 ppm1      1.066 ppm2      2.890 CV     1
 OR { 2394}
   (  segid "    " and resid 111  and name HG2%)
   (( segid "    " and resid 94   and name HB1 ))
 ASSI { 2396}
   (  segid "    " and resid 111  and name HG2%)
   (( segid "    " and resid 112  and name HG2 ))
      5.000     3.100     1.000 peak  2396 weight  0.10000E+01 volume  0.12650E-03 ppm1      1.069 ppm2      2.294 CV     1
 ASSI { 2400}
   (  segid "    " and resid 111  and name HG2%)
   (  segid "    " and resid 113  and name HG1%)
      3.100     1.200     1.200 peak  2400 weight  0.10000E+01 volume  0.13174E-02 ppm1      1.069 ppm2      0.589 CV     1
 OR { 2400}
   (  segid "    " and resid 111  and name HG2%)
   (  segid "    " and resid 113  and name HG2%)
 ASSI { 2401}
   (  segid "    " and resid 111  and name HG2%)
   (  segid "    " and resid 20   and name HG2%)
      3.500     1.500     1.500 peak  2401 weight  0.10000E+01 volume  0.53404E-03 ppm1      1.067 ppm2     -0.102 CV     1
 ASSI { 2405}
   (  segid "    " and resid 124  and name HG2%)
   (( segid "    " and resid 128  and name HB2 ))
      4.200     2.200     1.800 peak  2405 weight  0.10000E+01 volume  0.23459E-03 ppm1      0.896 ppm2      2.675 CV     1
 OR { 2405}
   (  segid "    " and resid 124  and name HG2%)
   (( segid "    " and resid 128  and name HB1 ))
 ASSI { 2411}
   (  segid "    " and resid 106  and name HB% )
   (( segid "    " and resid 105  and name HN  ))
      5.600     4.000     0.400 peak  2411 weight  0.10000E+01 volume  0.68870E-04 ppm1      0.982 ppm2      8.474 CV     1
 ASSI { 2413}
   (  segid "    " and resid 106  and name HB% )
   (( segid "    " and resid 98   and name HN  ))
      4.100     2.100     1.900 peak  2413 weight  0.10000E+01 volume  0.19336E-03 ppm1      0.980 ppm2      8.124 CV     1
 ASSI { 2417}
   (  segid "    " and resid 106  and name HB% )
   (( segid "    " and resid 107  and name HA  ))
      4.000     2.000     2.000 peak  2417 weight  0.10000E+01 volume  0.38934E-03 ppm1      0.978 ppm2      5.028 CV     1
 ASSI { 2419}
   (  segid "    " and resid 106  and name HB% )
   (( segid "    " and resid 107  and name HB1 ))
      4.200     2.200     1.800 peak  2419 weight  0.10000E+01 volume  0.39786E-03 ppm1      0.980 ppm2      3.123 CV     1
 OR { 2419}
   (  segid "    " and resid 106  and name HB% )
   (( segid "    " and resid 107  and name HB2 ))
 ASSI { 2420}
   (  segid "    " and resid 106  and name HB% )
   (( segid "    " and resid 105  and name HB1 ))
      3.100     1.200     1.200 peak  2420 weight  0.10000E+01 volume  0.53225E-03 ppm1      0.980 ppm2      2.411 CV     1
 OR { 2420}
   (  segid "    " and resid 106  and name HB% )
   (( segid "    " and resid 105  and name HB2 ))
 ASSI { 2421}
   (  segid "    " and resid 106  and name HB% )
   (( segid "    " and resid 98   and name HE2 ))
      3.600     1.700     1.700 peak  2421 weight  0.10000E+01 volume  0.37336E-03 ppm1      0.981 ppm2      1.929 CV     1
 ASSI { 2422}
   (  segid "    " and resid 106  and name HB% )
   (( segid "    " and resid 98   and name HE1 ))
      4.100     2.100     1.900 peak  2422 weight  0.10000E+01 volume  0.27959E-03 ppm1      0.981 ppm2      1.706 CV     1
 ASSI { 2424}
   (  segid "    " and resid 106  and name HB% )
   (( segid "    " and resid 97   and name HA  ))
      4.700     2.700     1.300 peak  2424 weight  0.10000E+01 volume  0.17887E-03 ppm1      0.973 ppm2      4.825 CV     1
 ASSI { 2425}
   (  segid "    " and resid 106  and name HB% )
   (  segid "    " and resid 4    and name HD1%)
      2.700     0.900     0.900 peak  2425 weight  0.10000E+01 volume  0.26281E-02 ppm1      0.979 ppm2      0.579 CV     1
 ASSI { 2427}
   (  segid "    " and resid 93   and name HG1%)
   (( segid "    " and resid 94   and name HN  ))
      3.900     1.900     1.900 peak  2427 weight  0.10000E+01 volume  0.54830E-03 ppm1      0.948 ppm2      9.132 CV     1
 ASSI { 2436}
   (  segid "    " and resid 93   and name HG1%)
   (( segid "    " and resid 110  and name HA2 ))
      4.600     2.600     1.400 peak  2436 weight  0.10000E+01 volume  0.24675E-03 ppm1      0.947 ppm2      2.640 CV     1
 ASSI { 2440}
   (  segid "    " and resid 93   and name HG1%)
   (  segid "    " and resid 40   and name HB% )
      3.300     1.400     1.400 peak  2440 weight  0.10000E+01 volume  0.32979E-03 ppm1      0.948 ppm2      1.430 CV     1
 ASSI { 2441}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 38   and name HN  ))
      4.700     2.800     1.300 peak  2441 weight  0.10000E+01 volume  0.27446E-03 ppm1      0.989 ppm2      9.420 CV     1
 OR { 2441}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 38   and name HN  ))
 ASSI { 2445}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 61   and name HN  ))
      3.800     1.800     1.800 peak  2445 weight  0.10000E+01 volume  0.42564E-03 ppm1      0.989 ppm2      7.650 CV     1
 OR { 2445}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 61   and name HN  ))
 ASSI { 2450}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 37   and name HA  ))
      4.900     3.000     1.100 peak  2450 weight  0.10000E+01 volume  0.27344E-03 ppm1      0.988 ppm2      5.091 CV     1
 OR { 2450}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 37   and name HA  ))
 ASSI { 2452}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 49   and name HB2 ))
      3.900     1.900     1.900 peak  2452 weight  0.10000E+01 volume  0.53459E-03 ppm1      0.985 ppm2      3.532 CV     1
 OR { 2452}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 49   and name HB2 ))
 ASSI { 2453}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 36   and name HB1 ))
      3.700     1.700     1.700 peak  2453 weight  0.10000E+01 volume  0.79296E-03 ppm1      0.985 ppm2      3.118 CV     1
 OR { 2453}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 36   and name HB1 ))
 ASSI { 2455}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 36   and name HB2 ))
      3.800     1.800     1.800 peak  2455 weight  0.10000E+01 volume  0.73916E-03 ppm1      0.984 ppm2      2.780 CV     1
 OR { 2455}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 36   and name HB2 ))
 ASSI { 2457}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 46   and name HG2 ))
      3.400     1.400     1.400 peak  2457 weight  0.10000E+01 volume  0.95789E-03 ppm1      0.986 ppm2      2.163 CV     1
 OR { 2457}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 46   and name HG2 ))
 ASSI { 2459}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 38   and name HG2 ))
      3.100     1.200     1.200 peak  2459 weight  0.10000E+01 volume  0.21687E-02 ppm1      0.984 ppm2      1.401 CV     1
 OR { 2459}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 38   and name HG2 ))
 OR { 2459}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 38   and name HG1 ))
 OR { 2459}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 38   and name HG1 ))
 ASSI { 2460}
   (  segid "    " and resid 48   and name HG1%)
   (  segid "    " and resid 64   and name HG1%)
      2.700     0.900     0.900 peak  2460 weight  0.10000E+01 volume  0.31278E-02 ppm1      0.984 ppm2      0.165 CV     1
 OR { 2460}
   (  segid "    " and resid 48   and name HG1%)
   (  segid "    " and resid 64   and name HG1%)
 ASSI { 2461}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 38   and name HB2 ))
      3.200     1.300     1.300 peak  2461 weight  0.10000E+01 volume  0.21959E-02 ppm1      0.983 ppm2      0.672 CV     1
 OR { 2461}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 38   and name HB2 ))
 OR { 2461}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 38   and name HB1 ))
 OR { 2461}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 38   and name HB1 ))
 ASSI { 2470}
   (  segid "    " and resid 79   and name HD2%)
   (  segid "    " and resid 29   and name HE% )
      2.700     0.900     0.900 peak  2470 weight  0.10000E+01 volume  0.31598E-02 ppm1      0.926 ppm2      7.159 CV     1
 OR { 2470}
   (  segid "    " and resid 79   and name HD2%)
   (( segid "    " and resid 29   and name HZ  ))
 ASSI { 2475}
   (  segid "    " and resid 79   and name HD2%)
   (( segid "    " and resid 72   and name HD2 ))
      3.100     1.200     1.200 peak  2475 weight  0.10000E+01 volume  0.55248E-03 ppm1      0.938 ppm2      3.262 CV     1
 ASSI { 2479}
   (  segid "    " and resid 79   and name HD2%)
   (( segid "    " and resid 70   and name HG11))
      2.900     1.100     1.100 peak  2479 weight  0.10000E+01 volume  0.15450E-02 ppm1      0.943 ppm2      2.208 CV     1
 ASSI { 2485}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 83   and name HG2 ))
      4.000     2.000     2.000 peak  2485 weight  0.10000E+01 volume  0.38674E-03 ppm1      0.925 ppm2     -0.042 CV     1
 ASSI { 2493}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 94   and name HH  ))
      3.600     1.600     1.600 peak  2493 weight  0.10000E+01 volume  0.53422E-03 ppm1      0.922 ppm2     10.252 CV     1
 ASSI { 2500}
   (  segid "    " and resid 11   and name HD1%)
   (( segid "    " and resid 12   and name HN  ))
      3.600     1.600     1.600 peak  2500 weight  0.10000E+01 volume  0.96115E-03 ppm1      0.842 ppm2      9.022 CV     1
 OR { 2500}
   (  segid "    " and resid 11   and name HD2%)
   (( segid "    " and resid 12   and name HN  ))
 ASSI { 2514}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 48   and name HN  ))
      3.900     1.900     1.900 peak  2514 weight  0.10000E+01 volume  0.67454E-03 ppm1      0.866 ppm2      7.906 CV     1
 ASSI { 2516}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 47   and name HN  ))
      4.300     2.300     1.700 peak  2516 weight  0.10000E+01 volume  0.25324E-03 ppm1      0.860 ppm2      8.982 CV     1
 ASSI { 2520}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 47   and name HA  ))
      2.600     0.800     0.800 peak  2520 weight  0.10000E+01 volume  0.23301E-02 ppm1      0.865 ppm2      4.434 CV     1
 ASSI { 2527}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 36   and name HA  ))
      4.600     2.600     1.400 peak  2527 weight  0.10000E+01 volume  0.21584E-03 ppm1      0.868 ppm2      5.479 CV     1
 ASSI { 2537}
   (  segid "    " and resid 12   and name HG2%)
   (( segid "    " and resid 11   and name HA  ))
      4.200     2.200     1.800 peak  2537 weight  0.10000E+01 volume  0.52746E-03 ppm1      0.861 ppm2      5.248 CV     1
 ASSI { 2541}
   (  segid "    " and resid 12   and name HG2%)
   (( segid "    " and resid 16   and name HA1 ))
      3.300     1.400     1.400 peak  2541 weight  0.10000E+01 volume  0.76588E-03 ppm1      0.860 ppm2      3.711 CV     1
 ASSI { 2548}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 38   and name HN  ))
      3.200     1.300     1.300 peak  2548 weight  0.10000E+01 volume  0.88205E-03 ppm1      0.869 ppm2      9.406 CV     1
 OR { 2548}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 38   and name HN  ))
 ASSI { 2549}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 36   and name HN  ))
      5.200     3.400     0.800 peak  2549 weight  0.10000E+01 volume  0.10615E-03 ppm1      0.870 ppm2      8.749 CV     1
 OR { 2549}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 36   and name HN  ))
 ASSI { 2551}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 49   and name HN  ))
      3.100     1.200     1.200 peak  2551 weight  0.10000E+01 volume  0.21111E-02 ppm1      0.870 ppm2      7.149 CV     1
 OR { 2551}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 49   and name HN  ))
 ASSI { 2553}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 38   and name HA  ))
      3.600     1.600     1.600 peak  2553 weight  0.10000E+01 volume  0.19888E-03 ppm1      0.875 ppm2      5.799 CV     1
 OR { 2553}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 38   and name HA  ))
 ASSI { 2554}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 36   and name HA  ))
      5.100     3.200     0.900 peak  2554 weight  0.10000E+01 volume  0.94758E-04 ppm1      0.872 ppm2      5.473 CV     1
 OR { 2554}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 36   and name HA  ))
 ASSI { 2555}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 37   and name HA  ))
      3.000     1.100     1.100 peak  2555 weight  0.10000E+01 volume  0.10723E-02 ppm1      0.870 ppm2      5.086 CV     1
 OR { 2555}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 37   and name HA  ))
 ASSI { 2557}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 47   and name HA  ))
      4.000     2.000     2.000 peak  2557 weight  0.10000E+01 volume  0.40932E-03 ppm1      0.870 ppm2      4.434 CV     1
 OR { 2557}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 47   and name HA  ))
 ASSI { 2559}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 49   and name HB2 ))
      4.700     2.700     1.300 peak  2559 weight  0.10000E+01 volume  0.18869E-03 ppm1      0.877 ppm2      3.522 CV     1
 OR { 2559}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 49   and name HB2 ))
 ASSI { 2560}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 36   and name HB2 ))
      3.400     1.400     1.400 peak  2560 weight  0.10000E+01 volume  0.11740E-02 ppm1      0.870 ppm2      2.759 CV     1
 OR { 2560}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 36   and name HB2 ))
 ASSI { 2561}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 36   and name HB1 ))
      3.400     1.500     1.500 peak  2561 weight  0.10000E+01 volume  0.63844E-03 ppm1      0.870 ppm2      3.093 CV     1
 OR { 2561}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 36   and name HB1 ))
 ASSI { 2562}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 38   and name HD1 ))
      3.000     1.100     1.100 peak  2562 weight  0.10000E+01 volume  0.17651E-02 ppm1      0.870 ppm2      2.546 CV     1
 OR { 2562}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 38   and name HD1 ))
 OR { 2562}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 38   and name HD2 ))
 OR { 2562}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 38   and name HD2 ))
 ASSI { 2563}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 46   and name HG1 ))
      3.300     1.400     1.400 peak  2563 weight  0.10000E+01 volume  0.58601E-03 ppm1      0.871 ppm2      2.333 CV     1
 OR { 2563}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 46   and name HG1 ))
 ASSI { 2564}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 46   and name HG1 ))
      3.600     1.600     1.600 peak  2564 weight  0.10000E+01 volume  0.45832E-03 ppm1      0.870 ppm2      2.163 CV     1
 OR { 2564}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 46   and name HG1 ))
 OR { 2564}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 46   and name HG2 ))
 OR { 2564}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 46   and name HG2 ))
 ASSI { 2566}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 38   and name HG2 ))
      2.500     0.800     0.800 peak  2566 weight  0.10000E+01 volume  0.40305E-02 ppm1      0.869 ppm2      1.401 CV     1
 OR { 2566}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 38   and name HG2 ))
 OR { 2566}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 38   and name HG1 ))
 OR { 2566}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 38   and name HG1 ))
 ASSI { 2571}
   (  segid "    " and resid 64   and name HG2%)
   (  segid "    " and resid 60   and name HD% )
      3.200     1.300     1.300 peak  2571 weight  0.10000E+01 volume  0.20722E-02 ppm1      0.851 ppm2      7.082 CV     1
 ASSI { 2572}
   (  segid "    " and resid 64   and name HG2%)
   (  segid "    " and resid 68   and name HD% )
      3.000     1.200     1.200 peak  2572 weight  0.10000E+01 volume  0.15179E-02 ppm1      0.854 ppm2      6.934 CV     1
 OR { 2572}
   (  segid "    " and resid 64   and name HG2%)
   (  segid "    " and resid 68   and name HE% )
 OR { 2572}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 68   and name HZ  ))
 ASSI { 2574}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 68   and name HA  ))
      6.000     4.800     0.000 peak  2574 weight  0.10000E+01 volume  0.63352E-04 ppm1      0.855 ppm2      5.992 CV     1
 ASSI { 2581}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 48   and name HB  ))
      3.900     1.900     1.900 peak  2581 weight  0.10000E+01 volume  0.37381E-03 ppm1      0.856 ppm2      1.929 CV     1
 ASSI { 2588}
   (  segid "    " and resid 124  and name HD1%)
   (( segid "    " and resid 128  and name HB2 ))
      4.400     2.400     1.600 peak  2588 weight  0.10000E+01 volume  0.18268E-03 ppm1      0.833 ppm2      2.676 CV     1
 OR { 2588}
   (  segid "    " and resid 124  and name HD1%)
   (( segid "    " and resid 128  and name HB1 ))
 ASSI { 2595}
   (( segid "    " and resid 81   and name HB1 ))
   (( segid "    " and resid 36   and name HE1 ))
      4.100     2.100     1.900 peak  2595 weight  0.10000E+01 volume  0.14649E-03 ppm1      0.678 ppm2      7.904 CV     1
 ASSI { 2596}
   (( segid "    " and resid 81   and name HB1 ))
   (( segid "    " and resid 20   and name HN  ))
      6.000     5.300     0.000 peak  2596 weight  0.10000E+01 volume  0.29604E-04 ppm1      0.677 ppm2      8.140 CV     1
 ASSI { 2597}
   (( segid "    " and resid 81   and name HB1 ))
   (  segid "    " and resid 83   and name HE% )
      4.900     3.100     1.100 peak  2597 weight  0.10000E+01 volume  0.21013E-03 ppm1      0.687 ppm2      0.942 CV     1
 OR { 2597}
   (( segid "    " and resid 81   and name HB1 ))
   (( segid "    " and resid 83   and name HB1 ))
 ASSI { 2602}
   (( segid "    " and resid 38   and name HB1 ))
   (( segid "    " and resid 39   and name HN  ))
      4.400     2.400     1.600 peak  2602 weight  0.10000E+01 volume  0.28706E-03 ppm1      0.680 ppm2      9.231 CV     1
 ASSI { 2603}
   (( segid "    " and resid 38   and name HB1 ))
   (  segid "    " and resid 94   and name HE% )
      4.300     2.300     1.700 peak  2603 weight  0.10000E+01 volume  0.15462E-03 ppm1      0.683 ppm2      6.772 CV     1
 ASSI { 2608}
   (( segid "    " and resid 38   and name HB1 ))
   (  segid "    " and resid 92   and name HB% )
      3.200     1.300     1.300 peak  2608 weight  0.10000E+01 volume  0.97785E-03 ppm1      0.690 ppm2      1.095 CV     1
 ASSI { 2609}
   (( segid "    " and resid 38   and name HB2 ))
   (  segid "    " and resid 92   and name HB% )
      3.100     1.200     1.200 peak  2609 weight  0.10000E+01 volume  0.96731E-03 ppm1      0.725 ppm2      1.084 CV     1
 ASSI { 2614}
   (( segid "    " and resid 38   and name HB2 ))
   (  segid "    " and resid 94   and name HE% )
      4.500     2.600     1.500 peak  2614 weight  0.10000E+01 volume  0.21672E-03 ppm1      0.733 ppm2      6.742 CV     1
 ASSI { 2615}
   (( segid "    " and resid 38   and name HB2 ))
   (( segid "    " and resid 39   and name HN  ))
      4.300     2.300     1.700 peak  2615 weight  0.10000E+01 volume  0.24265E-03 ppm1      0.745 ppm2      9.259 CV     1
 ASSI { 2630}
   (  segid "    " and resid 2    and name HG2%)
   (( segid "    " and resid 3    and name HN  ))
      3.800     1.800     1.800 peak  2630 weight  0.10000E+01 volume  0.56642E-03 ppm1      0.813 ppm2      8.521 CV     1
 ASSI { 2635}
   (  segid "    " and resid 2    and name HG2%)
   (( segid "    " and resid 27   and name HB1 ))
      3.500     1.500     1.500 peak  2635 weight  0.10000E+01 volume  0.10449E-02 ppm1      0.812 ppm2      3.077 CV     1
 ASSI { 2636}
   (  segid "    " and resid 2    and name HG2%)
   (( segid "    " and resid 27   and name HB2 ))
      3.300     1.300     1.300 peak  2636 weight  0.10000E+01 volume  0.87060E-03 ppm1      0.814 ppm2      2.918 CV     1
 ASSI { 2638}
   (  segid "    " and resid 12   and name HG1%)
   (( segid "    " and resid 14   and name HB1 ))
      4.300     2.300     1.700 peak  2638 weight  0.10000E+01 volume  0.31242E-03 ppm1      0.817 ppm2      2.154 CV     1
 OR { 2638}
   (  segid "    " and resid 12   and name HG1%)
   (( segid "    " and resid 14   and name HG2 ))
 ASSI { 2643}
   (  segid "    " and resid 12   and name HG1%)
   (( segid "    " and resid 18   and name HN  ))
      3.400     1.500     1.500 peak  2643 weight  0.10000E+01 volume  0.10541E-02 ppm1      0.786 ppm2      8.633 CV     1
 ASSI { 2644}
   (  segid "    " and resid 12   and name HG1%)
   (( segid "    " and resid 16   and name HN  ))
      3.200     1.300     1.300 peak  2644 weight  0.10000E+01 volume  0.11549E-02 ppm1      0.784 ppm2      8.429 CV     1
 ASSI { 2646}
   (  segid "    " and resid 12   and name HG1%)
   (( segid "    " and resid 17   and name HN  ))
      4.100     2.100     1.900 peak  2646 weight  0.10000E+01 volume  0.31786E-03 ppm1      0.785 ppm2      7.842 CV     1
 ASSI { 2647}
   (  segid "    " and resid 12   and name HG1%)
   (( segid "    " and resid 11   and name HA  ))
      4.700     2.700     1.300 peak  2647 weight  0.10000E+01 volume  0.32236E-03 ppm1      0.784 ppm2      5.245 CV     1
 ASSI { 2648}
   (  segid "    " and resid 12   and name HG1%)
   (( segid "    " and resid 115  and name HA  ))
      3.300     1.300     1.300 peak  2648 weight  0.10000E+01 volume  0.11982E-02 ppm1      0.786 ppm2      4.821 CV     1
 ASSI { 2652}
   (  segid "    " and resid 12   and name HG1%)
   (( segid "    " and resid 16   and name HA1 ))
      3.100     1.200     1.200 peak  2652 weight  0.10000E+01 volume  0.77825E-03 ppm1      0.785 ppm2      3.709 CV     1
 ASSI { 2654}
   (  segid "    " and resid 12   and name HG1%)
   (( segid "    " and resid 13   and name HG2 ))
      4.100     2.100     1.900 peak  2654 weight  0.10000E+01 volume  0.37447E-03 ppm1      0.787 ppm2      2.411 CV     1
 OR { 2654}
   (  segid "    " and resid 12   and name HG1%)
   (( segid "    " and resid 13   and name HG1 ))
 ASSI { 2660}
   (  segid "    " and resid 18   and name HD2%)
   (( segid "    " and resid 10   and name HN  ))
      4.000     2.000     2.000 peak  2660 weight  0.10000E+01 volume  0.24909E-03 ppm1      0.772 ppm2      7.121 CV     1
 ASSI { 2662}
   (  segid "    " and resid 18   and name HD2%)
   (( segid "    " and resid 10   and name HA1 ))
      3.500     1.600     1.600 peak  2662 weight  0.10000E+01 volume  0.55699E-03 ppm1      0.771 ppm2      4.085 CV     1
 OR { 2662}
   (  segid "    " and resid 18   and name HD2%)
   (( segid "    " and resid 10   and name HA2 ))
 ASSI { 2665}
   (  segid "    " and resid 18   and name HD2%)
   (( segid "    " and resid 9    and name HA2 ))
      4.100     2.100     1.900 peak  2665 weight  0.10000E+01 volume  0.40504E-03 ppm1      0.772 ppm2      3.535 CV     1
 ASSI { 2668}
   (  segid "    " and resid 18   and name HD2%)
   (  segid "    " and resid 20   and name HG1%)
      3.600     1.600     1.600 peak  2668 weight  0.10000E+01 volume  0.75208E-03 ppm1      0.772 ppm2      0.300 CV     1
 ASSI { 2670}
   (  segid "    " and resid 18   and name HD2%)
   (( segid "    " and resid 9    and name HA1 ))
      4.100     2.100     1.900 peak  2670 weight  0.10000E+01 volume  0.65941E-03 ppm1      0.770 ppm2      3.917 CV     1
 ASSI { 2672}
   (  segid "    " and resid 18   and name HD2%)
   (( segid "    " and resid 19   and name HB1 ))
      4.100     2.200     1.900 peak  2672 weight  0.10000E+01 volume  0.45803E-03 ppm1      0.773 ppm2      1.661 CV     1
 OR { 2672}
   (  segid "    " and resid 18   and name HD2%)
   (( segid "    " and resid 19   and name HB2 ))
 ASSI { 2677}
   (  segid "    " and resid 11   and name HD1%)
   (( segid "    " and resid 10   and name HA2 ))
      4.100     2.100     1.900 peak  2677 weight  0.10000E+01 volume  0.47209E-03 ppm1      0.827 ppm2      4.044 CV     1
 OR { 2677}
   (  segid "    " and resid 11   and name HD2%)
   (( segid "    " and resid 10   and name HA2 ))
 ASSI { 2680}
   (  segid "    " and resid 11   and name HD1%)
   (( segid "    " and resid 112  and name HG2 ))
      4.100     2.100     1.900 peak  2680 weight  0.10000E+01 volume  0.36464E-03 ppm1      0.826 ppm2      2.290 CV     1
 OR { 2680}
   (  segid "    " and resid 11   and name HD2%)
   (( segid "    " and resid 112  and name HG2 ))
 ASSI { 2685}
   (  segid "    " and resid 4    and name HD2%)
   (  segid "    " and resid 27   and name HD% )
      3.300     1.400     1.400 peak  2685 weight  0.10000E+01 volume  0.10443E-02 ppm1      0.686 ppm2      6.973 CV     1
 OR { 2685}
   (  segid "    " and resid 4    and name HD2%)
   (  segid "    " and resid 27   and name HE% )
 OR { 2685}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 27   and name HZ  ))
 ASSI { 2687}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 97   and name HA  ))
      3.700     1.700     1.700 peak  2687 weight  0.10000E+01 volume  0.34332E-03 ppm1      0.679 ppm2      4.847 CV     1
 ASSI { 2689}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 107  and name HB1 ))
      4.200     2.200     1.800 peak  2689 weight  0.10000E+01 volume  0.36334E-03 ppm1      0.688 ppm2      3.075 CV     1
 OR { 2689}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 107  and name HB2 ))
 ASSI { 2694}
   (  segid "    " and resid 2    and name HG1%)
   (( segid "    " and resid 25   and name HN  ))
      3.900     1.900     1.900 peak  2694 weight  0.10000E+01 volume  0.40792E-03 ppm1      0.729 ppm2      8.667 CV     1
 ASSI { 2695}
   (  segid "    " and resid 2    and name HG1%)
   (( segid "    " and resid 3    and name HN  ))
      3.900     1.900     1.900 peak  2695 weight  0.10000E+01 volume  0.44768E-03 ppm1      0.726 ppm2      8.489 CV     1
 ASSI { 2698}
   (  segid "    " and resid 2    and name HG1%)
   (( segid "    " and resid 107  and name HA  ))
      4.900     3.000     1.100 peak  2698 weight  0.10000E+01 volume  0.10780E-03 ppm1      0.733 ppm2      5.035 CV     1
 ASSI { 2701}
   (  segid "    " and resid 2    and name HG1%)
   (( segid "    " and resid 25   and name HB2 ))
      4.900     3.000     1.100 peak  2701 weight  0.10000E+01 volume  0.12846E-03 ppm1      0.732 ppm2      3.794 CV     1
 OR { 2701}
   (  segid "    " and resid 2    and name HG1%)
   (( segid "    " and resid 25   and name HB1 ))
 ASSI { 2702}
   (  segid "    " and resid 2    and name HG1%)
   (( segid "    " and resid 27   and name HB1 ))
      4.300     2.300     1.700 peak  2702 weight  0.10000E+01 volume  0.34312E-03 ppm1      0.728 ppm2      3.082 CV     1
 ASSI { 2703}
   (  segid "    " and resid 2    and name HG1%)
   (( segid "    " and resid 27   and name HB2 ))
      4.000     2.000     2.000 peak  2703 weight  0.10000E+01 volume  0.29962E-03 ppm1      0.730 ppm2      2.893 CV     1
 ASSI { 2705}
   (  segid "    " and resid 2    and name HG1%)
   (( segid "    " and resid 3    and name HG1 ))
      4.700     2.800     1.300 peak  2705 weight  0.10000E+01 volume  0.19941E-03 ppm1      0.729 ppm2      2.296 CV     1
 OR { 2705}
   (  segid "    " and resid 2    and name HG1%)
   (( segid "    " and resid 3    and name HG2 ))
 ASSI { 2715}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 91   and name HG1 ))
      3.900     1.900     1.900 peak  2715 weight  0.10000E+01 volume  0.43763E-03 ppm1      0.661 ppm2      5.814 CV     1
 ASSI { 2717}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 21   and name HB1 ))
      3.200     1.300     1.300 peak  2717 weight  0.10000E+01 volume  0.12790E-02 ppm1      0.662 ppm2      3.784 CV     1
 ASSI { 2719}
   (  segid "    " and resid 78   and name HG2%)
   (  segid "    " and resid 23   and name HB% )
      3.000     1.100     1.100 peak  2719 weight  0.10000E+01 volume  0.23565E-02 ppm1      0.662 ppm2      1.402 CV     1
 ASSI { 2724}
   (  segid "    " and resid 81   and name HD1%)
   (( segid "    " and resid 36   and name HE1 ))
      3.300     1.400     1.400 peak  2724 weight  0.10000E+01 volume  0.34725E-03 ppm1      0.666 ppm2      7.897 CV     1
 ASSI { 2727}
   (  segid "    " and resid 81   and name HD1%)
   (( segid "    " and resid 68   and name HA  ))
      5.100     3.300     0.900 peak  2727 weight  0.10000E+01 volume  0.12635E-03 ppm1      0.663 ppm2      6.004 CV     1
 ASSI { 2728}
   (  segid "    " and resid 81   and name HD1%)
   (( segid "    " and resid 70   and name HA  ))
      3.300     1.300     1.300 peak  2728 weight  0.10000E+01 volume  0.93535E-03 ppm1      0.665 ppm2      5.354 CV     1
 ASSI { 2732}
   (  segid "    " and resid 81   and name HD1%)
   (( segid "    " and resid 49   and name HB2 ))
      3.000     1.100     1.100 peak  2732 weight  0.10000E+01 volume  0.59654E-03 ppm1      0.662 ppm2      3.525 CV     1
 ASSI { 2734}
   (  segid "    " and resid 81   and name HD1%)
   (( segid "    " and resid 70   and name HG11))
      3.200     1.300     1.300 peak  2734 weight  0.10000E+01 volume  0.42073E-03 ppm1      0.665 ppm2      2.209 CV     1
 ASSI { 2736}
   (  segid "    " and resid 81   and name HD1%)
   (( segid "    " and resid 83   and name HG1 ))
      2.700     0.900     0.900 peak  2736 weight  0.10000E+01 volume  0.19961E-02 ppm1      0.664 ppm2      1.276 CV     1
 ASSI { 2741}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 94   and name HH  ))
      4.000     2.000     2.000 peak  2741 weight  0.10000E+01 volume  0.11900E-03 ppm1      0.651 ppm2     10.240 CV     1
 ASSI { 2745}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 88   and name HA  ))
      3.500     1.500     1.500 peak  2745 weight  0.10000E+01 volume  0.71069E-03 ppm1      0.655 ppm2      4.142 CV     1
 ASSI { 2747}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 90   and name HB2 ))
      3.600     1.600     1.600 peak  2747 weight  0.10000E+01 volume  0.68668E-03 ppm1      0.655 ppm2      2.824 CV     1
 ASSI { 2749}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 86   and name HB1 ))
      2.800     1.000     1.000 peak  2749 weight  0.10000E+01 volume  0.43211E-02 ppm1      0.652 ppm2      1.440 CV     1
 ASSI { 2753}
   (  segid "    " and resid 37   and name HG2%)
   (( segid "    " and resid 36   and name HN  ))
      5.100     3.200     0.900 peak  2753 weight  0.10000E+01 volume  0.16162E-03 ppm1      0.643 ppm2      8.822 CV     1
 ASSI { 2758}
   (  segid "    " and resid 37   and name HG2%)
   (( segid "    " and resid 95   and name HB2 ))
      3.300     1.300     1.300 peak  2758 weight  0.10000E+01 volume  0.15595E-02 ppm1      0.642 ppm2      3.129 CV     1
 ASSI { 2759}
   (  segid "    " and resid 37   and name HG2%)
   (( segid "    " and resid 95   and name HB1 ))
      2.600     0.800     0.800 peak  2759 weight  0.10000E+01 volume  0.18752E-02 ppm1      0.642 ppm2      2.482 CV     1
 ASSI { 2761}
   (  segid "    " and resid 115  and name HG1%)
   (  segid "    " and resid 114  and name HG2%)
      3.300     1.300     1.300 peak  2761 weight  0.10000E+01 volume  0.27757E-02 ppm1      0.644 ppm2      1.104 CV     1
 ASSI { 2763}
   (  segid "    " and resid 113  and name HG2%)
   (( segid "    " and resid 94   and name HH  ))
      5.700     4.100     0.300 peak  2763 weight  0.10000E+01 volume  0.58261E-04 ppm1      0.618 ppm2     10.280 CV     1
 ASSI { 2765}
   (  segid "    " and resid 113  and name HG2%)
   (( segid "    " and resid 114  and name HN  ))
      4.000     2.000     2.000 peak  2765 weight  0.10000E+01 volume  0.10533E-02 ppm1      0.618 ppm2      8.425 CV     1
 ASSI { 2766}
   (  segid "    " and resid 113  and name HG2%)
   (( segid "    " and resid 9    and name HN  ))
      5.800     4.200     0.200 peak  2766 weight  0.10000E+01 volume  0.32826E-04 ppm1      0.619 ppm2      8.140 CV     1
 ASSI { 2767}
   (  segid "    " and resid 113  and name HG2%)
   (( segid "    " and resid 10   and name HN  ))
      3.500     1.600     1.600 peak  2767 weight  0.10000E+01 volume  0.49384E-03 ppm1      0.622 ppm2      7.114 CV     1
 ASSI { 2772}
   (  segid "    " and resid 113  and name HG2%)
   (( segid "    " and resid 9    and name HA1 ))
      4.200     2.200     1.800 peak  2772 weight  0.10000E+01 volume  0.39113E-03 ppm1      0.621 ppm2      3.905 CV     1
 ASSI { 2774}
   (  segid "    " and resid 113  and name HG2%)
   (( segid "    " and resid 9    and name HA2 ))
      4.100     2.100     1.900 peak  2774 weight  0.10000E+01 volume  0.16723E-03 ppm1      0.620 ppm2      3.527 CV     1
 ASSI { 2776}
   (  segid "    " and resid 113  and name HG2%)
   (( segid "    " and resid 94   and name HB2 ))
      4.000     2.000     2.000 peak  2776 weight  0.10000E+01 volume  0.21203E-03 ppm1      0.623 ppm2      2.846 CV     1
 OR { 2776}
   (  segid "    " and resid 113  and name HG2%)
   (( segid "    " and resid 94   and name HB1 ))
 ASSI { 2787}
   (  segid "    " and resid 18   and name HD1%)
   (( segid "    " and resid 10   and name HA1 ))
      3.900     1.900     1.900 peak  2787 weight  0.10000E+01 volume  0.32026E-03 ppm1      0.651 ppm2      4.061 CV     1
 OR { 2787}
   (  segid "    " and resid 18   and name HD1%)
   (( segid "    " and resid 10   and name HA2 ))
 ASSI { 2789}
   (  segid "    " and resid 18   and name HD1%)
   (( segid "    " and resid 9    and name HA2 ))
      3.600     1.600     1.600 peak  2789 weight  0.10000E+01 volume  0.78404E-03 ppm1      0.651 ppm2      3.530 CV     1
 ASSI { 2793}
   (  segid "    " and resid 18   and name HD1%)
   (  segid "    " and resid 20   and name HG1%)
      3.100     1.200     1.200 peak  2793 weight  0.10000E+01 volume  0.18783E-02 ppm1      0.651 ppm2      0.305 CV     1
 ASSI { 2803}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 107  and name HB1 ))
      3.800     1.800     1.800 peak  2803 weight  0.10000E+01 volume  0.72826E-03 ppm1      0.590 ppm2      3.064 CV     1
 OR { 2803}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 107  and name HB2 ))
 ASSI { 2810}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 15   and name HN  ))
      5.700     4.100     0.300 peak  2810 weight  0.10000E+01 volume  0.53602E-04 ppm1      0.518 ppm2      9.771 CV     1
 ASSI { 2811}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 87   and name HN  ))
      5.300     3.500     0.700 peak  2811 weight  0.10000E+01 volume  0.89451E-04 ppm1      0.520 ppm2      9.526 CV     1
 ASSI { 2816}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 10   and name HN  ))
      4.600     2.600     1.400 peak  2816 weight  0.10000E+01 volume  0.14919E-03 ppm1      0.520 ppm2      7.115 CV     1
 ASSI { 2821}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 83   and name HB2 ))
      2.800     1.000     1.000 peak  2821 weight  0.10000E+01 volume  0.19408E-02 ppm1      0.520 ppm2      1.840 CV     1
 ASSI { 2825}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 83   and name HG2 ))
      4.700     2.700     1.300 peak  2825 weight  0.10000E+01 volume  0.16000E-03 ppm1      0.524 ppm2     -0.026 CV     1
 ASSI { 2827}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 90   and name HB2 ))
      4.800     2.900     1.200 peak  2827 weight  0.10000E+01 volume  0.12118E-03 ppm1      0.524 ppm2      2.784 CV     1
 ASSI { 2832}
   (  segid "    " and resid 113  and name HG1%)
   (( segid "    " and resid 114  and name HN  ))
      4.000     2.000     2.000 peak  2832 weight  0.10000E+01 volume  0.50603E-03 ppm1      0.523 ppm2      8.429 CV     1
 ASSI { 2834}
   (  segid "    " and resid 113  and name HG1%)
   (( segid "    " and resid 10   and name HN  ))
      3.400     1.500     1.500 peak  2834 weight  0.10000E+01 volume  0.14740E-02 ppm1      0.522 ppm2      7.115 CV     1
 ASSI { 2835}
   (  segid "    " and resid 113  and name HG1%)
   (  segid "    " and resid 94   and name HE% )
      3.200     1.300     1.300 peak  2835 weight  0.10000E+01 volume  0.95770E-03 ppm1      0.521 ppm2      6.757 CV     1
 ASSI { 2841}
   (  segid "    " and resid 113  and name HG1%)
   (( segid "    " and resid 9    and name HA2 ))
      2.800     1.000     1.000 peak  2841 weight  0.10000E+01 volume  0.10182E-02 ppm1      0.521 ppm2      3.529 CV     1
 ASSI { 2842}
   (  segid "    " and resid 113  and name HG1%)
   (( segid "    " and resid 94   and name HB2 ))
      3.500     1.600     1.600 peak  2842 weight  0.10000E+01 volume  0.42113E-03 ppm1      0.524 ppm2      2.877 CV     1
 OR { 2842}
   (  segid "    " and resid 113  and name HG1%)
   (( segid "    " and resid 94   and name HB1 ))
 ASSI { 2852}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 87   and name HN  ))
      4.300     2.400     1.700 peak  2852 weight  0.10000E+01 volume  0.17944E-03 ppm1      0.408 ppm2      9.525 CV     1
 ASSI { 2857}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 91   and name HG1 ))
      4.700     2.700     1.300 peak  2857 weight  0.10000E+01 volume  0.17134E-03 ppm1      0.408 ppm2      5.833 CV     1
 ASSI { 2860}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 14   and name HA  ))
      2.500     0.800     0.800 peak  2860 weight  0.10000E+01 volume  0.31089E-02 ppm1      0.408 ppm2      3.884 CV     1
 ASSI { 2861}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 14   and name HD1 ))
      3.100     1.200     1.200 peak  2861 weight  0.10000E+01 volume  0.12391E-02 ppm1      0.408 ppm2      3.523 CV     1
 OR { 2861}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 14   and name HD2 ))
 ASSI { 2862}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 14   and name HB1 ))
      3.300     1.400     1.400 peak  2862 weight  0.10000E+01 volume  0.14033E-02 ppm1      0.408 ppm2      2.122 CV     1
 OR { 2862}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 14   and name HG2 ))
 ASSI { 2864}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 14   and name HG1 ))
      2.700     0.900     0.900 peak  2864 weight  0.10000E+01 volume  0.22472E-02 ppm1      0.408 ppm2      1.732 CV     1
 ASSI { 2865}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 86   and name HB1 ))
      3.200     1.200     1.200 peak  2865 weight  0.10000E+01 volume  0.16407E-02 ppm1      0.409 ppm2      1.430 CV     1
 ASSI { 2866}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 86   and name HG  ))
      3.000     1.100     1.100 peak  2866 weight  0.10000E+01 volume  0.12295E-02 ppm1      0.408 ppm2      1.252 CV     1
 OR { 2866}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 86   and name HB2 ))
 ASSI { 2878}
   (  segid "    " and resid 93   and name HG2%)
   (( segid "    " and resid 95   and name HB2 ))
      3.800     1.800     1.800 peak  2878 weight  0.10000E+01 volume  0.32589E-03 ppm1      0.380 ppm2      3.112 CV     1
 ASSI { 2879}
   (  segid "    " and resid 93   and name HG2%)
   (( segid "    " and resid 94   and name HB2 ))
      5.300     3.400     0.700 peak  2879 weight  0.10000E+01 volume  0.13022E-03 ppm1      0.378 ppm2      2.871 CV     1
 OR { 2879}
   (  segid "    " and resid 93   and name HG2%)
   (( segid "    " and resid 94   and name HB1 ))
 ASSI { 2881}
   (  segid "    " and resid 93   and name HG2%)
   (( segid "    " and resid 95   and name HB1 ))
      5.400     3.600     0.600 peak  2881 weight  0.10000E+01 volume  0.11202E-03 ppm1      0.380 ppm2      2.459 CV     1
 ASSI { 2884}
   (  segid "    " and resid 93   and name HG2%)
   (( segid "    " and resid 39   and name HB2 ))
      4.100     2.100     1.900 peak  2884 weight  0.10000E+01 volume  0.36121E-03 ppm1      0.379 ppm2      1.760 CV     1
 ASSI { 2886}
   (  segid "    " and resid 20   and name HG1%)
   (( segid "    " and resid 7    and name HN  ))
      5.300     3.400     0.700 peak  2886 weight  0.10000E+01 volume  0.81283E-04 ppm1      0.307 ppm2      9.515 CV     1
 ASSI { 2887}
   (  segid "    " and resid 20   and name HG1%)
   (( segid "    " and resid 94   and name HN  ))
      5.200     3.400     0.800 peak  2887 weight  0.10000E+01 volume  0.16352E-03 ppm1      0.302 ppm2      9.087 CV     1
 ASSI { 2893}
   (  segid "    " and resid 20   and name HG1%)
   (( segid "    " and resid 19   and name HA  ))
      5.200     3.400     0.800 peak  2893 weight  0.10000E+01 volume  0.14515E-03 ppm1      0.308 ppm2      5.115 CV     1
 ASSI { 2900}
   (  segid "    " and resid 20   and name HG1%)
   (( segid "    " and resid 94   and name HB2 ))
      3.900     1.900     1.900 peak  2900 weight  0.10000E+01 volume  0.31272E-03 ppm1      0.308 ppm2      2.883 CV     1
 OR { 2900}
   (  segid "    " and resid 20   and name HG1%)
   (( segid "    " and resid 94   and name HB1 ))
 ASSI { 2909}
   (  segid "    " and resid 45   and name HD1%)
   (( segid "    " and resid 39   and name HN  ))
      5.500     3.800     0.500 peak  2909 weight  0.10000E+01 volume  0.58017E-04 ppm1      0.330 ppm2      9.197 CV     1
 ASSI { 2913}
   (  segid "    " and resid 45   and name HD1%)
   (  segid "    " and resid 95   and name HD% )
      3.100     1.200     1.200 peak  2913 weight  0.10000E+01 volume  0.85749E-03 ppm1      0.331 ppm2      6.930 CV     1
 OR { 2913}
   (  segid "    " and resid 45   and name HD2%)
   (  segid "    " and resid 95   and name HD% )
 ASSI { 2915}
   (  segid "    " and resid 45   and name HD1%)
   (( segid "    " and resid 38   and name HA  ))
      4.800     2.900     1.200 peak  2915 weight  0.10000E+01 volume  0.12642E-03 ppm1      0.333 ppm2      5.809 CV     1
 ASSI { 2921}
   (  segid "    " and resid 45   and name HD1%)
   (( segid "    " and resid 95   and name HB2 ))
      3.700     1.700     1.700 peak  2921 weight  0.10000E+01 volume  0.49315E-03 ppm1      0.333 ppm2      3.161 CV     1
 ASSI { 2922}
   (  segid "    " and resid 45   and name HD1%)
   (( segid "    " and resid 95   and name HB1 ))
      3.900     1.900     1.900 peak  2922 weight  0.10000E+01 volume  0.36363E-03 ppm1      0.333 ppm2      2.479 CV     1
 OR { 2922}
   (  segid "    " and resid 45   and name HD2%)
   (( segid "    " and resid 95   and name HB1 ))
 ASSI { 2923}
   (  segid "    " and resid 45   and name HD1%)
   (( segid "    " and resid 39   and name HG1 ))
      3.100     1.200     1.200 peak  2923 weight  0.10000E+01 volume  0.20538E-02 ppm1      0.330 ppm2      2.268 CV     1
 OR { 2923}
   (  segid "    " and resid 45   and name HD1%)
   (( segid "    " and resid 39   and name HB1 ))
 ASSI { 2925}
   (  segid "    " and resid 45   and name HD1%)
   (( segid "    " and resid 39   and name HB2 ))
      2.800     1.000     1.000 peak  2925 weight  0.10000E+01 volume  0.16882E-02 ppm1      0.329 ppm2      1.731 CV     1
 ASSI { 2929}
   (  segid "    " and resid 45   and name HD2%)
   (  segid "    " and resid 37   and name HG1%)
      3.100     1.200     1.200 peak  2929 weight  0.10000E+01 volume  0.21810E-02 ppm1      0.327 ppm2      0.873 CV     1
 OR { 2929}
   (  segid "    " and resid 45   and name HD1%)
   (  segid "    " and resid 37   and name HG1%)
 ASSI { 2930}
   (  segid "    " and resid 45   and name HD1%)
   (  segid "    " and resid 37   and name HG2%)
      2.100     0.600     0.600 peak  2930 weight  0.10000E+01 volume  0.11258E-01 ppm1      0.329 ppm2      0.592 CV     1
 OR { 2930}
   (  segid "    " and resid 45   and name HD2%)
   (  segid "    " and resid 37   and name HG2%)
 ASSI { 2934}
   (  segid "    " and resid 104  and name HD2%)
   (  segid "    " and resid 99   and name HD% )
      3.200     1.300     1.300 peak  2934 weight  0.10000E+01 volume  0.84240E-03 ppm1      0.400 ppm2      6.702 CV     1
 ASSI { 2936}
   (  segid "    " and resid 104  and name HD2%)
   (( segid "    " and resid 99   and name HA  ))
      4.000     2.000     2.000 peak  2936 weight  0.10000E+01 volume  0.37127E-03 ppm1      0.400 ppm2      4.949 CV     1
 ASSI { 2946}
   (  segid "    " and resid 104  and name HD2%)
   (  segid "    " and resid 37   and name HG1%)
      3.000     1.100     1.100 peak  2946 weight  0.10000E+01 volume  0.13297E-02 ppm1      0.405 ppm2      0.850 CV     1
 ASSI { 2947}
   (  segid "    " and resid 79   and name HD1%)
   (( segid "    " and resid 80   and name HN  ))
      3.900     1.900     1.900 peak  2947 weight  0.10000E+01 volume  0.37789E-03 ppm1      0.405 ppm2      9.175 CV     1
 ASSI { 2950}
   (  segid "    " and resid 79   and name HD1%)
   (  segid "    " and resid 29   and name HE% )
      3.500     1.500     1.500 peak  2950 weight  0.10000E+01 volume  0.55409E-03 ppm1      0.404 ppm2      7.186 CV     1
 OR { 2950}
   (  segid "    " and resid 79   and name HD1%)
   (( segid "    " and resid 29   and name HZ  ))
 ASSI { 2951}
   (  segid "    " and resid 79   and name HD1%)
   (( segid "    " and resid 36   and name HD1 ))
      3.500     1.500     1.500 peak  2951 weight  0.10000E+01 volume  0.95871E-03 ppm1      0.406 ppm2      6.913 CV     1
 OR { 2951}
   (  segid "    " and resid 79   and name HD1%)
   (( segid "    " and resid 36   and name HZ2 ))
 ASSI { 2958}
   (  segid "    " and resid 79   and name HD1%)
   (( segid "    " and resid 34   and name HG1 ))
      2.900     1.100     1.100 peak  2958 weight  0.10000E+01 volume  0.13961E-02 ppm1      0.404 ppm2      2.398 CV     1
 OR { 2958}
   (  segid "    " and resid 79   and name HD1%)
   (( segid "    " and resid 34   and name HG2 ))
 ASSI { 2959}
   (  segid "    " and resid 79   and name HD1%)
   (( segid "    " and resid 70   and name HG11))
      3.600     1.700     1.700 peak  2959 weight  0.10000E+01 volume  0.36491E-03 ppm1      0.407 ppm2      2.190 CV     1
 ASSI { 2963}
   (  segid "    " and resid 79   and name HD1%)
   (( segid "    " and resid 70   and name HG12))
      3.400     1.500     1.500 peak  2963 weight  0.10000E+01 volume  0.70632E-03 ppm1      0.400 ppm2      1.280 CV     1
 ASSI { 2970}
   (  segid "    " and resid 64   and name HG1%)
   (  segid "    " and resid 60   and name HD% )
      3.000     1.100     1.100 peak  2970 weight  0.10000E+01 volume  0.14256E-02 ppm1      0.190 ppm2      7.097 CV     1
 ASSI { 2978}
   (  segid "    " and resid 64   and name HG1%)
   (( segid "    " and resid 60   and name HB1 ))
      4.800     2.900     1.200 peak  2978 weight  0.10000E+01 volume  0.25892E-03 ppm1      0.189 ppm2      2.527 CV     1
 ASSI { 2988}
   (  segid "    " and resid 81   and name HD2%)
   (( segid "    " and resid 20   and name HN  ))
      6.000     4.900     0.000 peak  2988 weight  0.10000E+01 volume  0.33253E-04 ppm1      0.153 ppm2      8.151 CV     1
 ASSI { 2989}
   (  segid "    " and resid 81   and name HD2%)
   (( segid "    " and resid 36   and name HE1 ))
      4.200     2.200     1.800 peak  2989 weight  0.10000E+01 volume  0.21930E-03 ppm1      0.154 ppm2      7.884 CV     1
 ASSI { 2991}
   (  segid "    " and resid 81   and name HD2%)
   (( segid "    " and resid 36   and name HD1 ))
      2.500     0.800     0.800 peak  2991 weight  0.10000E+01 volume  0.45417E-02 ppm1      0.151 ppm2      6.958 CV     1
 OR { 2991}
   (  segid "    " and resid 81   and name HD2%)
   (( segid "    " and resid 36   and name HZ2 ))
 OR { 2991}
   (  segid "    " and resid 81   and name HD2%)
   (( segid "    " and resid 36   and name HH2 ))
 OR { 2991}
   (  segid "    " and resid 81   and name HD2%)
   (( segid "    " and resid 36   and name HZ3 ))
 ASSI { 2992}
   (  segid "    " and resid 81   and name HD2%)
   (( segid "    " and resid 36   and name HB1 ))
      3.400     1.500     1.500 peak  2992 weight  0.10000E+01 volume  0.63991E-03 ppm1      0.151 ppm2      3.095 CV     1
 ASSI { 2993}
   (  segid "    " and resid 81   and name HD2%)
   (( segid "    " and resid 36   and name HB2 ))
      3.400     1.400     1.400 peak  2993 weight  0.10000E+01 volume  0.64575E-03 ppm1      0.153 ppm2      2.770 CV     1
 ASSI { 2995}
   (  segid "    " and resid 81   and name HD2%)
   (  segid "    " and resid 83   and name HE% )
      2.600     0.900     0.900 peak  2995 weight  0.10000E+01 volume  0.46901E-02 ppm1      0.151 ppm2      0.961 CV     1
 OR { 2995}
   (  segid "    " and resid 81   and name HD2%)
   (( segid "    " and resid 83   and name HB1 ))
 ASSI { 3001}
   (  segid "    " and resid 81   and name HD2%)
   (( segid "    " and resid 83   and name HA  ))
      4.400     2.400     1.600 peak  3001 weight  0.10000E+01 volume  0.24883E-03 ppm1      0.150 ppm2      3.953 CV     1
 ASSI { 3002}
   (  segid "    " and resid 20   and name HG2%)
   (  segid "    " and resid 81   and name HD2%)
      3.100     1.200     1.200 peak  3002 weight  0.10000E+01 volume  0.25934E-02 ppm1     -0.094 ppm2      0.105 CV     1
 ASSI { 3006}
   (  segid "    " and resid 20   and name HG2%)
   (  segid "    " and resid 83   and name HE% )
      3.000     1.100     1.100 peak  3006 weight  0.10000E+01 volume  0.17254E-02 ppm1     -0.094 ppm2      0.952 CV     1
 ASSI { 3010}
   (  segid "    " and resid 20   and name HG2%)
   (( segid "    " and resid 94   and name HB1 ))
      3.600     1.600     1.600 peak  3010 weight  0.10000E+01 volume  0.52751E-03 ppm1     -0.094 ppm2      2.893 CV     1
 OR { 3010}
   (  segid "    " and resid 20   and name HG2%)
   (( segid "    " and resid 94   and name HB2 ))
 ASSI { 3012}
   (  segid "    " and resid 20   and name HG2%)
   (( segid "    " and resid 19   and name HA  ))
      4.400     2.400     1.600 peak  3012 weight  0.10000E+01 volume  0.30807E-03 ppm1     -0.094 ppm2      5.121 CV     1
 ASSI { 3023}
   (( segid "    " and resid 83   and name HG2 ))
   (  segid "    " and resid 68   and name HE% )
      3.500     1.500     1.500 peak  3023 weight  0.10000E+01 volume  0.57557E-03 ppm1     -0.031 ppm2      7.014 CV     1
 OR { 3023}
   (( segid "    " and resid 83   and name HG2 ))
   (( segid "    " and resid 68   and name HZ  ))
 OR { 3023}
   (( segid "    " and resid 83   and name HG2 ))
   (  segid "    " and resid 68   and name HD% )
 ASSI { 3029}
   (( segid "    " and resid 83   and name HG2 ))
   (  segid "    " and resid 81   and name HD1%)
      3.100     1.200     1.200 peak  3029 weight  0.10000E+01 volume  0.10653E-02 ppm1     -0.034 ppm2      0.656 CV     1
 ASSI { 3031}
   (( segid "    " and resid 83   and name HG2 ))
   (  segid "    " and resid 81   and name HD2%)
      3.600     1.600     1.600 peak  3031 weight  0.10000E+01 volume  0.59580E-03 ppm1     -0.033 ppm2      0.139 CV     1
 ASSI { 3036}
   (( segid "    " and resid 79   and name HB2 ))
   (( segid "    " and resid 22   and name HB1 ))
      3.400     1.400     1.400 peak  3036 weight  0.10000E+01 volume  0.50810E-03 ppm1      1.088 ppm2      2.931 CV     1
 OR { 3036}
   (( segid "    " and resid 79   and name HB2 ))
   (( segid "    " and resid 22   and name HB2 ))
 ASSI { 3047}
   (( segid "    " and resid 104  and name HB2 ))
   (( segid "    " and resid 103  and name HA  ))
      4.400     2.400     1.600 peak  3047 weight  0.10000E+01 volume  0.17371E-03 ppm1      1.225 ppm2      4.416 CV     1
 ASSI { 3054}
   (  segid "    " and resid 104  and name HD1%)
   (( segid "    " and resid 106  and name HN  ))
      4.900     3.000     1.100 peak  3054 weight  0.10000E+01 volume  0.14568E-03 ppm1      0.531 ppm2      7.748 CV     1
 ASSI { 3057}
   (  segid "    " and resid 104  and name HD1%)
   (  segid "    " and resid 99   and name HD% )
      3.000     1.100     1.100 peak  3057 weight  0.10000E+01 volume  0.62321E-03 ppm1      0.532 ppm2      6.721 CV     1
 ASSI { 3058}
   (  segid "    " and resid 104  and name HD1%)
   (( segid "    " and resid 99   and name HA  ))
      4.300     2.300     1.700 peak  3058 weight  0.10000E+01 volume  0.32655E-03 ppm1      0.530 ppm2      4.928 CV     1
 ASSI { 3062}
   (  segid "    " and resid 104  and name HD1%)
   (( segid "    " and resid 99   and name HB1 ))
      4.700     2.700     1.300 peak  3062 weight  0.10000E+01 volume  0.14067E-03 ppm1      0.534 ppm2      2.711 CV     1
 OR { 3062}
   (  segid "    " and resid 104  and name HD1%)
   (( segid "    " and resid 99   and name HB2 ))
 ASSI { 3066}
   (  segid "    " and resid 104  and name HD1%)
   (  segid "    " and resid 37   and name HG1%)
      2.700     0.900     0.900 peak  3066 weight  0.10000E+01 volume  0.21966E-02 ppm1      0.530 ppm2      0.854 CV     1
 ASSI { 3071}
   (( segid "    " and resid 79   and name HB1 ))
   (( segid "    " and resid 22   and name HB1 ))
      4.100     2.200     1.900 peak  3071 weight  0.10000E+01 volume  0.83656E-03 ppm1      1.806 ppm2      2.898 CV     1
 ASSI { 3075}
   (( segid "    " and resid 79   and name HB1 ))
   (( segid "    " and resid 22   and name HB2 ))
      3.900     1.900     1.900 peak  3075 weight  0.10000E+01 volume  0.43111E-03 ppm1      1.814 ppm2      3.037 CV     1
 ASSI { 3088}
   (  segid "    " and resid 106  and name HB% )
   (  segid "    " and resid 4    and name HD2%)
      2.900     1.100     1.100 peak  3088 weight  0.10000E+01 volume  0.20912E-02 ppm1      0.983 ppm2      0.676 CV     1
 ASSI { 3089}
   (  segid "    " and resid 2    and name HG2%)
   (  segid "    " and resid 27   and name HD% )
      3.400     1.400     1.400 peak  3089 weight  0.10000E+01 volume  0.83905E-03 ppm1      0.813 ppm2      7.011 CV     1
 OR { 3089}
   (  segid "    " and resid 2    and name HG2%)
   (  segid "    " and resid 27   and name HE% )
 ASSI { 3090}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 107  and name HE3 ))
      3.200     1.300     1.300 peak  3090 weight  0.10000E+01 volume  0.13893E-02 ppm1      0.685 ppm2      7.111 CV     1
 OR { 3090}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 107  and name HZ3 ))
 OR { 3090}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 107  and name HZ2 ))
 ASSI { 3094}
   (  segid "    " and resid 104  and name HD1%)
   (( segid "    " and resid 107  and name HB1 ))
      4.800     2.900     1.200 peak  3094 weight  0.10000E+01 volume  0.21810E-03 ppm1      0.534 ppm2      3.076 CV     1
 OR { 3094}
   (  segid "    " and resid 104  and name HD1%)
   (( segid "    " and resid 107  and name HB2 ))
 ASSI { 3103}
   (( segid "    " and resid 3    and name HB2 ))
   (( segid "    " and resid 4    and name HN  ))
      5.500     3.800     0.500 peak  3103 weight  0.10000E+01 volume  0.11932E-03 ppm1      1.966 ppm2      8.079 CV     1
 ASSI { 3105}
   (( segid "    " and resid 3    and name HB2 ))
   (( segid "    " and resid 25   and name HB2 ))
      4.800     2.800     1.200 peak  3105 weight  0.10000E+01 volume  0.11528E-03 ppm1      1.969 ppm2      3.839 CV     1
 OR { 3105}
   (( segid "    " and resid 3    and name HB2 ))
   (( segid "    " and resid 25   and name HB1 ))
 ASSI { 3107}
   (( segid "    " and resid 112  and name HA  ))
   (  segid "    " and resid 93   and name HG2%)
      4.200     2.200     1.800 peak  3107 weight  0.10000E+01 volume  0.25896E-03 ppm1      4.465 ppm2      0.372 CV     1
 ASSI { 3111}
   (( segid "    " and resid 89   and name HG2 ))
   (( segid "    " and resid 90   and name HN  ))
      4.300     2.300     1.700 peak  3111 weight  0.10000E+01 volume  0.34440E-03 ppm1      2.240 ppm2      8.432 CV     1
 ASSI { 3113}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 87   and name HN  ))
      3.500     1.500     1.500 peak  3113 weight  0.10000E+01 volume  0.45618E-03 ppm1      1.262 ppm2      9.508 CV     1
 ASSI { 3117}
   (( segid "    " and resid 8    and name HA2 ))
   (  segid "    " and resid 20   and name HG1%)
      4.400     2.400     1.600 peak  3117 weight  0.10000E+01 volume  0.26319E-03 ppm1      3.782 ppm2      0.288 CV     1
 ASSI { 3119}
   (( segid "    " and resid 8    and name HA2 ))
   (( segid "    " and resid 9    and name HN  ))
      3.700     1.700     1.700 peak  3119 weight  0.10000E+01 volume  0.29985E-03 ppm1      3.782 ppm2      8.122 CV     1
 ASSI { 3124}
   (( segid "    " and resid 54   and name HA2 ))
   (( segid "    " and resid 53   and name HB1 ))
      4.400     2.500     1.600 peak  3124 weight  0.10000E+01 volume  0.20164E-03 ppm1      3.893 ppm2      1.878 CV     1
 OR { 3124}
   (( segid "    " and resid 54   and name HA1 ))
   (( segid "    " and resid 53   and name HB1 ))
 ASSI { 3130}
   (( segid "    " and resid 81   and name HG  ))
   (  segid "    " and resid 83   and name HE% )
      4.000     2.000     2.000 peak  3130 weight  0.10000E+01 volume  0.43357E-03 ppm1      0.474 ppm2      0.965 CV     1
 OR { 3130}
   (( segid "    " and resid 81   and name HG  ))
   (( segid "    " and resid 83   and name HB1 ))
 ASSI { 3138}
   (( segid "    " and resid 95   and name HA  ))
   (( segid "    " and resid 96   and name HN  ))
      3.100     1.200     1.200 peak  3138 weight  0.10000E+01 volume  0.88334E-03 ppm1      4.930 ppm2      8.893 CV     1
 ASSI { 3152}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 47   and name HE1 ))
      5.700     4.000     0.300 peak  3152 weight  0.10000E+01 volume  0.82152E-04 ppm1      0.861 ppm2     10.402 CV     1
 ASSI { 3156}
   (  segid "    " and resid 2    and name HG1%)
   (  segid "    " and resid 27   and name HD% )
      3.700     1.700     1.700 peak  3156 weight  0.10000E+01 volume  0.53689E-03 ppm1      0.727 ppm2      6.928 CV     1
 OR { 3156}
   (  segid "    " and resid 2    and name HG1%)
   (  segid "    " and resid 27   and name HE% )
 ASSI { 3157}
   (( segid "    " and resid 34   and name HB1 ))
   (  segid "    " and resid 79   and name HD1%)
      3.400     1.400     1.400 peak  3157 weight  0.10000E+01 volume  0.60298E-03 ppm1      1.940 ppm2      0.398 CV     1
 ASSI { 3162}
   (( segid "    " and resid 32   and name HB2 ))
   (( segid "    " and resid 98   and name HG1 ))
      4.600     2.600     1.400 peak  3162 weight  0.10000E+01 volume  0.21180E-03 ppm1      2.697 ppm2      1.029 CV     1
 OR { 3162}
   (( segid "    " and resid 32   and name HB2 ))
   (( segid "    " and resid 98   and name HG2 ))
 ASSI { 3163}
   (( segid "    " and resid 32   and name HB2 ))
   (( segid "    " and resid 98   and name HB2 ))
      3.800     1.800     1.800 peak  3163 weight  0.10000E+01 volume  0.48156E-03 ppm1      2.703 ppm2      1.429 CV     1
 OR { 3163}
   (( segid "    " and resid 32   and name HB2 ))
   (( segid "    " and resid 98   and name HB1 ))
 ASSI { 3164}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 60   and name HN  ))
      2.700     0.900     0.900 peak  3164 weight  0.10000E+01 volume  0.21741E-02 ppm1      4.872 ppm2      8.896 CV     1
 ASSI { 3165}
   (( segid "    " and resid 59   and name HA  ))
   (  segid "    " and resid 60   and name HD% )
      3.600     1.600     1.600 peak  3165 weight  0.10000E+01 volume  0.72025E-03 ppm1      4.869 ppm2      7.013 CV     1
 ASSI { 3167}
   (( segid "    " and resid 72   and name HA  ))
   (  segid "    " and resid 80   and name HD% )
      3.200     1.300     1.300 peak  3167 weight  0.10000E+01 volume  0.83523E-03 ppm1      5.412 ppm2      6.929 CV     1
 ASSI { 3168}
   (( segid "    " and resid 72   and name HA  ))
   (  segid "    " and resid 80   and name HE% )
      3.500     1.500     1.500 peak  3168 weight  0.10000E+01 volume  0.78869E-03 ppm1      5.414 ppm2      6.783 CV     1
 ASSI { 3169}
   (( segid "    " and resid 38   and name HG2 ))
   (( segid "    " and resid 94   and name HH  ))
      6.000     6.000     0.000 peak  3169 weight  0.10000E+01 volume  0.12710E-04 ppm1      1.390 ppm2     10.227 CV     1
 ASSI { 3170}
   (( segid "    " and resid 38   and name HB1 ))
   (( segid "    " and resid 94   and name HH  ))
      5.400     3.600     0.600 peak  3170 weight  0.10000E+01 volume  0.73092E-04 ppm1      0.678 ppm2     10.273 CV     1
 ASSI { 3175}
   (  segid "    " and resid 64   and name HG1%)
   (( segid "    " and resid 65   and name HB2 ))
      4.200     2.200     1.800 peak  3175 weight  0.10000E+01 volume  0.39389E-03 ppm1      0.188 ppm2      1.823 CV     1
 OR { 3175}
   (  segid "    " and resid 64   and name HG1%)
   (( segid "    " and resid 65   and name HB1 ))
 OR { 3175}
   (  segid "    " and resid 64   and name HG1%)
   (( segid "    " and resid 65   and name HD1 ))
 OR { 3175}
   (  segid "    " and resid 64   and name HG1%)
   (( segid "    " and resid 65   and name HD2 ))
 ASSI { 3176}
   (  segid "    " and resid 92   and name HB% )
   (( segid "    " and resid 41   and name HD1 ))
      4.000     2.000     2.000 peak  3176 weight  0.10000E+01 volume  0.36918E-03 ppm1      1.112 ppm2      3.806 CV     1
 ASSI { 3179}
   (  segid "    " and resid 113  and name HG1%)
   (  segid "    " and resid 94   and name HD% )
      2.900     1.100     1.100 peak  3179 weight  0.10000E+01 volume  0.16505E-02 ppm1      0.521 ppm2      6.931 CV     1
 ASSI { 3180}
   (  segid "    " and resid 113  and name HG2%)
   (  segid "    " and resid 94   and name HD% )
      3.200     1.300     1.300 peak  3180 weight  0.10000E+01 volume  0.10411E-02 ppm1      0.623 ppm2      6.940 CV     1
 ASSI { 3181}
   (  segid "    " and resid 83   and name HE% )
   (( segid "    " and resid 18   and name HN  ))
      4.800     2.900     1.200 peak  3181 weight  0.10000E+01 volume  0.11522E-03 ppm1      0.952 ppm2      8.633 CV     1
 ASSI { 3185}
   (  segid "    " and resid 34   and name HE% )
   (  segid "    " and resid 32   and name HE% )
      3.400     1.400     1.400 peak  3185 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.764 ppm2      7.067 CV     1
 ASSI {    1}
   (( segid "    " and resid 47   and name HE1 ))
   (( segid "    " and resid 50   and name HN  ))
      3.800     1.800     1.800 peak     1 weight  0.10000E+01 volume  0.46565E-03 ppm1     10.405 ppm2      8.796 CV     1
 OR {    1}
   (( segid "    " and resid 47   and name HE1 ))
   (( segid "    " and resid 36   and name HN  ))
 ASSI {    4}
   (( segid "    " and resid 47   and name HE1 ))
   (( segid "    " and resid 49   and name HA  ))
      4.400     2.400     1.600 peak     4 weight  0.10000E+01 volume  0.19299E-03 ppm1     10.408 ppm2      4.932 CV     1
 OR {    4}
   (( segid "    " and resid 47   and name HE1 ))
   (( segid "    " and resid 59   and name HA  ))
 ASSI {   10}
   (( segid "    " and resid 47   and name HE1 ))
   (  segid "    " and resid 37   and name HG1%)
      5.000     3.100     1.000 peak    10 weight  0.10000E+01 volume  0.16792E-03 ppm1     10.402 ppm2      0.856 CV     1
 OR {   10}
   (( segid "    " and resid 47   and name HE1 ))
   (  segid "    " and resid 48   and name HG1%)
 OR {   10}
   (( segid "    " and resid 47   and name HE1 ))
   (  segid "    " and resid 48   and name HG1%)
 ASSI {   11}
   (( segid "    " and resid 47   and name HE1 ))
   (  segid "    " and resid 104  and name HD1%)
      3.900     1.900     1.900 peak    11 weight  0.10000E+01 volume  0.14252E-03 ppm1     10.408 ppm2      0.485 CV     1
 OR {   11}
   (( segid "    " and resid 47   and name HE1 ))
   (( segid "    " and resid 81   and name HG  ))
 ASSI {   19}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 16   and name HA1 ))
      4.000     2.000     2.000 peak    19 weight  0.10000E+01 volume  0.11003E-02 ppm1      9.772 ppm2      3.701 CV     1
 OR {   19}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 85   and name HB2 ))
 ASSI {   22}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 14   and name HB2 ))
      3.700     1.700     1.700 peak    22 weight  0.10000E+01 volume  0.70163E-03 ppm1      9.771 ppm2      1.877 CV     1
 OR {   22}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 115  and name HB  ))
 ASSI {   27}
   (( segid "    " and resid 15   and name HN  ))
   (  segid "    " and resid 12   and name HG2%)
      4.800     2.800     1.200 peak    27 weight  0.10000E+01 volume  0.23623E-03 ppm1      9.771 ppm2      0.875 CV     1
 OR {   27}
   (( segid "    " and resid 15   and name HN  ))
   (  segid "    " and resid 12   and name HG1%)
 OR {   27}
   (( segid "    " and resid 15   and name HN  ))
   (  segid "    " and resid 86   and name HD2%)
 ASSI {   34}
   (( segid "    " and resid 107  and name HE1 ))
   (( segid "    " and resid 45   and name HB1 ))
      5.500     3.800     0.500 peak    34 weight  0.10000E+01 volume  0.30643E-04 ppm1      9.689 ppm2      1.433 CV     1
 OR {   34}
   (( segid "    " and resid 107  and name HE1 ))
   (( segid "    " and resid 4    and name HB2 ))
 OR {   34}
   (( segid "    " and resid 107  and name HE1 ))
   (( segid "    " and resid 4    and name HB1 ))
 OR {   34}
   (( segid "    " and resid 107  and name HE1 ))
   (( segid "    " and resid 4    and name HG  ))
 OR {   34}
   (( segid "    " and resid 107  and name HE1 ))
   (  segid "    " and resid 35   and name HB% )
 ASSI {   37}
   (( segid "    " and resid 107  and name HE1 ))
   (( segid "    " and resid 104  and name HG  ))
      3.900     1.900     1.900 peak    37 weight  0.10000E+01 volume  0.13299E-03 ppm1      9.687 ppm2      1.294 CV     1
 OR {   37}
   (( segid "    " and resid 107  and name HE1 ))
   (( segid "    " and resid 104  and name HB1 ))
 OR {   37}
   (( segid "    " and resid 107  and name HE1 ))
   (( segid "    " and resid 45   and name HG  ))
 ASSI {   43}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 43   and name HB2 ))
      3.200     1.200     1.200 peak    43 weight  0.10000E+01 volume  0.13222E-02 ppm1      9.530 ppm2      1.964 CV     1
 OR {   43}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 43   and name HB1 ))
 OR {   43}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 41   and name HG2 ))
 OR {   43}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 41   and name HB2 ))
 ASSI {   46}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 43   and name HG1 ))
      3.400     1.500     1.500 peak    46 weight  0.10000E+01 volume  0.92887E-03 ppm1      9.533 ppm2      1.269 CV     1
 OR {   46}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 45   and name HB2 ))
 ASSI {   48}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 38   and name HB2 ))
      4.800     2.900     1.200 peak    48 weight  0.10000E+01 volume  0.14917E-03 ppm1      9.531 ppm2      0.648 CV     1
 OR {   48}
   (( segid "    " and resid 40   and name HN  ))
   (  segid "    " and resid 37   and name HG2%)
 ASSI {   51}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 21   and name HN  ))
      3.300     1.300     1.300 peak    51 weight  0.10000E+01 volume  0.86692E-03 ppm1      9.524 ppm2      8.827 CV     1
 OR {   51}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 111  and name HN  ))
 ASSI {   53}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 23   and name HN  ))
      5.900     4.300     0.100 peak    53 weight  0.10000E+01 volume  0.84484E-04 ppm1      9.524 ppm2      8.266 CV     1
 OR {   53}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 5    and name HN  ))
 ASSI {   54}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 36   and name HZ2 ))
      5.100     3.200     0.900 peak    54 weight  0.10000E+01 volume  0.13216E-03 ppm1      9.518 ppm2      6.961 CV     1
 OR {   54}
   (( segid "    " and resid 7    and name HN  ))
   (  segid "    " and resid 80   and name HD% )
 OR {   54}
   (( segid "    " and resid 7    and name HN  ))
   (  segid "    " and resid 94   and name HD% )
 ASSI {   60}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 20   and name HB  ))
      4.000     2.000     2.000 peak    60 weight  0.10000E+01 volume  0.34164E-03 ppm1      9.523 ppm2      2.076 CV     1
 OR {   60}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 5    and name HB1 ))
 OR {   60}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 5    and name HB2 ))
 ASSI {   62}
   (( segid "    " and resid 7    and name HN  ))
   (  segid "    " and resid 23   and name HB% )
      5.400     3.600     0.600 peak    62 weight  0.10000E+01 volume  0.90458E-04 ppm1      9.521 ppm2      1.415 CV     1
 OR {   62}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 4    and name HB1 ))
 OR {   62}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 4    and name HB2 ))
 ASSI {   68}
   (( segid "    " and resid 37   and name HN  ))
   (  segid "    " and resid 95   and name HD% )
      4.300     2.300     1.700 peak    68 weight  0.10000E+01 volume  0.50783E-03 ppm1      9.525 ppm2      6.966 CV     1
 OR {   68}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 36   and name HD1 ))
 OR {   68}
   (( segid "    " and resid 37   and name HN  ))
   (  segid "    " and resid 94   and name HD% )
 OR {   68}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 49   and name HG  ))
 ASSI {   69}
   (( segid "    " and resid 37   and name HN  ))
   (  segid "    " and resid 95   and name HD% )
      4.800     2.900     1.200 peak    69 weight  0.10000E+01 volume  0.24711E-03 ppm1      9.522 ppm2      6.830 CV     1
 OR {   69}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 36   and name HZ3 ))
 OR {   69}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 47   and name HD1 ))
 OR {   69}
   (( segid "    " and resid 37   and name HN  ))
   (  segid "    " and resid 95   and name HE% )
 ASSI {   72}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 96   and name HA  ))
      3.300     1.400     1.400 peak    72 weight  0.10000E+01 volume  0.10516E-02 ppm1      9.522 ppm2      4.922 CV     1
 OR {   72}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 94   and name HA  ))
 OR {   72}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 95   and name HA  ))
 ASSI {   73}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 36   and name HB2 ))
      3.600     1.600     1.600 peak    73 weight  0.10000E+01 volume  0.91990E-03 ppm1      9.525 ppm2      3.101 CV     1
 OR {   73}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 95   and name HB2 ))
 ASSI {   77}
   (( segid "    " and resid 37   and name HN  ))
   (  segid "    " and resid 35   and name HB% )
      4.800     2.900     1.200 peak    77 weight  0.10000E+01 volume  0.14764E-03 ppm1      9.520 ppm2      1.443 CV     1
 OR {   77}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 38   and name HG1 ))
 OR {   77}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 45   and name HB1 ))
 ASSI {   78}
   (( segid "    " and resid 37   and name HN  ))
   (  segid "    " and resid 97   and name HB% )
      4.100     2.200     1.900 peak    78 weight  0.10000E+01 volume  0.41874E-03 ppm1      9.519 ppm2      1.118 CV     1
 OR {   78}
   (( segid "    " and resid 37   and name HN  ))
   (  segid "    " and resid 70   and name HD1%)
 OR {   78}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 104  and name HB2 ))
 OR {   78}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 45   and name HB2 ))
 ASSI {   81}
   (( segid "    " and resid 37   and name HN  ))
   (  segid "    " and resid 104  and name HD2%)
      5.000     3.100     1.000 peak    81 weight  0.10000E+01 volume  0.14307E-03 ppm1      9.523 ppm2      0.432 CV     1
 OR {   81}
   (( segid "    " and resid 37   and name HN  ))
   (  segid "    " and resid 93   and name HG2%)
 ASSI {   83}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 90   and name HN  ))
      4.100     2.100     1.900 peak    83 weight  0.10000E+01 volume  0.26285E-03 ppm1      9.521 ppm2      8.429 CV     1
 OR {   83}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 115  and name HN  ))
 ASSI {   85}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 91   and name HN  ))
      5.800     4.200     0.200 peak    85 weight  0.10000E+01 volume  0.35332E-04 ppm1      9.524 ppm2      7.754 CV     1
 OR {   85}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 84   and name HN  ))
 ASSI {   97}
   (( segid "    " and resid 87   and name HN  ))
   (  segid "    " and resid 86   and name HD1%)
      3.700     1.800     1.800 peak    97 weight  0.10000E+01 volume  0.63913E-03 ppm1      9.519 ppm2      0.438 CV     1
 OR {   97}
   (( segid "    " and resid 87   and name HN  ))
   (  segid "    " and resid 115  and name HG2%)
 ASSI {  104}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 36   and name HA  ))
      4.600     2.600     1.400 peak   104 weight  0.10000E+01 volume  0.26157E-03 ppm1      9.409 ppm2      5.463 CV     1
 OR {  104}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 36   and name HA  ))
 ASSI {  108}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 47   and name HA  ))
      3.900     1.900     1.900 peak   108 weight  0.10000E+01 volume  0.68691E-03 ppm1      9.413 ppm2      4.441 CV     1
 OR {  108}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 93   and name HA  ))
 OR {  108}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 112  and name HA  ))
 ASSI {  113}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 46   and name HG2 ))
      3.700     1.700     1.700 peak   113 weight  0.10000E+01 volume  0.61015E-03 ppm1      9.410 ppm2      2.283 CV     1
 OR {  113}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 39   and name HB1 ))
 ASSI {  114}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 37   and name HB  ))
      2.400     0.700     0.700 peak   114 weight  0.10000E+01 volume  0.41710E-02 ppm1      9.414 ppm2      1.937 CV     1
 OR {  114}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 46   and name HB2 ))
 ASSI {  117}
   (( segid "    " and resid 38   and name HN  ))
   (  segid "    " and resid 37   and name HG1%)
      2.700     0.900     0.900 peak   117 weight  0.10000E+01 volume  0.31601E-02 ppm1      9.414 ppm2      0.852 CV     1
 OR {  117}
   (( segid "    " and resid 38   and name HN  ))
   (  segid "    " and resid 48   and name HG1%)
 OR {  117}
   (( segid "    " and resid 38   and name HN  ))
   (  segid "    " and resid 48   and name HG1%)
 ASSI {  119}
   (( segid "    " and resid 95   and name HN  ))
   (  segid "    " and resid 93   and name HG2%)
      3.500     1.500     1.500 peak   119 weight  0.10000E+01 volume  0.93370E-03 ppm1      9.412 ppm2      0.338 CV     1
 OR {  119}
   (( segid "    " and resid 38   and name HN  ))
   (  segid "    " and resid 45   and name HD1%)
 OR {  119}
   (( segid "    " and resid 38   and name HN  ))
   (  segid "    " and resid 45   and name HD2%)
 OR {  119}
   (( segid "    " and resid 95   and name HN  ))
   (  segid "    " and resid 45   and name HD2%)
 ASSI {  121}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 39   and name HB2 ))
      3.500     1.500     1.500 peak   121 weight  0.10000E+01 volume  0.63333E-03 ppm1      9.412 ppm2      1.759 CV     1
 OR {  121}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 39   and name HB2 ))
 ASSI {  128}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 45   and name HB1 ))
      2.900     1.100     1.100 peak   128 weight  0.10000E+01 volume  0.21297E-02 ppm1      9.387 ppm2      1.404 CV     1
 OR {  128}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 38   and name HG1 ))
 ASSI {  130}
   (( segid "    " and resid 46   and name HN  ))
   (  segid "    " and resid 37   and name HG1%)
      4.300     2.300     1.700 peak   130 weight  0.10000E+01 volume  0.29141E-03 ppm1      9.385 ppm2      0.855 CV     1
 OR {  130}
   (( segid "    " and resid 46   and name HN  ))
   (  segid "    " and resid 48   and name HG1%)
 OR {  130}
   (( segid "    " and resid 46   and name HN  ))
   (  segid "    " and resid 48   and name HG1%)
 ASSI {  131}
   (( segid "    " and resid 46   and name HN  ))
   (  segid "    " and resid 37   and name HG2%)
      3.900     1.900     1.900 peak   131 weight  0.10000E+01 volume  0.27404E-03 ppm1      9.387 ppm2      0.673 CV     1
 OR {  131}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 38   and name HB2 ))
 OR {  131}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 38   and name HB1 ))
 ASSI {  137}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 49   and name HG  ))
      6.000     4.500     0.000 peak   137 weight  0.10000E+01 volume  0.39101E-04 ppm1      9.378 ppm2      6.972 CV     1
 OR {  137}
   (( segid "    " and resid 51   and name HN  ))
   (  segid "    " and resid 60   and name HD% )
 ASSI {  142}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 33   and name HB1 ))
      4.200     2.200     1.800 peak   142 weight  0.10000E+01 volume  0.18919E-03 ppm1      9.374 ppm2      2.813 CV     1
 OR {  142}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 59   and name HB2 ))
 OR {  142}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 53   and name HD1 ))
 OR {  142}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 36   and name HB1 ))
 ASSI {  148}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 69   and name HN  ))
      4.200     2.200     1.800 peak   148 weight  0.10000E+01 volume  0.36272E-03 ppm1      9.254 ppm2      8.886 CV     1
 OR {  148}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 82   and name HN  ))
 ASSI {  150}
   (( segid "    " and resid 70   and name HN  ))
   (  segid "    " and resid 60   and name HE% )
      3.300     1.400     1.400 peak   150 weight  0.10000E+01 volume  0.11435E-02 ppm1      9.257 ppm2      6.745 CV     1
 OR {  150}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 84   and name HD22))
 ASSI {  168}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 93   and name HB  ))
      3.300     1.400     1.400 peak   168 weight  0.10000E+01 volume  0.11470E-02 ppm1      9.249 ppm2      1.959 CV     1
 OR {  168}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 72   and name HB1 ))
 ASSI {  170}
   (( segid "    " and resid 39   and name HN  ))
   (  segid "    " and resid 92   and name HB% )
      2.800     1.000     1.000 peak   170 weight  0.10000E+01 volume  0.30764E-02 ppm1      9.252 ppm2      1.098 CV     1
 OR {  170}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 79   and name HB2 ))
 ASSI {  171}
   (( segid "    " and resid 80   and name HN  ))
   (  segid "    " and resid 79   and name HD2%)
      2.800     1.000     1.000 peak   171 weight  0.10000E+01 volume  0.26484E-02 ppm1      9.238 ppm2      0.930 CV     1
 OR {  171}
   (( segid "    " and resid 39   and name HN  ))
   (  segid "    " and resid 93   and name HG1%)
 ASSI {  173}
   (( segid "    " and resid 39   and name HN  ))
   (  segid "    " and resid 93   and name HG2%)
      3.300     1.300     1.300 peak   173 weight  0.10000E+01 volume  0.88550E-03 ppm1      9.250 ppm2      0.348 CV     1
 OR {  173}
   (( segid "    " and resid 39   and name HN  ))
   (  segid "    " and resid 45   and name HD2%)
 ASSI {  176}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 79   and name HN  ))
      3.600     1.600     1.600 peak   176 weight  0.10000E+01 volume  0.97702E-03 ppm1      9.233 ppm2      8.504 CV     1
 OR {  176}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 81   and name HN  ))
 ASSI {  181}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 93   and name HA  ))
      4.600     2.700     1.400 peak   181 weight  0.10000E+01 volume  0.23507E-03 ppm1      9.257 ppm2      4.475 CV     1
 OR {  181}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 92   and name HA  ))
 ASSI {  184}
   (( segid "    " and resid 39   and name HN  ))
   (  segid "    " and resid 93   and name HG2%)
      3.400     1.400     1.400 peak   184 weight  0.10000E+01 volume  0.81642E-03 ppm1      9.248 ppm2      0.348 CV     1
 OR {  184}
   (( segid "    " and resid 80   and name HN  ))
   (  segid "    " and resid 79   and name HD1%)
 ASSI {  191}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 97   and name HN  ))
      3.200     1.200     1.200 peak   191 weight  0.10000E+01 volume  0.12989E-02 ppm1      9.172 ppm2      8.569 CV     1
 OR {  191}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 99   and name HN  ))
 ASSI {  195}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 99   and name HB1 ))
      4.900     3.000     1.100 peak   195 weight  0.10000E+01 volume  0.15916E-03 ppm1      9.169 ppm2      2.715 CV     1
 OR {  195}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 99   and name HB2 ))
 OR {  195}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 32   and name HB2 ))
 ASSI {  199}
   (( segid "    " and resid 35   and name HN  ))
   (  segid "    " and resid 97   and name HB% )
      3.300     1.400     1.400 peak   199 weight  0.10000E+01 volume  0.13448E-02 ppm1      9.171 ppm2      1.108 CV     1
 OR {  199}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 98   and name HG2 ))
 OR {  199}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 98   and name HG1 ))
 OR {  199}
   (( segid "    " and resid 35   and name HN  ))
   (  segid "    " and resid 70   and name HD1%)
 ASSI {  200}
   (( segid "    " and resid 35   and name HN  ))
   (  segid "    " and resid 51   and name HG2%)
      3.900     1.900     1.900 peak   200 weight  0.10000E+01 volume  0.55267E-03 ppm1      9.175 ppm2      0.942 CV     1
 OR {  200}
   (( segid "    " and resid 35   and name HN  ))
   (  segid "    " and resid 79   and name HD2%)
 OR {  200}
   (( segid "    " and resid 35   and name HN  ))
   (  segid "    " and resid 106  and name HB% )
 ASSI {  201}
   (( segid "    " and resid 35   and name HN  ))
   (  segid "    " and resid 104  and name HD2%)
      3.800     1.800     1.800 peak   201 weight  0.10000E+01 volume  0.47885E-03 ppm1      9.171 ppm2      0.385 CV     1
 OR {  201}
   (( segid "    " and resid 35   and name HN  ))
   (  segid "    " and resid 79   and name HD1%)
 OR {  201}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 98   and name HD2 ))
 ASSI {  204}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 79   and name HN  ))
      3.100     1.200     1.200 peak   204 weight  0.10000E+01 volume  0.11685E-02 ppm1      9.165 ppm2      8.483 CV     1
 OR {  204}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 81   and name HN  ))
 ASSI {  211}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 79   and name HA  ))
      4.000     2.000     2.000 peak   211 weight  0.10000E+01 volume  0.50484E-03 ppm1      9.165 ppm2      5.066 CV     1
 OR {  211}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 78   and name HA  ))
 ASSI {  216}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 79   and name HB1 ))
      3.800     1.800     1.800 peak   216 weight  0.10000E+01 volume  0.71772E-03 ppm1      9.166 ppm2      1.775 CV     1
 OR {  216}
   (( segid "    " and resid 22   and name HN  ))
   (  segid "    " and resid 6    and name HB% )
 OR {  216}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 96   and name HB1 ))
 OR {  216}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 79   and name HG  ))
 ASSI {  217}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 79   and name HB2 ))
      3.800     1.800     1.800 peak   217 weight  0.10000E+01 volume  0.30195E-03 ppm1      9.164 ppm2      1.030 CV     1
 OR {  217}
   (( segid "    " and resid 22   and name HN  ))
   (  segid "    " and resid 111  and name HG2%)
 ASSI {  218}
   (( segid "    " and resid 22   and name HN  ))
   (  segid "    " and resid 78   and name HG2%)
      3.100     1.200     1.200 peak   218 weight  0.10000E+01 volume  0.12183E-02 ppm1      9.165 ppm2      0.651 CV     1
 OR {  218}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 81   and name HB2 ))
 ASSI {  219}
   (( segid "    " and resid 22   and name HN  ))
   (  segid "    " and resid 79   and name HD1%)
      5.000     3.100     1.000 peak   219 weight  0.10000E+01 volume  0.12876E-03 ppm1      9.172 ppm2      0.404 CV     1
 OR {  219}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 81   and name HG  ))
 ASSI {  221}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 93   and name HN  ))
      4.300     2.300     1.700 peak   221 weight  0.10000E+01 volume  0.36358E-03 ppm1      9.146 ppm2      7.740 CV     1
 OR {  221}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 36   and name HE3 ))
 ASSI {  225}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 93   and name HA  ))
      2.200     0.600     0.600 peak   225 weight  0.10000E+01 volume  0.64216E-02 ppm1      9.147 ppm2      4.405 CV     1
 OR {  225}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 112  and name HA  ))
 ASSI {  228}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 93   and name HB  ))
      3.900     1.900     1.900 peak   228 weight  0.10000E+01 volume  0.44904E-03 ppm1      9.148 ppm2      1.997 CV     1
 OR {  228}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 112  and name HB2 ))
 OR {  228}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 112  and name HB1 ))
 ASSI {  229}
   (( segid "    " and resid 94   and name HN  ))
   (  segid "    " and resid 111  and name HG2%)
      2.900     1.000     1.000 peak   229 weight  0.10000E+01 volume  0.19038E-02 ppm1      9.146 ppm2      0.993 CV     1
 OR {  229}
   (( segid "    " and resid 94   and name HN  ))
   (  segid "    " and resid 93   and name HG1%)
 ASSI {  230}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 38   and name HB1 ))
      4.100     2.100     1.900 peak   230 weight  0.10000E+01 volume  0.40106E-03 ppm1      9.144 ppm2      0.711 CV     1
 OR {  230}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 38   and name HB2 ))
 OR {  230}
   (( segid "    " and resid 94   and name HN  ))
   (  segid "    " and resid 18   and name HD2%)
 ASSI {  237}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 87   and name HB2 ))
      3.700     1.700     1.700 peak   237 weight  0.10000E+01 volume  0.36030E-03 ppm1      9.141 ppm2      2.145 CV     1
 OR {  237}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 89   and name HB1 ))
 ASSI {  245}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 94   and name HH  ))
      4.900     3.000     1.100 peak   245 weight  0.10000E+01 volume  0.13103E-03 ppm1      9.097 ppm2     10.263 CV     1
 OR {  245}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 94   and name HH  ))
 ASSI {  246}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 115  and name HN  ))
      4.800     2.800     1.200 peak   246 weight  0.10000E+01 volume  0.23313E-03 ppm1      9.099 ppm2      8.396 CV     1
 OR {  246}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 90   and name HN  ))
 OR {  246}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 114  and name HN  ))
 ASSI {  247}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 91   and name HN  ))
      3.900     1.900     1.900 peak   247 weight  0.10000E+01 volume  0.48626E-03 ppm1      9.099 ppm2      7.768 CV     1
 OR {  247}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 93   and name HN  ))
 ASSI {  248}
   (( segid "    " and resid 92   and name HN  ))
   (  segid "    " and resid 94   and name HD% )
      3.500     1.500     1.500 peak   248 weight  0.10000E+01 volume  0.98714E-03 ppm1      9.097 ppm2      6.951 CV     1
 OR {  248}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 112  and name HE22))
 ASSI {  250}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 91   and name HG1 ))
      5.200     3.400     0.800 peak   250 weight  0.10000E+01 volume  0.16520E-03 ppm1      9.100 ppm2      5.816 CV     1
 OR {  250}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 38   and name HA  ))
 ASSI {  253}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 112  and name HG2 ))
      3.500     1.600     1.600 peak   253 weight  0.10000E+01 volume  0.74817E-03 ppm1      9.099 ppm2      2.348 CV     1
 OR {  253}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 113  and name HB  ))
 ASSI {  254}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 112  and name HG1 ))
      4.400     2.400     1.600 peak   254 weight  0.10000E+01 volume  0.29650E-03 ppm1      9.101 ppm2      1.995 CV     1
 OR {  254}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 93   and name HB  ))
 OR {  254}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 112  and name HB2 ))
 OR {  254}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 112  and name HB1 ))
 ASSI {  257}
   (( segid "    " and resid 92   and name HN  ))
   (  segid "    " and resid 93   and name HG1%)
      4.500     2.500     1.500 peak   257 weight  0.10000E+01 volume  0.26702E-03 ppm1      9.095 ppm2      0.916 CV     1
 OR {  257}
   (( segid "    " and resid 92   and name HN  ))
   (  segid "    " and resid 86   and name HD2%)
 OR {  257}
   (( segid "    " and resid 92   and name HN  ))
   (  segid "    " and resid 83   and name HE% )
 ASSI {  258}
   (( segid "    " and resid 92   and name HN  ))
   (  segid "    " and resid 113  and name HG2%)
      3.300     1.300     1.300 peak   258 weight  0.10000E+01 volume  0.14934E-02 ppm1      9.100 ppm2      0.613 CV     1
 OR {  258}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 38   and name HB2 ))
 OR {  258}
   (( segid "    " and resid 92   and name HN  ))
   (  segid "    " and resid 115  and name HG1%)
 ASSI {  264}
   (( segid "    " and resid 72   and name HN  ))
   (  segid "    " and resid 79   and name HD2%)
      3.900     1.900     1.900 peak   264 weight  0.10000E+01 volume  0.51790E-03 ppm1      9.073 ppm2      0.971 CV     1
 OR {  264}
   (( segid "    " and resid 72   and name HN  ))
   (  segid "    " and resid 51   and name HG2%)
 ASSI {  267}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 114  and name HN  ))
      3.400     1.400     1.400 peak   267 weight  0.10000E+01 volume  0.12766E-02 ppm1      9.035 ppm2      8.442 CV     1
 OR {  267}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 115  and name HN  ))
 ASSI {  278}
   (( segid "    " and resid 12   and name HN  ))
   (  segid "    " and resid 115  and name HG1%)
      3.200     1.300     1.300 peak   278 weight  0.10000E+01 volume  0.12309E-02 ppm1      9.034 ppm2      0.634 CV     1
 OR {  278}
   (( segid "    " and resid 12   and name HN  ))
   (  segid "    " and resid 18   and name HD2%)
 ASSI {  282}
   (( segid "    " and resid 62   and name HN  ))
   (  segid "    " and resid 61   and name HB% )
      3.700     1.800     1.800 peak   282 weight  0.10000E+01 volume  0.48143E-03 ppm1      9.018 ppm2      1.389 CV     1
 OR {  282}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 65   and name HG2 ))
 OR {  282}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 65   and name HG1 ))
 ASSI {  283}
   (( segid "    " and resid 113  and name HN  ))
   (  segid "    " and resid 93   and name HG2%)
      3.400     1.500     1.500 peak   283 weight  0.10000E+01 volume  0.39404E-03 ppm1      8.973 ppm2      0.353 CV     1
 OR {  283}
   (( segid "    " and resid 113  and name HN  ))
   (  segid "    " and resid 20   and name HG1%)
 ASSI {  284}
   (( segid "    " and resid 113  and name HN  ))
   (  segid "    " and resid 111  and name HG2%)
      3.800     1.800     1.800 peak   284 weight  0.10000E+01 volume  0.42624E-03 ppm1      8.970 ppm2      1.107 CV     1
 OR {  284}
   (( segid "    " and resid 113  and name HN  ))
   (  segid "    " and resid 92   and name HB% )
 OR {  284}
   (( segid "    " and resid 113  and name HN  ))
   (  segid "    " and resid 114  and name HG2%)
 ASSI {  287}
   (( segid "    " and resid 113  and name HN  ))
   (  segid "    " and resid 91   and name HG2%)
      4.800     2.900     1.200 peak   287 weight  0.10000E+01 volume  0.95945E-04 ppm1      8.975 ppm2      1.498 CV     1
 OR {  287}
   (( segid "    " and resid 113  and name HN  ))
   (  segid "    " and resid 40   and name HB% )
 OR {  287}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 11   and name HG  ))
 ASSI {  288}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 112  and name HG1 ))
      3.300     1.300     1.300 peak   288 weight  0.10000E+01 volume  0.18300E-02 ppm1      8.972 ppm2      2.026 CV     1
 OR {  288}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 112  and name HB1 ))
 OR {  288}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 112  and name HB2 ))
 OR {  288}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 93   and name HB  ))
 ASSI {  291}
   (( segid "    " and resid 113  and name HN  ))
   (  segid "    " and resid 94   and name HD% )
      3.500     1.500     1.500 peak   291 weight  0.10000E+01 volume  0.85841E-03 ppm1      8.977 ppm2      6.963 CV     1
 OR {  291}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 112  and name HE22))
 ASSI {  292}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 112  and name HE21))
      3.500     1.500     1.500 peak   292 weight  0.10000E+01 volume  0.75567E-03 ppm1      8.973 ppm2      6.718 CV     1
 OR {  292}
   (( segid "    " and resid 113  and name HN  ))
   (  segid "    " and resid 94   and name HE% )
 ASSI {  295}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 46   and name HN  ))
      5.000     3.100     1.000 peak   295 weight  0.10000E+01 volume  0.13731E-03 ppm1      8.968 ppm2      9.385 CV     1
 OR {  295}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 38   and name HN  ))
 ASSI {  304}
   (( segid "    " and resid 47   and name HN  ))
   (  segid "    " and resid 37   and name HG1%)
      4.300     2.300     1.700 peak   304 weight  0.10000E+01 volume  0.26779E-03 ppm1      8.967 ppm2      0.860 CV     1
 OR {  304}
   (( segid "    " and resid 47   and name HN  ))
   (  segid "    " and resid 48   and name HG1%)
 OR {  304}
   (( segid "    " and resid 47   and name HN  ))
   (  segid "    " and resid 48   and name HG1%)
 ASSI {  306}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 45   and name HB1 ))
      4.300     2.300     1.700 peak   306 weight  0.10000E+01 volume  0.10863E-03 ppm1      8.971 ppm2      1.428 CV     1
 OR {  306}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 38   and name HG1 ))
 ASSI {  307}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 45   and name HG  ))
      5.000     3.200     1.000 peak   307 weight  0.10000E+01 volume  0.28314E-04 ppm1      8.970 ppm2      1.237 CV     1
 OR {  307}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 45   and name HB2 ))
 OR {  307}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 104  and name HB2 ))
 ASSI {  309}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 78   and name HN  ))
      3.700     1.700     1.700 peak   309 weight  0.10000E+01 volume  0.40746E-03 ppm1      8.956 ppm2      7.470 CV     1
 OR {  309}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 76   and name HN  ))
 ASSI {  320}
   (( segid "    " and resid 73   and name HN  ))
   (  segid "    " and resid 79   and name HD2%)
      6.000     4.500     0.000 peak   320 weight  0.10000E+01 volume  0.49522E-04 ppm1      8.955 ppm2      0.936 CV     1
 OR {  320}
   (( segid "    " and resid 73   and name HN  ))
   (  segid "    " and resid 51   and name HG2%)
 ASSI {  339}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 95   and name HB2 ))
      3.000     1.200     1.200 peak   339 weight  0.10000E+01 volume  0.14638E-02 ppm1      8.896 ppm2      3.122 CV     1
 OR {  339}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 107  and name HB1 ))
 ASSI {  343}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 4    and name HB1 ))
      3.800     1.800     1.800 peak   343 weight  0.10000E+01 volume  0.52723E-03 ppm1      8.899 ppm2      1.419 CV     1
 OR {  343}
   (( segid "    " and resid 60   and name HN  ))
   (  segid "    " and resid 61   and name HB% )
 OR {  343}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 4    and name HB2 ))
 OR {  343}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 65   and name HG2 ))
 OR {  343}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 65   and name HG1 ))
 OR {  343}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 4    and name HG  ))
 ASSI {  346}
   (( segid "    " and resid 96   and name HN  ))
   (  segid "    " and resid 37   and name HG2%)
      4.100     2.100     1.900 peak   346 weight  0.10000E+01 volume  0.38022E-03 ppm1      8.897 ppm2      0.633 CV     1
 OR {  346}
   (( segid "    " and resid 96   and name HN  ))
   (  segid "    " and resid 4    and name HD2%)
 OR {  346}
   (( segid "    " and resid 96   and name HN  ))
   (  segid "    " and resid 4    and name HD1%)
 ASSI {  347}
   (( segid "    " and resid 96   and name HN  ))
   (  segid "    " and resid 93   and name HG2%)
      4.600     2.700     1.400 peak   347 weight  0.10000E+01 volume  0.15450E-03 ppm1      8.900 ppm2      0.389 CV     1
 OR {  347}
   (( segid "    " and resid 96   and name HN  ))
   (  segid "    " and resid 45   and name HD1%)
 OR {  347}
   (( segid "    " and resid 96   and name HN  ))
   (  segid "    " and resid 104  and name HD2%)
 OR {  347}
   (( segid "    " and resid 96   and name HN  ))
   (  segid "    " and resid 45   and name HD2%)
 OR {  347}
   (( segid "    " and resid 96   and name HN  ))
   (  segid "    " and resid 20   and name HG1%)
 ASSI {  349}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 71   and name HN  ))
      3.800     1.800     1.800 peak   349 weight  0.10000E+01 volume  0.69211E-03 ppm1      8.881 ppm2      8.564 CV     1
 OR {  349}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 81   and name HN  ))
 ASSI {  351}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 69   and name HB  ))
      3.300     1.300     1.300 peak   351 weight  0.10000E+01 volume  0.10568E-02 ppm1      8.878 ppm2      3.813 CV     1
 OR {  351}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 17   and name HB2 ))
 OR {  351}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 69   and name HB  ))
 ASSI {  359}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 68   and name HB1 ))
      3.500     1.500     1.500 peak   359 weight  0.10000E+01 volume  0.26660E-03 ppm1      8.877 ppm2      2.936 CV     1
 OR {  359}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 19   and name HD2 ))
 OR {  359}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 19   and name HD1 ))
 OR {  359}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 68   and name HB2 ))
 OR {  359}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 94   and name HB2 ))
 ASSI {  361}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 19   and name HN  ))
      3.400     1.400     1.400 peak   361 weight  0.10000E+01 volume  0.67863E-03 ppm1      8.862 ppm2      8.164 CV     1
 OR {  361}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 20   and name HN  ))
 OR {  361}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 86   and name HN  ))
 OR {  361}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 19   and name HN  ))
 ASSI {  365}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 19   and name HA  ))
      3.000     1.100     1.100 peak   365 weight  0.10000E+01 volume  0.15394E-02 ppm1      8.860 ppm2      5.109 CV     1
 OR {  365}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 84   and name HA  ))
 OR {  365}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 19   and name HA  ))
 ASSI {  372}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 68   and name HN  ))
      5.000     3.100     1.000 peak   372 weight  0.10000E+01 volume  0.12864E-03 ppm1      8.876 ppm2      7.362 CV     1
 OR {  372}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 84   and name HD21))
 ASSI {  377}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 83   and name HA  ))
      3.300     1.400     1.400 peak   377 weight  0.10000E+01 volume  0.65660E-03 ppm1      8.876 ppm2      3.985 CV     1
 OR {  377}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 83   and name HA  ))
 ASSI {  383}
   (( segid "    " and resid 69   and name HN  ))
   (  segid "    " and resid 70   and name HG2%)
      4.000     2.000     2.000 peak   383 weight  0.10000E+01 volume  0.46151E-03 ppm1      8.875 ppm2      0.990 CV     1
 OR {  383}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 83   and name HB1 ))
 OR {  383}
   (( segid "    " and resid 82   and name HN  ))
   (  segid "    " and resid 70   and name HG2%)
 OR {  383}
   (( segid "    " and resid 82   and name HN  ))
   (  segid "    " and resid 83   and name HE% )
 OR {  383}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 83   and name HB1 ))
 OR {  383}
   (( segid "    " and resid 69   and name HN  ))
   (  segid "    " and resid 70   and name HD1%)
 OR {  383}
   (( segid "    " and resid 69   and name HN  ))
   (  segid "    " and resid 83   and name HE% )
 ASSI {  386}
   (( segid "    " and resid 82   and name HN  ))
   (  segid "    " and resid 81   and name HD1%)
      4.800     2.900     1.200 peak   386 weight  0.10000E+01 volume  0.91930E-04 ppm1      8.878 ppm2      0.157 CV     1
 OR {  386}
   (( segid "    " and resid 69   and name HN  ))
   (  segid "    " and resid 81   and name HD1%)
 ASSI {  387}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 83   and name HG1 ))
      4.100     2.100     1.900 peak   387 weight  0.10000E+01 volume  0.22271E-03 ppm1      8.885 ppm2     -0.037 CV     1
 OR {  387}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 83   and name HG1 ))
 ASSI {  392}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 49   and name HN  ))
      3.300     1.300     1.300 peak   392 weight  0.10000E+01 volume  0.17187E-02 ppm1      8.848 ppm2      7.129 CV     1
 OR {  392}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 47   and name HZ2 ))
 OR {  392}
   (( segid "    " and resid 50   and name HN  ))
   (  segid "    " and resid 59   and name HD% )
 ASSI {  393}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 49   and name HG  ))
      3.000     1.100     1.100 peak   393 weight  0.10000E+01 volume  0.16350E-02 ppm1      8.844 ppm2      6.995 CV     1
 OR {  393}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 47   and name HZ2 ))
 OR {  393}
   (( segid "    " and resid 50   and name HN  ))
   (  segid "    " and resid 59   and name HD% )
 ASSI {  399}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 49   and name HB2 ))
      3.600     1.600     1.600 peak   399 weight  0.10000E+01 volume  0.10484E-02 ppm1      8.848 ppm2      3.833 CV     1
 OR {  399}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 58   and name HB  ))
 ASSI {  405}
   (( segid "    " and resid 50   and name HN  ))
   (  segid "    " and resid 70   and name HD1%)
      3.300     1.300     1.300 peak   405 weight  0.10000E+01 volume  0.95338E-03 ppm1      8.848 ppm2      1.032 CV     1
 OR {  405}
   (( segid "    " and resid 50   and name HN  ))
   (  segid "    " and resid 70   and name HG2%)
 OR {  405}
   (( segid "    " and resid 50   and name HN  ))
   (  segid "    " and resid 51   and name HG2%)
 OR {  405}
   (( segid "    " and resid 50   and name HN  ))
   (  segid "    " and resid 48   and name HG2%)
 OR {  405}
   (( segid "    " and resid 50   and name HN  ))
   (  segid "    " and resid 48   and name HG2%)
 ASSI {  406}
   (( segid "    " and resid 50   and name HN  ))
   (  segid "    " and resid 51   and name HD1%)
      5.000     3.100     1.000 peak   406 weight  0.10000E+01 volume  0.11788E-03 ppm1      8.848 ppm2      0.837 CV     1
 OR {  406}
   (( segid "    " and resid 50   and name HN  ))
   (  segid "    " and resid 64   and name HG1%)
 ASSI {  411}
   (( segid "    " and resid 21   and name HN  ))
   (  segid "    " and resid 80   and name HD% )
      3.500     1.500     1.500 peak   411 weight  0.10000E+01 volume  0.15990E-02 ppm1      8.833 ppm2      6.967 CV     1
 OR {  411}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 36   and name HZ2 ))
 OR {  411}
   (( segid "    " and resid 21   and name HN  ))
   (  segid "    " and resid 94   and name HD% )
 ASSI {  420}
   (( segid "    " and resid 21   and name HN  ))
   (  segid "    " and resid 20   and name HG1%)
      2.900     1.000     1.000 peak   420 weight  0.10000E+01 volume  0.33050E-02 ppm1      8.808 ppm2      0.358 CV     1
 OR {  420}
   (( segid "    " and resid 111  and name HN  ))
   (  segid "    " and resid 93   and name HG2%)
 ASSI {  428}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 51   and name HN  ))
      4.300     2.400     1.700 peak   428 weight  0.10000E+01 volume  0.51647E-03 ppm1      8.762 ppm2      9.396 CV     1
 OR {  428}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 38   and name HN  ))
 OR {  428}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 95   and name HN  ))
 ASSI {  438}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 48   and name HB  ))
      3.600     1.700     1.700 peak   438 weight  0.10000E+01 volume  0.99353E-03 ppm1      8.761 ppm2      1.930 CV     1
 OR {  438}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 34   and name HB2 ))
 OR {  438}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 37   and name HB  ))
 OR {  438}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 70   and name HB  ))
 ASSI {  440}
   (( segid "    " and resid 36   and name HN  ))
   (  segid "    " and resid 50   and name HG2%)
      3.700     1.700     1.700 peak   440 weight  0.10000E+01 volume  0.11436E-02 ppm1      8.762 ppm2      1.264 CV     1
 OR {  440}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 70   and name HG11))
 OR {  440}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 104  and name HG  ))
 OR {  440}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 38   and name HG2 ))
 ASSI {  441}
   (( segid "    " and resid 36   and name HN  ))
   (  segid "    " and resid 70   and name HD1%)
      3.000     1.100     1.100 peak   441 weight  0.10000E+01 volume  0.27946E-02 ppm1      8.764 ppm2      1.072 CV     1
 OR {  441}
   (( segid "    " and resid 36   and name HN  ))
   (  segid "    " and resid 48   and name HG2%)
 OR {  441}
   (( segid "    " and resid 36   and name HN  ))
   (  segid "    " and resid 48   and name HG2%)
 OR {  441}
   (( segid "    " and resid 36   and name HN  ))
   (  segid "    " and resid 70   and name HG2%)
 ASSI {  442}
   (( segid "    " and resid 36   and name HN  ))
   (  segid "    " and resid 37   and name HG1%)
      3.400     1.400     1.400 peak   442 weight  0.10000E+01 volume  0.10911E-02 ppm1      8.762 ppm2      0.876 CV     1
 OR {  442}
   (( segid "    " and resid 36   and name HN  ))
   (  segid "    " and resid 48   and name HG2%)
 OR {  442}
   (( segid "    " and resid 36   and name HN  ))
   (  segid "    " and resid 51   and name HG2%)
 OR {  442}
   (( segid "    " and resid 36   and name HN  ))
   (  segid "    " and resid 48   and name HG1%)
 OR {  442}
   (( segid "    " and resid 36   and name HN  ))
   (  segid "    " and resid 48   and name HG1%)
 OR {  442}
   (( segid "    " and resid 36   and name HN  ))
   (  segid "    " and resid 79   and name HD2%)
 ASSI {  443}
   (( segid "    " and resid 36   and name HN  ))
   (  segid "    " and resid 37   and name HG2%)
      4.500     2.600     1.500 peak   443 weight  0.10000E+01 volume  0.30028E-03 ppm1      8.762 ppm2      0.628 CV     1
 OR {  443}
   (( segid "    " and resid 36   and name HN  ))
   (  segid "    " and resid 81   and name HD2%)
 ASSI {  444}
   (( segid "    " and resid 36   and name HN  ))
   (  segid "    " and resid 104  and name HD2%)
      4.000     2.000     2.000 peak   444 weight  0.10000E+01 volume  0.46671E-03 ppm1      8.768 ppm2      0.372 CV     1
 OR {  444}
   (( segid "    " and resid 36   and name HN  ))
   (  segid "    " and resid 79   and name HD1%)
 ASSI {  457}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 41   and name HB2 ))
      5.100     3.300     0.900 peak   457 weight  0.10000E+01 volume  0.13024E-03 ppm1      8.693 ppm2      1.924 CV     1
 OR {  457}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 43   and name HB2 ))
 ASSI {  466}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 19   and name HN  ))
      4.500     2.600     1.500 peak   466 weight  0.10000E+01 volume  0.25553E-03 ppm1      8.642 ppm2      8.143 CV     1
 OR {  466}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 86   and name HN  ))
 ASSI {  470}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 84   and name HA  ))
      3.800     1.800     1.800 peak   470 weight  0.10000E+01 volume  0.59309E-03 ppm1      8.638 ppm2      5.118 CV     1
 OR {  470}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 19   and name HA  ))
 ASSI {  475}
   (( segid "    " and resid 18   and name HN  ))
   (  segid "    " and resid 86   and name HD2%)
      3.500     1.500     1.500 peak   475 weight  0.10000E+01 volume  0.12976E-02 ppm1      8.641 ppm2      0.964 CV     1
 OR {  475}
   (( segid "    " and resid 18   and name HN  ))
   (  segid "    " and resid 83   and name HE% )
 OR {  475}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 83   and name HB1 ))
 ASSI {  484}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 35   and name HA  ))
      3.900     1.900     1.900 peak   484 weight  0.10000E+01 volume  0.37473E-03 ppm1      8.593 ppm2      5.677 CV     1
 OR {  484}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 34   and name HA  ))
 ASSI {  489}
   (( segid "    " and resid 97   and name HN  ))
   (  segid "    " and resid 35   and name HB% )
      3.600     1.700     1.700 peak   489 weight  0.10000E+01 volume  0.58284E-03 ppm1      8.592 ppm2      1.458 CV     1
 OR {  489}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 98   and name HB1 ))
 OR {  489}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 98   and name HB2 ))
 OR {  489}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 4    and name HG  ))
 ASSI {  491}
   (( segid "    " and resid 97   and name HN  ))
   (  segid "    " and resid 106  and name HB% )
      4.100     2.100     1.900 peak   491 weight  0.10000E+01 volume  0.24536E-03 ppm1      8.594 ppm2      0.927 CV     1
 OR {  491}
   (( segid "    " and resid 97   and name HN  ))
   (  segid "    " and resid 79   and name HD2%)
 ASSI {  492}
   (( segid "    " and resid 97   and name HN  ))
   (  segid "    " and resid 4    and name HD1%)
      4.600     2.600     1.400 peak   492 weight  0.10000E+01 volume  0.21174E-03 ppm1      8.594 ppm2      0.737 CV     1
 OR {  492}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 98   and name HD1 ))
 ASSI {  493}
   (( segid "    " and resid 97   and name HN  ))
   (  segid "    " and resid 37   and name HG2%)
      3.700     1.700     1.700 peak   493 weight  0.10000E+01 volume  0.52709E-03 ppm1      8.594 ppm2      0.608 CV     1
 OR {  493}
   (( segid "    " and resid 97   and name HN  ))
   (  segid "    " and resid 4    and name HD2%)
 ASSI {  495}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 36   and name HB2 ))
      4.800     2.900     1.200 peak   495 weight  0.10000E+01 volume  0.10967E-03 ppm1      8.602 ppm2      3.080 CV     1
 OR {  495}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 107  and name HB1 ))
 OR {  495}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 107  and name HB2 ))
 ASSI {  496}
   (( segid "    " and resid 6    and name HN  ))
   (  segid "    " and resid 95   and name HE% )
      5.400     3.700     0.600 peak   496 weight  0.10000E+01 volume  0.73911E-04 ppm1      8.582 ppm2      6.792 CV     1
 OR {  496}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 36   and name HH2 ))
 OR {  496}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 36   and name HZ3 ))
 ASSI {  501}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 109  and name HG1 ))
      4.000     2.000     2.000 peak   501 weight  0.10000E+01 volume  0.37743E-03 ppm1      8.588 ppm2      2.615 CV     1
 OR {  501}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 109  and name HG2 ))
 OR {  501}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 110  and name HA2 ))
 ASSI {  502}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 109  and name HB2 ))
      2.900     1.100     1.100 peak   502 weight  0.10000E+01 volume  0.24274E-02 ppm1      8.587 ppm2      2.283 CV     1
 OR {  502}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 5    and name HG2 ))
 OR {  502}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 5    and name HG1 ))
 OR {  502}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 109  and name HB1 ))
 ASSI {  505}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 4    and name HB1 ))
      4.900     3.000     1.100 peak   505 weight  0.10000E+01 volume  0.13787E-03 ppm1      8.586 ppm2      1.426 CV     1
 OR {  505}
   (( segid "    " and resid 6    and name HN  ))
   (  segid "    " and resid 23   and name HB% )
 OR {  505}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 4    and name HB2 ))
 OR {  505}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 4    and name HG  ))
 ASSI {  514}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 21   and name HN  ))
      3.600     1.700     1.700 peak   514 weight  0.10000E+01 volume  0.32598E-03 ppm1      8.529 ppm2      8.824 CV     1
 OR {  514}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 83   and name HN  ))
 ASSI {  517}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 36   and name HZ2 ))
      3.300     1.400     1.400 peak   517 weight  0.10000E+01 volume  0.14841E-02 ppm1      8.521 ppm2      6.936 CV     1
 OR {  517}
   (( segid "    " and resid 81   and name HN  ))
   (  segid "    " and resid 80   and name HD% )
 ASSI {  542}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 31   and name HN  ))
      4.200     2.200     1.800 peak   542 weight  0.10000E+01 volume  0.17574E-03 ppm1      8.509 ppm2      7.783 CV     1
 OR {  542}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 84   and name HN  ))
 OR {  542}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 58   and name HN  ))
 ASSI {  544}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 84   and name HD22))
      5.100     3.300     0.900 peak   544 weight  0.10000E+01 volume  0.62634E-04 ppm1      8.511 ppm2      6.791 CV     1
 OR {  544}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 67   and name HE  ))
 OR {  544}
   (( segid "    " and resid 52   and name HN  ))
   (  segid "    " and resid 60   and name HE% )
 OR {  544}
   (( segid "    " and resid 52   and name HN  ))
   (  segid "    " and resid 59   and name HE% )
 ASSI {  545}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 17   and name HA  ))
      3.700     1.700     1.700 peak   545 weight  0.10000E+01 volume  0.55069E-03 ppm1      8.507 ppm2      5.569 CV     1
 OR {  545}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 50   and name HA  ))
 ASSI {  547}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 29   and name HA  ))
      3.500     1.500     1.500 peak   547 weight  0.10000E+01 volume  0.65242E-03 ppm1      8.506 ppm2      4.291 CV     1
 OR {  547}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 31   and name HA  ))
 OR {  547}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 15   and name HA1 ))
 ASSI {  551}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 14   and name HD1 ))
      3.400     1.500     1.500 peak   551 weight  0.10000E+01 volume  0.34550E-03 ppm1      8.509 ppm2      3.463 CV     1
 OR {  551}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 14   and name HD2 ))
 OR {  551}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 59   and name HB1 ))
 ASSI {  552}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 72   and name HD2 ))
      4.500     2.500     1.500 peak   552 weight  0.10000E+01 volume  0.23405E-03 ppm1      8.509 ppm2      3.282 CV     1
 OR {  552}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 67   and name HD1 ))
 OR {  552}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 67   and name HD2 ))
 OR {  552}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 32   and name HB1 ))
 ASSI {  559}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 80   and name HN  ))
      3.400     1.500     1.500 peak   559 weight  0.10000E+01 volume  0.80396E-03 ppm1      8.504 ppm2      9.224 CV     1
 OR {  559}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 70   and name HN  ))
 ASSI {  562}
   (( segid "    " and resid 71   and name HN  ))
   (  segid "    " and resid 80   and name HD% )
      4.700     2.700     1.300 peak   562 weight  0.10000E+01 volume  0.19119E-03 ppm1      8.508 ppm2      6.953 CV     1
 OR {  562}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 36   and name HD1 ))
 OR {  562}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 36   and name HZ2 ))
 OR {  562}
   (( segid "    " and resid 71   and name HN  ))
   (  segid "    " and resid 68   and name HD% )
 OR {  562}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 49   and name HG  ))
 ASSI {  569}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 72   and name HB2 ))
      4.500     2.500     1.500 peak   569 weight  0.10000E+01 volume  0.23310E-03 ppm1      8.505 ppm2      1.758 CV     1
 OR {  569}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 79   and name HG  ))
 OR {  569}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 79   and name HB1 ))
 ASSI {  570}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 51   and name HB  ))
      4.300     2.300     1.700 peak   570 weight  0.10000E+01 volume  0.23056E-03 ppm1      8.502 ppm2      1.625 CV     1
 OR {  570}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 51   and name HG11))
 OR {  570}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 72   and name HG2 ))
 OR {  570}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 72   and name HG1 ))
 ASSI {  572}
   (( segid "    " and resid 71   and name HN  ))
   (  segid "    " and resid 79   and name HD2%)
      3.200     1.300     1.300 peak   572 weight  0.10000E+01 volume  0.15784E-02 ppm1      8.507 ppm2      0.861 CV     1
 OR {  572}
   (( segid "    " and resid 71   and name HN  ))
   (  segid "    " and resid 51   and name HD1%)
 ASSI {  576}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 99   and name HB2 ))
      3.600     1.600     1.600 peak   576 weight  0.10000E+01 volume  0.76864E-03 ppm1      8.509 ppm2      2.740 CV     1
 OR {  576}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 99   and name HB1 ))
 OR {  576}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 80   and name HB2 ))
 ASSI {  582}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 33   and name HB2 ))
      3.300     1.400     1.400 peak   582 weight  0.10000E+01 volume  0.50732E-03 ppm1      8.492 ppm2      3.273 CV     1
 OR {  582}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 32   and name HB1 ))
 ASSI {  585}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 34   and name HG2 ))
      3.300     1.400     1.400 peak   585 weight  0.10000E+01 volume  0.58628E-03 ppm1      8.492 ppm2      2.479 CV     1
 OR {  585}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 34   and name HG1 ))
 OR {  585}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 105  and name HB2 ))
 OR {  585}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 105  and name HB1 ))
 ASSI {  586}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 34   and name HB1 ))
      3.900     1.900     1.900 peak   586 weight  0.10000E+01 volume  0.25498E-03 ppm1      8.499 ppm2      1.720 CV     1
 OR {  586}
   (( segid "    " and resid 99   and name HN  ))
   (  segid "    " and resid 34   and name HE% )
 OR {  586}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 98   and name HE1 ))
 ASSI {  588}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 98   and name HG1 ))
      3.200     1.300     1.300 peak   588 weight  0.10000E+01 volume  0.20078E-02 ppm1      8.491 ppm2      1.008 CV     1
 OR {  588}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 98   and name HG2 ))
 OR {  588}
   (( segid "    " and resid 3    and name HN  ))
   (  segid "    " and resid 24   and name HB% )
 OR {  588}
   (( segid "    " and resid 99   and name HN  ))
   (  segid "    " and resid 106  and name HB% )
 ASSI {  604}
   (( segid "    " and resid 79   and name HN  ))
   (  segid "    " and resid 23   and name HB% )
      3.800     1.800     1.800 peak   604 weight  0.10000E+01 volume  0.27367E-03 ppm1      8.486 ppm2      1.421 CV     1
 OR {  604}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 53   and name HG1 ))
 OR {  604}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 76   and name HB2 ))
 ASSI {  620}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 22   and name HA  ))
      4.700     2.800     1.300 peak   620 weight  0.10000E+01 volume  0.14653E-03 ppm1      8.485 ppm2      5.437 CV     1
 OR {  620}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 72   and name HA  ))
 ASSI {  624}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 29   and name HZ  ))
      3.900     1.900     1.900 peak   624 weight  0.10000E+01 volume  0.38822E-03 ppm1      8.481 ppm2      7.113 CV     1
 OR {  624}
   (( segid "    " and resid 52   and name HN  ))
   (  segid "    " and resid 29   and name HE% )
 OR {  624}
   (( segid "    " and resid 79   and name HN  ))
   (  segid "    " and resid 29   and name HE% )
 OR {  624}
   (( segid "    " and resid 52   and name HN  ))
   (  segid "    " and resid 59   and name HD% )
 ASSI {  627}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 22   and name HN  ))
      3.100     1.200     1.200 peak   627 weight  0.10000E+01 volume  0.11931E-02 ppm1      8.484 ppm2      9.163 CV     1
 OR {  627}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 80   and name HN  ))
 ASSI {  636}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 13   and name HB2 ))
      3.900     1.900     1.900 peak   636 weight  0.10000E+01 volume  0.38941E-03 ppm1      8.474 ppm2      2.087 CV     1
 OR {  636}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 14   and name HG2 ))
 ASSI {  637}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 115  and name HB  ))
      3.600     1.600     1.600 peak   637 weight  0.10000E+01 volume  0.98898E-03 ppm1      8.473 ppm2      1.879 CV     1
 OR {  637}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 13   and name HB1 ))
 ASSI {  648}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 88   and name HN  ))
      5.200     3.300     0.800 peak   648 weight  0.10000E+01 volume  0.11148E-03 ppm1      8.441 ppm2      9.127 CV     1
 OR {  648}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 92   and name HN  ))
 ASSI {  651}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 89   and name HA  ))
      3.100     1.200     1.200 peak   651 weight  0.10000E+01 volume  0.13843E-02 ppm1      8.438 ppm2      4.334 CV     1
 OR {  651}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 91   and name HB  ))
 ASSI {  657}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 89   and name HB2 ))
      3.300     1.400     1.400 peak   657 weight  0.10000E+01 volume  0.97081E-03 ppm1      8.438 ppm2      1.956 CV     1
 OR {  657}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 115  and name HB  ))
 ASSI {  658}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 87   and name HB1 ))
      3.200     1.300     1.300 peak   658 weight  0.10000E+01 volume  0.10952E-02 ppm1      8.439 ppm2      1.601 CV     1
 OR {  658}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 87   and name HG2 ))
 OR {  658}
   (( segid "    " and resid 90   and name HN  ))
   (  segid "    " and resid 91   and name HG2%)
 ASSI {  659}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 86   and name HB1 ))
      5.600     3.900     0.400 peak   659 weight  0.10000E+01 volume  0.50258E-04 ppm1      8.443 ppm2      1.274 CV     1
 OR {  659}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 86   and name HG  ))
 OR {  659}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 38   and name HG2 ))
 ASSI {  660}
   (( segid "    " and resid 90   and name HN  ))
   (  segid "    " and resid 86   and name HD2%)
      3.700     1.700     1.700 peak   660 weight  0.10000E+01 volume  0.60813E-03 ppm1      8.439 ppm2      0.914 CV     1
 OR {  660}
   (( segid "    " and resid 90   and name HN  ))
   (  segid "    " and resid 48   and name HG2%)
 OR {  660}
   (( segid "    " and resid 90   and name HN  ))
   (  segid "    " and resid 11   and name HD2%)
 OR {  660}
   (( segid "    " and resid 90   and name HN  ))
   (  segid "    " and resid 83   and name HE% )
 ASSI {  662}
   (( segid "    " and resid 90   and name HN  ))
   (  segid "    " and resid 115  and name HG2%)
      4.200     2.200     1.800 peak   662 weight  0.10000E+01 volume  0.32255E-03 ppm1      8.434 ppm2      0.432 CV     1
 OR {  662}
   (( segid "    " and resid 90   and name HN  ))
   (  segid "    " and resid 86   and name HD1%)
 ASSI {  663}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 113  and name HN  ))
      3.600     1.600     1.600 peak   663 weight  0.10000E+01 volume  0.89608E-03 ppm1      8.431 ppm2      9.013 CV     1
 OR {  663}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 12   and name HN  ))
 OR {  663}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 92   and name HN  ))
 ASSI {  685}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 86   and name HN  ))
      3.300     1.300     1.300 peak   685 weight  0.10000E+01 volume  0.84521E-03 ppm1      8.432 ppm2      8.153 CV     1
 OR {  685}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 13   and name HN  ))
 ASSI {  688}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 14   and name HA  ))
      3.300     1.400     1.400 peak   688 weight  0.10000E+01 volume  0.23456E-02 ppm1      8.431 ppm2      3.892 CV     1
 OR {  688}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 86   and name HA  ))
 ASSI {  692}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 13   and name HB2 ))
      4.800     2.900     1.200 peak   692 weight  0.10000E+01 volume  0.13127E-03 ppm1      8.434 ppm2      2.073 CV     1
 OR {  692}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 14   and name HG2 ))
 ASSI {  693}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 12   and name HB  ))
      3.800     1.800     1.800 peak   693 weight  0.10000E+01 volume  0.49131E-03 ppm1      8.432 ppm2      1.857 CV     1
 OR {  693}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 14   and name HB2 ))
 OR {  693}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 115  and name HB  ))
 ASSI {  696}
   (( segid "    " and resid 16   and name HN  ))
   (  segid "    " and resid 12   and name HG2%)
      3.100     1.200     1.200 peak   696 weight  0.10000E+01 volume  0.14294E-02 ppm1      8.429 ppm2      0.834 CV     1
 OR {  696}
   (( segid "    " and resid 16   and name HN  ))
   (  segid "    " and resid 12   and name HG1%)
 OR {  696}
   (( segid "    " and resid 16   and name HN  ))
   (  segid "    " and resid 86   and name HD2%)
 ASSI {  697}
   (( segid "    " and resid 16   and name HN  ))
   (  segid "    " and resid 86   and name HD1%)
      3.400     1.400     1.400 peak   697 weight  0.10000E+01 volume  0.11550E-02 ppm1      8.426 ppm2      0.471 CV     1
 OR {  697}
   (( segid "    " and resid 16   and name HN  ))
   (  segid "    " and resid 115  and name HG2%)
 ASSI {  698}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 92   and name HN  ))
      4.500     2.500     1.500 peak   698 weight  0.10000E+01 volume  0.29972E-03 ppm1      8.402 ppm2      9.081 CV     1
 OR {  698}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 12   and name HN  ))
 ASSI {  712}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 58   and name HN  ))
      3.900     1.900     1.900 peak   712 weight  0.10000E+01 volume  0.72104E-03 ppm1      8.398 ppm2      7.807 CV     1
 OR {  712}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 55   and name HN  ))
 ASSI {  719}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 55   and name HB2 ))
      3.100     1.200     1.200 peak   719 weight  0.10000E+01 volume  0.86683E-03 ppm1      8.397 ppm2      2.731 CV     1
 OR {  719}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 52   and name HB2 ))
 ASSI {  728}
   (( segid "    " and resid 23   and name HN  ))
   (  segid "    " and resid 24   and name HB% )
      5.000     3.100     1.000 peak   728 weight  0.10000E+01 volume  0.12147E-03 ppm1      8.312 ppm2      1.059 CV     1
 OR {  728}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 79   and name HB2 ))
 ASSI {  729}
   (( segid "    " and resid 23   and name HN  ))
   (  segid "    " and resid 6    and name HB% )
      3.600     1.600     1.600 peak   729 weight  0.10000E+01 volume  0.32328E-03 ppm1      8.312 ppm2      1.762 CV     1
 OR {  729}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 79   and name HB1 ))
 ASSI {  737}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 5    and name HE21))
      5.100     3.200     0.900 peak   737 weight  0.10000E+01 volume  0.13664E-03 ppm1      8.300 ppm2      6.881 CV     1
 OR {  737}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 36   and name HZ2 ))
 OR {  737}
   (( segid "    " and resid 23   and name HN  ))
   (  segid "    " and resid 80   and name HD% )
 ASSI {  747}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 24   and name HA  ))
      4.000     2.000     2.000 peak   747 weight  0.10000E+01 volume  0.37262E-03 ppm1      8.277 ppm2      5.078 CV     1
 OR {  747}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 107  and name HA  ))
 ASSI {  763}
   (( segid "    " and resid 59   and name HN  ))
   (  segid "    " and resid 70   and name HG2%)
      3.300     1.300     1.300 peak   763 weight  0.10000E+01 volume  0.10543E-02 ppm1      8.275 ppm2      1.036 CV     1
 OR {  763}
   (( segid "    " and resid 59   and name HN  ))
   (  segid "    " and resid 70   and name HD1%)
 OR {  763}
   (( segid "    " and resid 59   and name HN  ))
   (  segid "    " and resid 51   and name HG2%)
 OR {  763}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 51   and name HG12))
 ASSI {  776}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 50   and name HN  ))
      3.200     1.300     1.300 peak   776 weight  0.10000E+01 volume  0.11109E-02 ppm1      8.275 ppm2      8.855 CV     1
 OR {  776}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 60   and name HN  ))
 ASSI {  804}
   (( segid "    " and resid 63   and name HN  ))
   (  segid "    " and resid 61   and name HB% )
      4.200     2.200     1.800 peak   804 weight  0.10000E+01 volume  0.23834E-03 ppm1      8.177 ppm2      1.411 CV     1
 OR {  804}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 65   and name HG2 ))
 OR {  804}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 65   and name HG1 ))
 ASSI {  808}
   (( segid "    " and resid 20   and name HN  ))
   (  segid "    " and resid 81   and name HD2%)
      3.000     1.100     1.100 peak   808 weight  0.10000E+01 volume  0.30594E-02 ppm1      8.167 ppm2      0.665 CV     1
 OR {  808}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 81   and name HB2 ))
 OR {  808}
   (( segid "    " and resid 20   and name HN  ))
   (  segid "    " and resid 18   and name HD2%)
 ASSI {  813}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 82   and name HB2 ))
      3.900     1.900     1.900 peak   813 weight  0.10000E+01 volume  0.78087E-03 ppm1      8.165 ppm2      1.948 CV     1
 OR {  813}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 82   and name HB1 ))
 OR {  813}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 115  and name HB  ))
 ASSI {  816}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 19   and name HD1 ))
      3.200     1.300     1.300 peak   816 weight  0.10000E+01 volume  0.58109E-03 ppm1      8.167 ppm2      2.858 CV     1
 OR {  816}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 19   and name HD2 ))
 OR {  816}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 94   and name HB2 ))
 ASSI {  824}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 85   and name HN  ))
      2.400     0.700     0.700 peak   824 weight  0.10000E+01 volume  0.47333E-02 ppm1      8.168 ppm2      8.476 CV     1
 OR {  824}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 16   and name HN  ))
 OR {  824}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 81   and name HN  ))
 ASSI {  825}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 21   and name HN  ))
      3.300     1.300     1.300 peak   825 weight  0.10000E+01 volume  0.18409E-02 ppm1      8.168 ppm2      8.838 CV     1
 OR {  825}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 83   and name HN  ))
 OR {  825}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 82   and name HN  ))
 ASSI {  835}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 16   and name HA1 ))
      4.000     2.000     2.000 peak   835 weight  0.10000E+01 volume  0.64442E-03 ppm1      8.165 ppm2      3.723 CV     1
 OR {  835}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 116  and name HB1 ))
 ASSI {  838}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 116  and name HN  ))
      3.200     1.300     1.300 peak   838 weight  0.10000E+01 volume  0.11387E-02 ppm1      8.164 ppm2      8.424 CV     1
 OR {  838}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 16   and name HN  ))
 ASSI {  844}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 21   and name HA  ))
      4.600     2.600     1.400 peak   844 weight  0.10000E+01 volume  0.16382E-03 ppm1      8.166 ppm2      5.755 CV     1
 OR {  844}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 80   and name HA  ))
 ASSI {  845}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 82   and name HA  ))
      3.100     1.200     1.200 peak   845 weight  0.10000E+01 volume  0.18709E-02 ppm1      8.166 ppm2      4.218 CV     1
 OR {  845}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 18   and name HA  ))
 ASSI {  849}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 83   and name HN  ))
      4.600     2.600     1.400 peak   849 weight  0.10000E+01 volume  0.19667E-03 ppm1      8.152 ppm2      8.829 CV     1
 OR {  849}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 21   and name HN  ))
 OR {  849}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 82   and name HN  ))
 ASSI {  865}
   (( segid "    " and resid 9    and name HN  ))
   (  segid "    " and resid 18   and name HD1%)
      4.200     2.200     1.800 peak   865 weight  0.10000E+01 volume  0.28553E-03 ppm1      8.132 ppm2      0.801 CV     1
 OR {  865}
   (( segid "    " and resid 9    and name HN  ))
   (  segid "    " and resid 11   and name HD1%)
 ASSI {  868}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 20   and name HB  ))
      3.900     1.900     1.900 peak   868 weight  0.10000E+01 volume  0.49288E-03 ppm1      8.139 ppm2      2.040 CV     1
 OR {  868}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 112  and name HB1 ))
 OR {  868}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 112  and name HB2 ))
 ASSI {  909}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 57   and name HN  ))
      3.400     1.500     1.500 peak   909 weight  0.10000E+01 volume  0.66962E-03 ppm1      8.036 ppm2      8.366 CV     1
 OR {  909}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 54   and name HN  ))
 ASSI {  914}
   (( segid "    " and resid 34   and name HN  ))
   (  segid "    " and resid 51   and name HG2%)
      2.900     1.000     1.000 peak   914 weight  0.10000E+01 volume  0.15983E-02 ppm1      8.035 ppm2      0.955 CV     1
 OR {  914}
   (( segid "    " and resid 34   and name HN  ))
   (  segid "    " and resid 79   and name HD2%)
 ASSI {  915}
   (( segid "    " and resid 34   and name HN  ))
   (  segid "    " and resid 50   and name HG2%)
      3.500     1.500     1.500 peak   915 weight  0.10000E+01 volume  0.10748E-02 ppm1      8.034 ppm2      1.183 CV     1
 OR {  915}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 51   and name HG12))
 OR {  915}
   (( segid "    " and resid 34   and name HN  ))
   (  segid "    " and resid 70   and name HD1%)
 OR {  915}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 70   and name HG11))
 ASSI {  919}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 32   and name HB2 ))
      3.500     1.500     1.500 peak   919 weight  0.10000E+01 volume  0.95858E-03 ppm1      8.033 ppm2      2.697 CV     1
 OR {  919}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 52   and name HB2 ))
 OR {  919}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 99   and name HB2 ))
 ASSI {  921}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 53   and name HD2 ))
      3.900     1.900     1.900 peak   921 weight  0.10000E+01 volume  0.48212E-03 ppm1      8.033 ppm2      3.084 CV     1
 OR {  921}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 52   and name HB1 ))
 OR {  921}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 72   and name HD1 ))
 ASSI {  940}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 39   and name HG1 ))
      3.600     1.700     1.700 peak   940 weight  0.10000E+01 volume  0.40832E-03 ppm1      7.938 ppm2      2.234 CV     1
 OR {  940}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 39   and name HB1 ))
 OR {  940}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 41   and name HB1 ))
 ASSI {  943}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 106  and name HA  ))
      2.400     0.700     0.700 peak   943 weight  0.10000E+01 volume  0.51633E-02 ppm1      7.942 ppm2      4.160 CV     1
 OR {  943}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 42   and name HA2 ))
 ASSI {  946}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 39   and name HE21))
      4.200     2.200     1.800 peak   946 weight  0.10000E+01 volume  0.24303E-03 ppm1      7.939 ppm2      6.756 CV     1
 OR {  946}
   (( segid "    " and resid 107  and name HN  ))
   (  segid "    " and resid 95   and name HE% )
 ASSI {  952}
   (( segid "    " and resid 108  and name HN  ))
   (  segid "    " and resid 95   and name HD% )
      4.000     2.000     2.000 peak   952 weight  0.10000E+01 volume  0.38997E-03 ppm1      7.936 ppm2      6.917 CV     1
 OR {  952}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 107  and name HD1 ))
 ASSI {  957}
   (( segid "    " and resid 108  and name HN  ))
   (  segid "    " and resid 106  and name HB% )
      4.600     2.600     1.400 peak   957 weight  0.10000E+01 volume  0.50346E-04 ppm1      7.934 ppm2      0.965 CV     1
 OR {  957}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 98   and name HG2 ))
 OR {  957}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 98   and name HG1 ))
 ASSI {  960}
   (( segid "    " and resid 36   and name HE1 ))
   (  segid "    " and resid 81   and name HD1%)
      4.200     2.200     1.800 peak   960 weight  0.10000E+01 volume  0.33938E-03 ppm1      7.902 ppm2      0.147 CV     1
 OR {  960}
   (( segid "    " and resid 48   and name HN  ))
   (  segid "    " and resid 64   and name HG2%)
 ASSI {  966}
   (( segid "    " and resid 48   and name HN  ))
   (  segid "    " and resid 35   and name HB% )
      3.700     1.700     1.700 peak   966 weight  0.10000E+01 volume  0.71731E-03 ppm1      7.923 ppm2      1.432 CV     1
 OR {  966}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 38   and name HG1 ))
 ASSI {  967}
   (( segid "    " and resid 36   and name HE1 ))
   (( segid "    " and resid 79   and name HB1 ))
      2.800     1.000     1.000 peak   967 weight  0.10000E+01 volume  0.38486E-02 ppm1      7.898 ppm2      1.762 CV     1
 OR {  967}
   (( segid "    " and resid 36   and name HE1 ))
   (( segid "    " and resid 79   and name HG  ))
 OR {  967}
   (( segid "    " and resid 36   and name HE1 ))
   (( segid "    " and resid 96   and name HB1 ))
 ASSI {  969}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 46   and name HG1 ))
      3.500     1.500     1.500 peak   969 weight  0.10000E+01 volume  0.11620E-02 ppm1      7.899 ppm2      2.212 CV     1
 OR {  969}
   (( segid "    " and resid 36   and name HE1 ))
   (( segid "    " and resid 70   and name HG12))
 OR {  969}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 46   and name HG2 ))
 ASSI {  974}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 49   and name HB1 ))
      5.700     4.000     0.300 peak   974 weight  0.10000E+01 volume  0.14748E-03 ppm1      7.901 ppm2      3.504 CV     1
 OR {  974}
   (( segid "    " and resid 36   and name HE1 ))
   (( segid "    " and resid 49   and name HB1 ))
 ASSI {  978}
   (( segid "    " and resid 36   and name HE1 ))
   (( segid "    " and resid 80   and name HA  ))
      4.100     2.100     1.900 peak   978 weight  0.10000E+01 volume  0.33524E-03 ppm1      7.897 ppm2      5.674 CV     1
 OR {  978}
   (( segid "    " and resid 36   and name HE1 ))
   (( segid "    " and resid 35   and name HA  ))
 OR {  978}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 35   and name HA  ))
 ASSI {  979}
   (( segid "    " and resid 36   and name HE1 ))
   (( segid "    " and resid 70   and name HA  ))
      4.200     2.200     1.800 peak   979 weight  0.10000E+01 volume  0.37219E-03 ppm1      7.894 ppm2      5.370 CV     1
 OR {  979}
   (( segid "    " and resid 36   and name HE1 ))
   (( segid "    " and resid 72   and name HA  ))
 OR {  979}
   (( segid "    " and resid 36   and name HE1 ))
   (( segid "    " and resid 22   and name HA  ))
 ASSI {  983}
   (( segid "    " and resid 36   and name HE1 ))
   (( segid "    " and resid 81   and name HN  ))
      3.900     1.900     1.900 peak   983 weight  0.10000E+01 volume  0.47352E-03 ppm1      7.898 ppm2      8.513 CV     1
 OR {  983}
   (( segid "    " and resid 36   and name HE1 ))
   (( segid "    " and resid 71   and name HN  ))
 OR {  983}
   (( segid "    " and resid 36   and name HE1 ))
   (( segid "    " and resid 79   and name HN  ))
 OR {  983}
   (( segid "    " and resid 36   and name HE1 ))
   (( segid "    " and resid 97   and name HN  ))
 ASSI {  984}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 50   and name HN  ))
      5.100     3.200     0.900 peak   984 weight  0.10000E+01 volume  0.17377E-03 ppm1      7.903 ppm2      8.858 CV     1
 OR {  984}
   (( segid "    " and resid 36   and name HE1 ))
   (( segid "    " and resid 82   and name HN  ))
 OR {  984}
   (( segid "    " and resid 36   and name HE1 ))
   (( segid "    " and resid 96   and name HN  ))
 OR {  984}
   (( segid "    " and resid 36   and name HE1 ))
   (( segid "    " and resid 50   and name HN  ))
 OR {  984}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 60   and name HN  ))
 ASSI {  985}
   (( segid "    " and resid 36   and name HE1 ))
   (( segid "    " and resid 80   and name HN  ))
      3.800     1.800     1.800 peak   985 weight  0.10000E+01 volume  0.51109E-03 ppm1      7.899 ppm2      9.230 CV     1
 OR {  985}
   (( segid "    " and resid 36   and name HE1 ))
   (( segid "    " and resid 22   and name HN  ))
 OR {  985}
   (( segid "    " and resid 36   and name HE1 ))
   (( segid "    " and resid 35   and name HN  ))
 ASSI {  986}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 38   and name HN  ))
      4.000     2.000     2.000 peak   986 weight  0.10000E+01 volume  0.42597E-03 ppm1      7.918 ppm2      9.423 CV     1
 OR {  986}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 37   and name HN  ))
 OR {  986}
   (( segid "    " and resid 36   and name HE1 ))
   (( segid "    " and resid 37   and name HN  ))
 OR {  986}
   (( segid "    " and resid 36   and name HE1 ))
   (( segid "    " and resid 51   and name HN  ))
 ASSI {  990}
   (( segid "    " and resid 52   and name HD21))
   (( segid "    " and resid 54   and name HA1 ))
      3.900     1.900     1.900 peak   990 weight  0.10000E+01 volume  0.41871E-03 ppm1      7.858 ppm2      3.891 CV     1
 OR {  990}
   (( segid "    " and resid 52   and name HD21))
   (( segid "    " and resid 56   and name HA2 ))
 OR {  990}
   (( segid "    " and resid 52   and name HD21))
   (( segid "    " and resid 54   and name HA2 ))
 ASSI {  996}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 18   and name HB2 ))
      3.900     1.900     1.900 peak   996 weight  0.10000E+01 volume  0.45769E-03 ppm1      7.851 ppm2      1.278 CV     1
 OR {  996}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 18   and name HB1 ))
 OR {  996}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 18   and name HG  ))
 OR {  996}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 86   and name HG  ))
 OR {  996}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 86   and name HB1 ))
 ASSI { 1004}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 86   and name HN  ))
      3.500     1.500     1.500 peak  1004 weight  0.10000E+01 volume  0.91079E-03 ppm1      7.853 ppm2      8.133 CV     1
 OR { 1004}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 19   and name HN  ))
 ASSI { 1008}
   (( segid "    " and resid 91   and name HN  ))
   (  segid "    " and resid 92   and name HB% )
      4.100     2.100     1.900 peak  1008 weight  0.10000E+01 volume  0.43954E-03 ppm1      7.799 ppm2      1.116 CV     1
 OR { 1008}
   (( segid "    " and resid 91   and name HN  ))
   (  segid "    " and resid 114  and name HG2%)
 ASSI { 1010}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 115  and name HB  ))
      3.500     1.500     1.500 peak  1010 weight  0.10000E+01 volume  0.56637E-03 ppm1      7.800 ppm2      1.914 CV     1
 OR { 1010}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 53   and name HB2 ))
 ASSI { 1015}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 53   and name HA  ))
      3.300     1.400     1.400 peak  1015 weight  0.10000E+01 volume  0.10306E-02 ppm1      7.800 ppm2      4.144 CV     1
 OR { 1015}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 88   and name HA  ))
 ASSI { 1017}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 90   and name HN  ))
      2.600     0.800     0.800 peak  1017 weight  0.10000E+01 volume  0.34108E-02 ppm1      7.800 ppm2      8.426 CV     1
 OR { 1017}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 54   and name HN  ))
 OR { 1017}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 57   and name HN  ))
 ASSI { 1036}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 39   and name HB1 ))
      3.300     1.300     1.300 peak  1036 weight  0.10000E+01 volume  0.10174E-02 ppm1      7.767 ppm2      2.292 CV     1
 OR { 1036}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 112  and name HG2 ))
 ASSI { 1041}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 112  and name HE21))
      4.300     2.300     1.700 peak  1041 weight  0.10000E+01 volume  0.21404E-03 ppm1      7.771 ppm2      6.692 CV     1
 OR { 1041}
   (( segid "    " and resid 93   and name HN  ))
   (  segid "    " and resid 94   and name HE% )
 ASSI { 1042}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 92   and name HN  ))
      3.600     1.600     1.600 peak  1042 weight  0.10000E+01 volume  0.94294E-03 ppm1      7.764 ppm2      9.084 CV     1
 OR { 1042}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 94   and name HN  ))
 ASSI { 1045}
   (( segid "    " and resid 106  and name HN  ))
   (  segid "    " and resid 104  and name HD1%)
      3.100     1.200     1.200 peak  1045 weight  0.10000E+01 volume  0.13777E-02 ppm1      7.765 ppm2      0.602 CV     1
 OR { 1045}
   (( segid "    " and resid 106  and name HN  ))
   (  segid "    " and resid 4    and name HD1%)
 OR { 1045}
   (( segid "    " and resid 106  and name HN  ))
   (  segid "    " and resid 4    and name HD2%)
 OR { 1045}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 98   and name HD1 ))
 ASSI { 1060}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 83   and name HN  ))
      4.200     2.200     1.800 peak  1060 weight  0.10000E+01 volume  0.38944E-03 ppm1      7.755 ppm2      8.860 CV     1
 OR { 1060}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 69   and name HN  ))
 ASSI { 1062}
   (( segid "    " and resid 84   and name HN  ))
   (  segid "    " and resid 64   and name HG2%)
      3.900     1.900     1.900 peak  1062 weight  0.10000E+01 volume  0.13655E-03 ppm1      7.755 ppm2      0.158 CV     1
 OR { 1062}
   (( segid "    " and resid 84   and name HN  ))
   (  segid "    " and resid 81   and name HD1%)
 OR { 1062}
   (( segid "    " and resid 91   and name HN  ))
   (  segid "    " and resid 81   and name HD1%)
 ASSI { 1090}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 102  and name HA1 ))
      3.800     1.800     1.800 peak  1090 weight  0.10000E+01 volume  0.74090E-03 ppm1      7.661 ppm2      3.859 CV     1
 OR { 1090}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 101  and name HA1 ))
 ASSI { 1097}
   (( segid "    " and resid 39   and name HE22))
   (( segid "    " and resid 45   and name HA  ))
      4.200     2.200     1.800 peak  1097 weight  0.10000E+01 volume  0.77052E-03 ppm1      7.653 ppm2      4.252 CV     1
 OR { 1097}
   (( segid "    " and resid 39   and name HE22))
   (( segid "    " and resid 44   and name HA1 ))
 ASSI { 1103}
   (( segid "    " and resid 61   and name HN  ))
   (  segid "    " and resid 60   and name HD% )
      3.500     1.500     1.500 peak  1103 weight  0.10000E+01 volume  0.15150E-02 ppm1      7.632 ppm2      7.016 CV     1
 OR { 1103}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 47   and name HZ2 ))
 ASSI { 1104}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 47   and name HH2 ))
      3.400     1.500     1.500 peak  1104 weight  0.10000E+01 volume  0.11866E-02 ppm1      7.631 ppm2      6.826 CV     1
 OR { 1104}
   (( segid "    " and resid 61   and name HN  ))
   (  segid "    " and resid 60   and name HE% )
 ASSI { 1112}
   (( segid "    " and resid 61   and name HN  ))
   (  segid "    " and resid 48   and name HG2%)
      4.200     2.200     1.800 peak  1112 weight  0.10000E+01 volume  0.26399E-03 ppm1      7.635 ppm2      1.034 CV     1
 OR { 1112}
   (( segid "    " and resid 61   and name HN  ))
   (  segid "    " and resid 48   and name HG2%)
 OR { 1112}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 64   and name HB  ))
 ASSI { 1122}
   (( segid "    " and resid 32   and name HN  ))
   (  segid "    " and resid 34   and name HE% )
      3.600     1.700     1.700 peak  1122 weight  0.10000E+01 volume  0.76767E-03 ppm1      7.533 ppm2      1.861 CV     1
 OR { 1122}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 53   and name HB1 ))
 OR { 1122}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 53   and name HB2 ))
 ASSI { 1126}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 29   and name HB2 ))
      5.700     4.100     0.300 peak  1126 weight  0.10000E+01 volume  0.79025E-04 ppm1      7.537 ppm2      3.049 CV     1
 OR { 1126}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 27   and name HB2 ))
 ASSI { 1141}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 76   and name HB2 ))
      3.700     1.700     1.700 peak  1141 weight  0.10000E+01 volume  0.43339E-03 ppm1      7.493 ppm2      1.461 CV     1
 OR { 1141}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 76   and name HG2 ))
 OR { 1141}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 76   and name HG1 ))
 OR { 1141}
   (( segid "    " and resid 78   and name HN  ))
   (  segid "    " and resid 23   and name HB% )
 ASSI { 1142}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 77   and name HB2 ))
      4.600     2.700     1.400 peak  1142 weight  0.10000E+01 volume  0.17816E-03 ppm1      7.494 ppm2      2.658 CV     1
 OR { 1142}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 73   and name HB1 ))
 ASSI { 1143}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 73   and name HB2 ))
      3.800     1.800     1.800 peak  1143 weight  0.10000E+01 volume  0.43091E-03 ppm1      7.493 ppm2      3.065 CV     1
 OR { 1143}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 76   and name HE1 ))
 ASSI { 1160}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 73   and name HB1 ))
      4.100     2.100     1.900 peak  1160 weight  0.10000E+01 volume  0.21974E-03 ppm1      7.450 ppm2      2.673 CV     1
 OR { 1160}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 77   and name HB2 ))
 ASSI { 1172}
   (( segid "    " and resid 68   and name HN  ))
   (  segid "    " and resid 64   and name HG2%)
      4.100     2.100     1.900 peak  1172 weight  0.10000E+01 volume  0.35046E-03 ppm1      7.387 ppm2      0.161 CV     1
 OR { 1172}
   (( segid "    " and resid 68   and name HN  ))
   (  segid "    " and resid 81   and name HD1%)
 ASSI { 1174}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 64   and name HB  ))
      3.500     1.500     1.500 peak  1174 weight  0.10000E+01 volume  0.89686E-03 ppm1      7.388 ppm2      1.027 CV     1
 OR { 1174}
   (( segid "    " and resid 68   and name HN  ))
   (  segid "    " and resid 70   and name HG2%)
 OR { 1174}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 83   and name HB1 ))
 ASSI { 1180}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 65   and name HA  ))
      3.700     1.700     1.700 peak  1180 weight  0.10000E+01 volume  0.29644E-03 ppm1      7.392 ppm2      3.609 CV     1
 OR { 1180}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 66   and name HA1 ))
 OR { 1180}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 85   and name HB2 ))
 OR { 1180}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 49   and name HB1 ))
 OR { 1180}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 85   and name HA  ))
 ASSI { 1181}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 83   and name HA  ))
      4.200     2.200     1.800 peak  1181 weight  0.10000E+01 volume  0.35877E-03 ppm1      7.388 ppm2      4.060 CV     1
 OR { 1181}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 64   and name HA  ))
 OR { 1181}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 85   and name HB1 ))
 ASSI { 1184}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 67   and name HN  ))
      2.800     1.000     1.000 peak  1184 weight  0.10000E+01 volume  0.36389E-02 ppm1      7.388 ppm2      7.694 CV     1
 OR { 1184}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 84   and name HN  ))
 ASSI { 1195}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 87   and name HD1 ))
      4.300     2.300     1.700 peak  1195 weight  0.10000E+01 volume  0.14344E-03 ppm1      7.293 ppm2      1.643 CV     1
 OR { 1195}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 87   and name HD2 ))
 OR { 1195}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 67   and name HB1 ))
 ASSI { 1199}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 60   and name HB1 ))
      3.500     1.500     1.500 peak  1199 weight  0.10000E+01 volume  0.48009E-03 ppm1      7.297 ppm2      2.929 CV     1
 OR { 1199}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 68   and name HB2 ))
 ASSI { 1202}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 64   and name HA  ))
      3.400     1.500     1.500 peak  1202 weight  0.10000E+01 volume  0.78321E-03 ppm1      7.297 ppm2      4.092 CV     1
 OR { 1202}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 63   and name HA  ))
 ASSI { 1204}
   (( segid "    " and resid 65   and name HN  ))
   (  segid "    " and resid 60   and name HE% )
      4.500     2.600     1.500 peak  1204 weight  0.10000E+01 volume  0.26041E-03 ppm1      7.300 ppm2      6.685 CV     1
 OR { 1204}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 67   and name HE  ))
 ASSI { 1219}
   (( segid "    " and resid 49   and name HN  ))
   (  segid "    " and resid 64   and name HG2%)
      4.600     2.600     1.400 peak  1219 weight  0.10000E+01 volume  0.17758E-03 ppm1      7.150 ppm2      0.168 CV     1
 OR { 1219}
   (( segid "    " and resid 49   and name HN  ))
   (  segid "    " and resid 81   and name HD1%)
 ASSI { 1220}
   (( segid "    " and resid 49   and name HN  ))
   (  segid "    " and resid 37   and name HG2%)
      4.100     2.100     1.900 peak  1220 weight  0.10000E+01 volume  0.27533E-03 ppm1      7.153 ppm2      0.644 CV     1
 OR { 1220}
   (( segid "    " and resid 49   and name HN  ))
   (  segid "    " and resid 81   and name HD2%)
 OR { 1220}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 81   and name HB2 ))
 ASSI { 1223}
   (( segid "    " and resid 49   and name HN  ))
   (  segid "    " and resid 50   and name HG2%)
      5.100     3.200     0.900 peak  1223 weight  0.10000E+01 volume  0.12876E-03 ppm1      7.156 ppm2      1.232 CV     1
 OR { 1223}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 70   and name HG11))
 ASSI { 1235}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 36   and name HN  ))
      3.100     1.200     1.200 peak  1235 weight  0.10000E+01 volume  0.10273E-02 ppm1      7.151 ppm2      8.761 CV     1
 OR { 1235}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 50   and name HN  ))
 ASSI { 1240}
   (( segid "    " and resid 10   and name HN  ))
   (  segid "    " and resid 83   and name HE% )
      3.900     1.900     1.900 peak  1240 weight  0.10000E+01 volume  0.55262E-03 ppm1      7.133 ppm2      1.061 CV     1
 OR { 1240}
   (( segid "    " and resid 10   and name HN  ))
   (  segid "    " and resid 111  and name HG2%)
 OR { 1240}
   (( segid "    " and resid 10   and name HN  ))
   (  segid "    " and resid 114  and name HG2%)
 ASSI { 1241}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 112  and name HB1 ))
      4.400     2.500     1.600 peak  1241 weight  0.10000E+01 volume  0.22562E-03 ppm1      7.131 ppm2      2.048 CV     1
 OR { 1241}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 112  and name HG1 ))
 OR { 1241}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 20   and name HB  ))
 OR { 1241}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 112  and name HB2 ))
 ASSI { 1245}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 9    and name HN  ))
      3.700     1.700     1.700 peak  1245 weight  0.10000E+01 volume  0.78965E-03 ppm1      7.132 ppm2      8.101 CV     1
 OR { 1245}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 11   and name HN  ))
 ASSI { 1251}
   (( segid "    " and resid 112  and name HE22))
   (  segid "    " and resid 114  and name HG2%)
      4.300     2.300     1.700 peak  1251 weight  0.10000E+01 volume  0.23531E-03 ppm1      6.972 ppm2      1.115 CV     1
 OR { 1251}
   (( segid "    " and resid 112  and name HE22))
   (  segid "    " and resid 92   and name HB% )
 ASSI { 1252}
   (( segid "    " and resid 112  and name HE22))
   (  segid "    " and resid 91   and name HG2%)
      3.500     1.600     1.600 peak  1252 weight  0.10000E+01 volume  0.84250E-03 ppm1      6.972 ppm2      1.498 CV     1
 OR { 1252}
   (( segid "    " and resid 112  and name HE22))
   (( segid "    " and resid 11   and name HG  ))
 ASSI { 1258}
   (( segid "    " and resid 82   and name HE22))
   (( segid "    " and resid 19   and name HG1 ))
      5.500     3.800     0.500 peak  1258 weight  0.10000E+01 volume  0.49550E-04 ppm1      6.958 ppm2      1.291 CV     1
 OR { 1258}
   (( segid "    " and resid 82   and name HE22))
   (( segid "    " and resid 18   and name HB1 ))
 OR { 1258}
   (( segid "    " and resid 82   and name HE22))
   (( segid "    " and resid 18   and name HB2 ))
 OR { 1258}
   (( segid "    " and resid 82   and name HE22))
   (( segid "    " and resid 18   and name HG  ))
 ASSI { 1275}
   (( segid "    " and resid 82   and name HE21))
   (( segid "    " and resid 19   and name HG1 ))
      3.700     1.700     1.700 peak  1275 weight  0.10000E+01 volume  0.40158E-03 ppm1      6.890 ppm2      1.242 CV     1
 OR { 1275}
   (( segid "    " and resid 77   and name HD22))
   (  segid "    " and resid 28   and name HG2%)
 OR { 1275}
   (( segid "    " and resid 82   and name HE21))
   (( segid "    " and resid 18   and name HB1 ))
 OR { 1275}
   (( segid "    " and resid 82   and name HE21))
   (( segid "    " and resid 18   and name HB2 ))
 OR { 1275}
   (( segid "    " and resid 82   and name HE21))
   (( segid "    " and resid 18   and name HG  ))
 ASSI { 1296}
   (( segid "    " and resid 112  and name HE21))
   (  segid "    " and resid 114  and name HG2%)
      3.800     1.800     1.800 peak  1296 weight  0.10000E+01 volume  0.36459E-03 ppm1      6.634 ppm2      1.112 CV     1
 OR { 1296}
   (( segid "    " and resid 112  and name HE21))
   (  segid "    " and resid 92   and name HB% )
 ASSI { 1297}
   (( segid "    " and resid 112  and name HE21))
   (  segid "    " and resid 91   and name HG2%)
      3.100     1.200     1.200 peak  1297 weight  0.10000E+01 volume  0.99459E-03 ppm1      6.636 ppm2      1.494 CV     1
 OR { 1297}
   (( segid "    " and resid 112  and name HE21))
   (  segid "    " and resid 40   and name HB% )
 ASSI { 1304}
   (( segid "    " and resid 112  and name HE22))
   (( segid "    " and resid 92   and name HN  ))
      4.200     2.200     1.800 peak  1304 weight  0.10000E+01 volume  0.56283E-03 ppm1      6.972 ppm2      9.106 CV     1
 OR { 1304}
   (( segid "    " and resid 112  and name HE22))
   (( segid "    " and resid 94   and name HN  ))
 ASSI { 1305}
   (( segid "    " and resid 52   and name HD22))
   (( segid "    " and resid 54   and name HA1 ))
      3.900     1.900     1.900 peak  1305 weight  0.10000E+01 volume  0.36438E-03 ppm1      6.914 ppm2      3.907 CV     1
 OR { 1305}
   (( segid "    " and resid 52   and name HD22))
   (( segid "    " and resid 54   and name HA2 ))
 OR { 1305}
   (( segid "    " and resid 52   and name HD22))
   (( segid "    " and resid 56   and name HA2 ))
 OR { 1305}
   (( segid "    " and resid 52   and name HD22))
   (( segid "    " and resid 57   and name HB2 ))
 OR { 1305}
   (( segid "    " and resid 52   and name HD22))
   (( segid "    " and resid 57   and name HB1 ))
 ASSI { 1306}
   (( segid "    " and resid 3    and name HN  ))
   (( segid "    " and resid 4    and name HN  ))
      4.600     2.700     1.400 peak  1306 weight  0.10000E+01 volume  0.25501E-03 ppm1      8.520 ppm2      8.043 CV     1
 OR { 1306}
   (( segid "    " and resid 3    and name HN  ))
   (( segid "    " and resid 2    and name HN  ))
 ASSI { 1307}
   (( segid "    " and resid 67   and name HE  ))
   (( segid "    " and resid 64   and name HA  ))
      3.600     1.600     1.600 peak  1307 weight  0.10000E+01 volume  0.47595E-03 ppm1      6.764 ppm2      4.073 CV     1
 OR { 1307}
   (( segid "    " and resid 67   and name HE  ))
   (( segid "    " and resid 85   and name HB1 ))
 ASSI { 1320}
   (( segid "    " and resid 38   and name HE  ))
   (( segid "    " and resid 46   and name HB1 ))
      5.400     3.700     0.600 peak  1320 weight  0.10000E+01 volume  0.10367E-03 ppm1      7.252 ppm2      2.075 CV     1
 OR { 1320}
   (( segid "    " and resid 38   and name HE  ))
   (( segid "    " and resid 89   and name HB1 ))
 ASSI { 1341}
   (( segid "    " and resid 82   and name HE21))
   (( segid "    " and resid 19   and name HA  ))
      3.400     1.400     1.400 peak  1341 weight  0.10000E+01 volume  0.00000E+00 ppm1      6.891 ppm2      5.116 CV     1
 OR { 1341}
   (( segid "    " and resid 82   and name HE21))
   (( segid "    " and resid 84   and name HA  ))
 ASSI { 1342}
   (( segid "    " and resid 82   and name HE22))
   (( segid "    " and resid 19   and name HA  ))
      3.400     1.400     1.400 peak  1342 weight  0.10000E+01 volume  0.00000E+00 ppm1      6.964 ppm2      5.132 CV     1
 OR { 1342}
   (( segid "    " and resid 82   and name HE22))
   (( segid "    " and resid 84   and name HA  ))
 ASSI { 1346}
   (( segid "    " and resid 77   and name HD21))
   (( segid "    " and resid 29   and name HN  ))
      3.400     1.400     1.400 peak  1346 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.252 ppm2      8.226 CV     1
 OR { 1346}
   (( segid "    " and resid 77   and name HD21))
   (( segid "    " and resid 24   and name HN  ))
 ASSI {    1}
   (( segid "    " and resid 35   and name HA  ))
   (  segid "    " and resid 79   and name HD1%)
      4.900     3.000     1.100 peak     1 weight  0.10000E+01 volume  0.15970E-03 ppm1      5.727 ppm2      0.378 CV     1
 OR {    1}
   (( segid "    " and resid 35   and name HA  ))
   (  segid "    " and resid 104  and name HD2%)
 ASSI {   14}
   (( segid "    " and resid 24   and name HA  ))
   (  segid "    " and resid 4    and name HD2%)
      4.500     2.500     1.500 peak    14 weight  0.10000E+01 volume  0.19489E-03 ppm1      5.101 ppm2      0.684 CV     1
 OR {   14}
   (( segid "    " and resid 24   and name HA  ))
   (  segid "    " and resid 78   and name HG2%)
 ASSI {   17}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 17   and name HB1 ))
      2.800     1.000     1.000 peak    17 weight  0.10000E+01 volume  0.22031E-02 ppm1      5.133 ppm2      3.692 CV     1
 OR {   17}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 17   and name HB2 ))
 OR {   17}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 85   and name HA  ))
 ASSI {   24}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 23   and name HN  ))
      3.900     1.900     1.900 peak    24 weight  0.10000E+01 volume  0.43748E-03 ppm1      5.765 ppm2      8.307 CV     1
 OR {   24}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 5    and name HN  ))
 ASSI {   35}
   (( segid "    " and resid 34   and name HA  ))
   (  segid "    " and resid 79   and name HD1%)
      4.500     2.500     1.500 peak    35 weight  0.10000E+01 volume  0.28934E-03 ppm1      5.670 ppm2      0.418 CV     1
 OR {   35}
   (( segid "    " and resid 34   and name HA  ))
   (  segid "    " and resid 104  and name HD2%)
 ASSI {   36}
   (( segid "    " and resid 34   and name HA  ))
   (  segid "    " and resid 51   and name HG2%)
      4.100     2.100     1.900 peak    36 weight  0.10000E+01 volume  0.52204E-03 ppm1      5.674 ppm2      0.945 CV     1
 OR {   36}
   (( segid "    " and resid 34   and name HA  ))
   (  segid "    " and resid 79   and name HD2%)
 ASSI {   37}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 98   and name HB1 ))
      3.300     1.400     1.400 peak    37 weight  0.10000E+01 volume  0.82461E-03 ppm1      5.672 ppm2      1.450 CV     1
 OR {   37}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 98   and name HB2 ))
 OR {   37}
   (( segid "    " and resid 34   and name HA  ))
   (  segid "    " and resid 35   and name HB% )
 ASSI {   46}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 84   and name HN  ))
      3.600     1.600     1.600 peak    46 weight  0.10000E+01 volume  0.52061E-03 ppm1      6.010 ppm2      7.744 CV     1
 OR {   46}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 67   and name HN  ))
 ASSI {   52}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 82   and name HB1 ))
      4.500     2.500     1.500 peak    52 weight  0.10000E+01 volume  0.31489E-03 ppm1      6.008 ppm2      1.952 CV     1
 OR {   52}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 70   and name HB  ))
 OR {   52}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 82   and name HG2 ))
 OR {   52}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 82   and name HB2 ))
 ASSI {   53}
   (( segid "    " and resid 68   and name HA  ))
   (  segid "    " and resid 64   and name HG1%)
      5.400     3.600     0.600 peak    53 weight  0.10000E+01 volume  0.12550E-03 ppm1      6.009 ppm2      0.161 CV     1
 OR {   53}
   (( segid "    " and resid 68   and name HA  ))
   (  segid "    " and resid 81   and name HD2%)
 ASSI {   55}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 83   and name HB1 ))
      3.900     1.900     1.900 peak    55 weight  0.10000E+01 volume  0.78381E-03 ppm1      6.010 ppm2      0.992 CV     1
 OR {   55}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 64   and name HB  ))
 OR {   55}
   (( segid "    " and resid 68   and name HA  ))
   (  segid "    " and resid 70   and name HG2%)
 OR {   55}
   (( segid "    " and resid 68   and name HA  ))
   (  segid "    " and resid 83   and name HE% )
 ASSI {   56}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 67   and name HG1 ))
      4.700     2.800     1.300 peak    56 weight  0.10000E+01 volume  0.18392E-03 ppm1      6.013 ppm2      1.308 CV     1
 OR {   56}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 83   and name HG1 ))
 ASSI {   71}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 81   and name HN  ))
      3.700     1.700     1.700 peak    71 weight  0.10000E+01 volume  0.55745E-03 ppm1      5.830 ppm2      8.501 CV     1
 OR {   71}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 79   and name HN  ))
 ASSI {   72}
   (( segid "    " and resid 21   and name HA  ))
   (  segid "    " and resid 80   and name HD% )
      2.900     1.000     1.000 peak    72 weight  0.10000E+01 volume  0.23881E-02 ppm1      5.829 ppm2      6.952 CV     1
 OR {   72}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 36   and name HZ2 ))
 ASSI {   75}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 20   and name HA  ))
      4.900     3.000     1.100 peak    75 weight  0.10000E+01 volume  0.14257E-03 ppm1      5.828 ppm2      4.840 CV     1
 OR {   75}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 23   and name HA  ))
 ASSI {   78}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 22   and name HB2 ))
      4.400     2.400     1.600 peak    78 weight  0.10000E+01 volume  0.43797E-03 ppm1      5.829 ppm2      2.932 CV     1
 OR {   78}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 22   and name HB1 ))
 OR {   78}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 80   and name HB2 ))
 ASSI {   80}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 79   and name HB1 ))
      5.000     3.100     1.000 peak    80 weight  0.10000E+01 volume  0.15882E-03 ppm1      5.828 ppm2      1.768 CV     1
 OR {   80}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 79   and name HG  ))
 OR {   80}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 19   and name HB1 ))
 ASSI {   82}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 79   and name HB2 ))
      4.800     2.900     1.200 peak    82 weight  0.10000E+01 volume  0.13438E-03 ppm1      5.830 ppm2      1.020 CV     1
 OR {   82}
   (( segid "    " and resid 21   and name HA  ))
   (  segid "    " and resid 111  and name HG2%)
 OR {   82}
   (( segid "    " and resid 21   and name HA  ))
   (  segid "    " and resid 83   and name HE% )
 OR {   82}
   (( segid "    " and resid 21   and name HA  ))
   (  segid "    " and resid 70   and name HD1%)
 ASSI {   83}
   (( segid "    " and resid 21   and name HA  ))
   (  segid "    " and resid 78   and name HG2%)
      3.900     1.900     1.900 peak    83 weight  0.10000E+01 volume  0.50300E-03 ppm1      5.830 ppm2      0.651 CV     1
 OR {   83}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 81   and name HB1 ))
 OR {   83}
   (( segid "    " and resid 21   and name HA  ))
   (  segid "    " and resid 81   and name HD1%)
 ASSI {   86}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 22   and name HB2 ))
      5.500     3.700     0.500 peak    86 weight  0.10000E+01 volume  0.15332E-03 ppm1      5.830 ppm2      3.058 CV     1
 OR {   86}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 80   and name HB2 ))
 ASSI {   88}
   (( segid "    " and resid 38   and name HA  ))
   (  segid "    " and resid 93   and name HG2%)
      4.200     2.200     1.800 peak    88 weight  0.10000E+01 volume  0.31795E-03 ppm1      5.817 ppm2      0.332 CV     1
 OR {   88}
   (( segid "    " and resid 38   and name HA  ))
   (  segid "    " and resid 45   and name HD1%)
 ASSI {   90}
   (( segid "    " and resid 38   and name HA  ))
   (  segid "    " and resid 48   and name HG2%)
      4.100     2.100     1.900 peak    90 weight  0.10000E+01 volume  0.49490E-03 ppm1      5.821 ppm2      0.870 CV     1
 OR {   90}
   (( segid "    " and resid 38   and name HA  ))
   (  segid "    " and resid 48   and name HG2%)
 OR {   90}
   (( segid "    " and resid 38   and name HA  ))
   (  segid "    " and resid 93   and name HG1%)
 OR {   90}
   (( segid "    " and resid 38   and name HA  ))
   (  segid "    " and resid 37   and name HG1%)
 ASSI {   93}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 93   and name HB  ))
      4.800     2.900     1.200 peak    93 weight  0.10000E+01 volume  0.18430E-03 ppm1      5.813 ppm2      1.979 CV     1
 OR {   93}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 48   and name HB  ))
 ASSI {   97}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 94   and name HA  ))
      2.900     1.000     1.000 peak    97 weight  0.10000E+01 volume  0.14867E-02 ppm1      5.815 ppm2      4.884 CV     1
 OR {   97}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 39   and name HA  ))
 ASSI {  104}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 21   and name HN  ))
      4.700     2.700     1.300 peak   104 weight  0.10000E+01 volume  0.12032E-03 ppm1      5.679 ppm2      8.860 CV     1
 OR {  104}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 82   and name HN  ))
 ASSI {  113}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 79   and name HG  ))
      4.100     2.100     1.900 peak   113 weight  0.10000E+01 volume  0.14047E-03 ppm1      5.700 ppm2      1.762 CV     1
 OR {  113}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 72   and name HB2 ))
 OR {  113}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 19   and name HB1 ))
 ASSI {  115}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 81   and name HB1 ))
      4.000     2.000     2.000 peak   115 weight  0.10000E+01 volume  0.45455E-03 ppm1      5.681 ppm2      0.673 CV     1
 OR {  115}
   (( segid "    " and resid 80   and name HA  ))
   (  segid "    " and resid 78   and name HG2%)
 OR {  115}
   (( segid "    " and resid 80   and name HA  ))
   (  segid "    " and resid 81   and name HD1%)
 ASSI {  120}
   (( segid "    " and resid 17   and name HA  ))
   (  segid "    " and resid 86   and name HD2%)
      3.300     1.400     1.400 peak   120 weight  0.10000E+01 volume  0.94469E-03 ppm1      5.568 ppm2      0.889 CV     1
 OR {  120}
   (( segid "    " and resid 17   and name HA  ))
   (  segid "    " and resid 12   and name HG2%)
 OR {  120}
   (( segid "    " and resid 17   and name HA  ))
   (  segid "    " and resid 83   and name HE% )
 ASSI {  121}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 18   and name HB2 ))
      3.800     1.800     1.800 peak   121 weight  0.10000E+01 volume  0.80203E-03 ppm1      5.570 ppm2      1.283 CV     1
 OR {  121}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 86   and name HB2 ))
 OR {  121}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 18   and name HB1 ))
 OR {  121}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 86   and name HG  ))
 OR {  121}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 83   and name HG1 ))
 ASSI {  125}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 18   and name HA  ))
      4.000     2.000     2.000 peak   125 weight  0.10000E+01 volume  0.50332E-03 ppm1      5.572 ppm2      4.292 CV     1
 OR {  125}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 16   and name HA2 ))
 ASSI {  132}
   (( segid "    " and resid 36   and name HA  ))
   (  segid "    " and resid 104  and name HD2%)
      4.300     2.300     1.700 peak   132 weight  0.10000E+01 volume  0.25704E-03 ppm1      5.469 ppm2      0.407 CV     1
 OR {  132}
   (( segid "    " and resid 36   and name HA  ))
   (  segid "    " and resid 79   and name HD1%)
 ASSI {  134}
   (( segid "    " and resid 36   and name HA  ))
   (  segid "    " and resid 37   and name HG1%)
      4.000     2.000     2.000 peak   134 weight  0.10000E+01 volume  0.48000E-03 ppm1      5.484 ppm2      0.884 CV     1
 OR {  134}
   (( segid "    " and resid 36   and name HA  ))
   (  segid "    " and resid 48   and name HG2%)
 OR {  134}
   (( segid "    " and resid 36   and name HA  ))
   (  segid "    " and resid 48   and name HG2%)
 ASSI {  135}
   (( segid "    " and resid 36   and name HA  ))
   (  segid "    " and resid 70   and name HD1%)
      4.600     2.600     1.400 peak   135 weight  0.10000E+01 volume  0.23724E-03 ppm1      5.487 ppm2      1.080 CV     1
 OR {  135}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 79   and name HB2 ))
 ASSI {  136}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 38   and name HG2 ))
      5.000     3.200     1.000 peak   136 weight  0.10000E+01 volume  0.13528E-03 ppm1      5.483 ppm2      1.424 CV     1
 OR {  136}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 98   and name HB2 ))
 OR {  136}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 4    and name HB1 ))
 OR {  136}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 4    and name HB2 ))
 OR {  136}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 4    and name HG  ))
 ASSI {  153}
   (( segid "    " and resid 50   and name HA  ))
   (  segid "    " and resid 70   and name HD1%)
      3.200     1.300     1.300 peak   153 weight  0.10000E+01 volume  0.16821E-02 ppm1      5.566 ppm2      1.008 CV     1
 OR {  153}
   (( segid "    " and resid 50   and name HA  ))
   (  segid "    " and resid 51   and name HG2%)
 ASSI {  158}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 79   and name HN  ))
      4.300     2.400     1.700 peak   158 weight  0.10000E+01 volume  0.22253E-03 ppm1      5.400 ppm2      8.522 CV     1
 OR {  158}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 71   and name HN  ))
 OR {  158}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 79   and name HN  ))
 ASSI {  161}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 6    and name HA  ))
      2.600     0.800     0.800 peak   161 weight  0.10000E+01 volume  0.27225E-02 ppm1      5.386 ppm2      5.754 CV     1
 OR {  161}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 21   and name HA  ))
 ASSI {  162}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 79   and name HA  ))
      3.000     1.200     1.200 peak   162 weight  0.10000E+01 volume  0.12004E-02 ppm1      5.408 ppm2      5.002 CV     1
 OR {  162}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 73   and name HA  ))
 ASSI {  169}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 79   and name HB2 ))
      3.900     1.900     1.900 peak   169 weight  0.10000E+01 volume  0.71092E-03 ppm1      5.381 ppm2      1.059 CV     1
 OR {  169}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 79   and name HB2 ))
 OR {  169}
   (( segid "    " and resid 22   and name HA  ))
   (  segid "    " and resid 111  and name HG2%)
 OR {  169}
   (( segid "    " and resid 72   and name HA  ))
   (  segid "    " and resid 70   and name HD1%)
 OR {  169}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 51   and name HG12))
 OR {  169}
   (( segid "    " and resid 22   and name HA  ))
   (  segid "    " and resid 24   and name HB% )
 ASSI {  170}
   (( segid "    " and resid 72   and name HA  ))
   (  segid "    " and resid 79   and name HD2%)
      3.500     1.600     1.600 peak   170 weight  0.10000E+01 volume  0.90564E-03 ppm1      5.409 ppm2      0.948 CV     1
 OR {  170}
   (( segid "    " and resid 72   and name HA  ))
   (  segid "    " and resid 51   and name HG2%)
 OR {  170}
   (( segid "    " and resid 22   and name HA  ))
   (  segid "    " and resid 79   and name HD2%)
 ASSI {  171}
   (( segid "    " and resid 22   and name HA  ))
   (  segid "    " and resid 78   and name HG2%)
      4.000     2.000     2.000 peak   171 weight  0.10000E+01 volume  0.43067E-03 ppm1      5.387 ppm2      0.651 CV     1
 OR {  171}
   (( segid "    " and resid 72   and name HA  ))
   (  segid "    " and resid 78   and name HG2%)
 OR {  171}
   (( segid "    " and resid 22   and name HA  ))
   (  segid "    " and resid 4    and name HD2%)
 OR {  171}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 81   and name HB1 ))
 ASSI {  176}
   (( segid "    " and resid 70   and name HA  ))
   (  segid "    " and resid 68   and name HD% )
      4.400     2.500     1.600 peak   176 weight  0.10000E+01 volume  0.19197E-03 ppm1      5.361 ppm2      6.977 CV     1
 OR {  176}
   (( segid "    " and resid 70   and name HA  ))
   (  segid "    " and resid 68   and name HE% )
 OR {  176}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 68   and name HZ  ))
 OR {  176}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 82   and name HE21))
 ASSI {  178}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 81   and name HA  ))
      3.100     1.200     1.200 peak   178 weight  0.10000E+01 volume  0.75061E-03 ppm1      5.375 ppm2      4.628 CV     1
 OR {  178}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 71   and name HA  ))
 ASSI {  190}
   (( segid "    " and resid 51   and name HA  ))
   (  segid "    " and resid 58   and name HG2%)
      2.800     1.000     1.000 peak   190 weight  0.10000E+01 volume  0.20814E-02 ppm1      5.250 ppm2      1.252 CV     1
 OR {  190}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 70   and name HG12))
 ASSI {  194}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 58   and name HB  ))
      6.000     4.700     0.000 peak   194 weight  0.10000E+01 volume  0.33555E-04 ppm1      5.254 ppm2      3.848 CV     1
 OR {  194}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 56   and name HA2 ))
 ASSI {  198}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 114  and name HN  ))
      3.200     1.300     1.300 peak   198 weight  0.10000E+01 volume  0.88711E-03 ppm1      5.255 ppm2      8.435 CV     1
 OR {  198}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 116  and name HN  ))
 OR {  198}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 115  and name HN  ))
 ASSI {  205}
   (( segid "    " and resid 11   and name HA  ))
   (  segid "    " and resid 18   and name HD1%)
      3.800     1.800     1.800 peak   205 weight  0.10000E+01 volume  0.51238E-03 ppm1      5.255 ppm2      0.646 CV     1
 OR {  205}
   (( segid "    " and resid 11   and name HA  ))
   (  segid "    " and resid 115  and name HG1%)
 OR {  205}
   (( segid "    " and resid 11   and name HA  ))
   (  segid "    " and resid 113  and name HG2%)
 ASSI {  207}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 12   and name HA  ))
      4.500     2.500     1.500 peak   207 weight  0.10000E+01 volume  0.29269E-03 ppm1      5.256 ppm2      4.409 CV     1
 OR {  207}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 113  and name HA  ))
 ASSI {  209}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 78   and name HA  ))
      3.200     1.200     1.200 peak   209 weight  0.10000E+01 volume  0.86848E-03 ppm1      4.865 ppm2      5.075 CV     1
 OR {  209}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 24   and name HA  ))
 ASSI {  217}
   (( segid "    " and resid 96   and name HA  ))
   (  segid "    " and resid 37   and name HG2%)
      4.000     2.000     2.000 peak   217 weight  0.10000E+01 volume  0.36781E-03 ppm1      4.961 ppm2      0.621 CV     1
 OR {  217}
   (( segid "    " and resid 96   and name HA  ))
   (  segid "    " and resid 4    and name HD1%)
 ASSI {  218}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 83   and name HN  ))
      3.400     1.500     1.500 peak   218 weight  0.10000E+01 volume  0.75921E-03 ppm1      5.130 ppm2      8.840 CV     1
 OR {  218}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 82   and name HN  ))
 OR {  218}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 21   and name HN  ))
 ASSI {  225}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 81   and name HB1 ))
      5.100     3.200     0.900 peak   225 weight  0.10000E+01 volume  0.10747E-03 ppm1      5.142 ppm2      0.656 CV     1
 OR {  225}
   (( segid "    " and resid 19   and name HA  ))
   (  segid "    " and resid 18   and name HD1%)
 OR {  225}
   (( segid "    " and resid 19   and name HA  ))
   (  segid "    " and resid 81   and name HD1%)
 ASSI {  227}
   (( segid "    " and resid 19   and name HA  ))
   (  segid "    " and resid 20   and name HG2%)
      4.100     2.100     1.900 peak   227 weight  0.10000E+01 volume  0.50580E-03 ppm1      5.135 ppm2     -0.078 CV     1
 OR {  227}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 83   and name HG2 ))
 ASSI {  237}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 4    and name HN  ))
      4.200     2.200     1.800 peak   237 weight  0.10000E+01 volume  0.23123E-03 ppm1      5.042 ppm2      8.128 CV     1
 OR {  237}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 98   and name HN  ))
 OR {  237}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 109  and name HN  ))
 ASSI {  247}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 38   and name HG2 ))
      4.400     2.500     1.600 peak   247 weight  0.10000E+01 volume  0.28413E-03 ppm1      5.100 ppm2      1.417 CV     1
 OR {  247}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 45   and name HB2 ))
 ASSI {  258}
   (( segid "    " and resid 58   and name HA  ))
   (  segid "    " and resid 70   and name HG2%)
      3.100     1.200     1.200 peak   258 weight  0.10000E+01 volume  0.12964E-02 ppm1      5.141 ppm2      1.035 CV     1
 OR {  258}
   (( segid "    " and resid 58   and name HA  ))
   (  segid "    " and resid 70   and name HD1%)
 OR {  258}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 51   and name HG12))
 OR {  258}
   (( segid "    " and resid 58   and name HA  ))
   (  segid "    " and resid 51   and name HG2%)
 ASSI {  262}
   (( segid "    " and resid 69   and name HA  ))
   (  segid "    " and resid 60   and name HE% )
      3.400     1.500     1.500 peak   262 weight  0.10000E+01 volume  0.82038E-03 ppm1      5.188 ppm2      6.752 CV     1
 OR {  262}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 84   and name HD22))
 ASSI {  263}
   (( segid "    " and resid 69   and name HA  ))
   (  segid "    " and resid 68   and name HD% )
      3.900     1.900     1.900 peak   263 weight  0.10000E+01 volume  0.58146E-03 ppm1      5.191 ppm2      6.959 CV     1
 OR {  263}
   (( segid "    " and resid 69   and name HA  ))
   (  segid "    " and resid 60   and name HD% )
 OR {  263}
   (( segid "    " and resid 69   and name HA  ))
   (  segid "    " and resid 68   and name HE% )
 OR {  263}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 36   and name HD1 ))
 ASSI {  265}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 70   and name HB  ))
      5.000     3.200     1.000 peak   265 weight  0.10000E+01 volume  0.17981E-03 ppm1      5.191 ppm2      1.987 CV     1
 OR {  265}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 82   and name HB1 ))
 ASSI {  270}
   (( segid "    " and resid 78   and name HA  ))
   (( segid "    " and resid 24   and name HN  ))
      4.200     2.200     1.800 peak   270 weight  0.10000E+01 volume  0.23539E-03 ppm1      5.093 ppm2      8.254 CV     1
 OR {  270}
   (( segid "    " and resid 78   and name HA  ))
   (( segid "    " and resid 23   and name HN  ))
 ASSI {  286}
   (( segid "    " and resid 20   and name HA  ))
   (  segid "    " and resid 113  and name HG1%)
      4.400     2.400     1.600 peak   286 weight  0.10000E+01 volume  0.37564E-03 ppm1      4.878 ppm2      0.529 CV     1
 OR {  286}
   (( segid "    " and resid 111  and name HA  ))
   (  segid "    " and resid 113  and name HG1%)
 ASSI {  289}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 14   and name HD1 ))
      4.400     2.500     1.600 peak   289 weight  0.10000E+01 volume  0.29002E-03 ppm1      4.848 ppm2      3.525 CV     1
 OR {  289}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 116  and name HB2 ))
 OR {  289}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 14   and name HD2 ))
 ASSI {  290}
   (( segid "    " and resid 115  and name HA  ))
   (  segid "    " and resid 11   and name HD2%)
      2.600     0.900     0.900 peak   290 weight  0.10000E+01 volume  0.27087E-02 ppm1      4.829 ppm2      0.794 CV     1
 OR {  290}
   (( segid "    " and resid 115  and name HA  ))
   (  segid "    " and resid 11   and name HD1%)
 OR {  290}
   (( segid "    " and resid 115  and name HA  ))
   (  segid "    " and resid 12   and name HG2%)
 ASSI {  294}
   (( segid "    " and resid 5    and name HA  ))
   (( segid "    " and resid 109  and name HN  ))
      3.700     1.700     1.700 peak   294 weight  0.10000E+01 volume  0.36348E-03 ppm1      4.869 ppm2      8.095 CV     1
 OR {  294}
   (( segid "    " and resid 5    and name HA  ))
   (( segid "    " and resid 4    and name HN  ))
 ASSI {  332}
   (( segid "    " and resid 112  and name HA  ))
   (  segid "    " and resid 93   and name HG1%)
      3.100     1.200     1.200 peak   332 weight  0.10000E+01 volume  0.16207E-02 ppm1      4.467 ppm2      0.959 CV     1
 OR {  332}
   (( segid "    " and resid 112  and name HA  ))
   (  segid "    " and resid 111  and name HG2%)
 ASSI {  337}
   (( segid "    " and resid 91   and name HB  ))
   (( segid "    " and resid 115  and name HN  ))
      4.300     2.300     1.700 peak   337 weight  0.10000E+01 volume  0.41974E-03 ppm1      4.369 ppm2      8.430 CV     1
 OR {  337}
   (( segid "    " and resid 91   and name HB  ))
   (( segid "    " and resid 90   and name HN  ))
 ASSI {  349}
   (( segid "    " and resid 91   and name HA  ))
   (  segid "    " and resid 114  and name HG2%)
      4.100     2.100     1.900 peak   349 weight  0.10000E+01 volume  0.29103E-03 ppm1      4.476 ppm2      1.079 CV     1
 OR {  349}
   (( segid "    " and resid 91   and name HA  ))
   (  segid "    " and resid 92   and name HB% )
 ASSI {  363}
   (( segid "    " and resid 113  and name HA  ))
   (( segid "    " and resid 9    and name HA1 ))
      4.900     3.000     1.100 peak   363 weight  0.10000E+01 volume  0.17607E-03 ppm1      4.378 ppm2      3.909 CV     1
 OR {  363}
   (( segid "    " and resid 113  and name HA  ))
   (( segid "    " and resid 114  and name HB  ))
 ASSI {  382}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 64   and name HN  ))
      4.000     2.000     2.000 peak   382 weight  0.10000E+01 volume  0.30804E-03 ppm1      4.165 ppm2      7.266 CV     1
 OR {  382}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 65   and name HN  ))
 ASSI {  415}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 20   and name HN  ))
      4.000     2.000     2.000 peak   415 weight  0.10000E+01 volume  0.44979E-03 ppm1      4.198 ppm2      8.163 CV     1
 OR {  415}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 19   and name HN  ))
 ASSI {  434}
   (( segid "    " and resid 108  and name HA1 ))
   (( segid "    " and resid 4    and name HB2 ))
      3.000     1.100     1.100 peak   434 weight  0.10000E+01 volume  0.16430E-02 ppm1      4.250 ppm2      1.452 CV     1
 OR {  434}
   (( segid "    " and resid 108  and name HA1 ))
   (( segid "    " and resid 4    and name HB1 ))
 OR {  434}
   (( segid "    " and resid 66   and name HA1 ))
   (( segid "    " and resid 67   and name HG2 ))
 ASSI {  441}
   (( segid "    " and resid 56   and name HA2 ))
   (( segid "    " and resid 51   and name HG12))
      4.300     2.300     1.700 peak   441 weight  0.10000E+01 volume  0.15900E-03 ppm1      3.865 ppm2      1.040 CV     1
 OR {  441}
   (( segid "    " and resid 56   and name HA2 ))
   (  segid "    " and resid 70   and name HG2%)
 ASSI {  451}
   (( segid "    " and resid 56   and name HA1 ))
   (( segid "    " and resid 51   and name HG12))
      4.400     2.500     1.600 peak   451 weight  0.10000E+01 volume  0.24758E-03 ppm1      4.017 ppm2      1.046 CV     1
 OR {  451}
   (( segid "    " and resid 56   and name HA1 ))
   (  segid "    " and resid 70   and name HG2%)
 ASSI {  474}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 84   and name HA  ))
      4.400     2.400     1.600 peak   474 weight  0.10000E+01 volume  0.29985E-03 ppm1      3.998 ppm2      5.124 CV     1
 OR {  474}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 19   and name HA  ))
 ASSI {  477}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 68   and name HB1 ))
      3.900     1.900     1.900 peak   477 weight  0.10000E+01 volume  0.47991E-03 ppm1      3.978 ppm2      2.872 CV     1
 OR {  477}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 68   and name HB2 ))
 OR {  477}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 84   and name HB1 ))
 ASSI {  481}
   (( segid "    " and resid 83   and name HA  ))
   (  segid "    " and resid 81   and name HD1%)
      4.400     2.400     1.600 peak   481 weight  0.10000E+01 volume  0.23334E-03 ppm1      3.978 ppm2      0.645 CV     1
 OR {  481}
   (( segid "    " and resid 104  and name HA  ))
   (  segid "    " and resid 4    and name HD2%)
 OR {  481}
   (( segid "    " and resid 83   and name HA  ))
   (  segid "    " and resid 18   and name HD1%)
 OR {  481}
   (( segid "    " and resid 104  and name HA  ))
   (  segid "    " and resid 4    and name HD1%)
 ASSI {  499}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 29   and name HB2 ))
      4.100     2.100     1.900 peak   499 weight  0.10000E+01 volume  0.39699E-03 ppm1      4.025 ppm2      2.988 CV     1
 OR {  499}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 74   and name HB2 ))
 OR {  499}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 74   and name HB1 ))
 ASSI {  500}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 72   and name HG1 ))
      4.400     2.400     1.600 peak   500 weight  0.10000E+01 volume  0.18657E-03 ppm1      4.026 ppm2      1.669 CV     1
 OR {  500}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 72   and name HG2 ))
 OR {  500}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 34   and name HB2 ))
 OR {  500}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 51   and name HG11))
 ASSI {  503}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 67   and name HE  ))
      3.900     1.900     1.900 peak   503 weight  0.10000E+01 volume  0.38625E-03 ppm1      4.085 ppm2      6.740 CV     1
 OR {  503}
   (( segid "    " and resid 64   and name HA  ))
   (  segid "    " and resid 60   and name HE% )
 ASSI {  507}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 87   and name HD1 ))
      3.600     1.600     1.600 peak   507 weight  0.10000E+01 volume  0.34058E-03 ppm1      4.085 ppm2      1.609 CV     1
 OR {  507}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 67   and name HB1 ))
 ASSI {  512}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 90   and name HN  ))
      4.200     2.200     1.800 peak   512 weight  0.10000E+01 volume  0.18507E-03 ppm1      4.145 ppm2      8.420 CV     1
 OR {  512}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 115  and name HN  ))
 ASSI {  515}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 87   and name HB2 ))
      4.600     2.600     1.400 peak   515 weight  0.10000E+01 volume  0.21945E-03 ppm1      4.149 ppm2      2.107 CV     1
 OR {  515}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 14   and name HG2 ))
 OR {  515}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 89   and name HB2 ))
 ASSI {  530}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 65   and name HN  ))
      3.500     1.500     1.500 peak   530 weight  0.10000E+01 volume  0.64998E-03 ppm1      4.314 ppm2      7.278 CV     1
 OR {  530}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 64   and name HN  ))
 ASSI {  534}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 65   and name HG2 ))
      3.400     1.400     1.400 peak   534 weight  0.10000E+01 volume  0.78174E-03 ppm1      4.311 ppm2      1.423 CV     1
 OR {  534}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 65   and name HG1 ))
 OR {  534}
   (( segid "    " and resid 62   and name HA  ))
   (  segid "    " and resid 61   and name HB% )
 ASSI {  542}
   (( segid "    " and resid 28   and name HA  ))
   (( segid "    " and resid 77   and name HB2 ))
      4.800     2.800     1.200 peak   542 weight  0.10000E+01 volume  0.16518E-03 ppm1      4.305 ppm2      2.850 CV     1
 OR {  542}
   (( segid "    " and resid 28   and name HA  ))
   (( segid "    " and resid 29   and name HB1 ))
 ASSI {  550}
   (( segid "    " and resid 85   and name HB1 ))
   (( segid "    " and resid 67   and name HB2 ))
      5.000     3.200     1.000 peak   550 weight  0.10000E+01 volume  0.13698E-03 ppm1      4.038 ppm2      2.175 CV     1
 OR {  550}
   (( segid "    " and resid 85   and name HB1 ))
   (( segid "    " and resid 87   and name HB2 ))
 ASSI {  564}
   (( segid "    " and resid 71   and name HB2 ))
   (  segid "    " and resid 69   and name HG2%)
      4.300     2.300     1.700 peak   564 weight  0.10000E+01 volume  0.22957E-03 ppm1      3.902 ppm2      1.177 CV     1
 OR {  564}
   (( segid "    " and resid 71   and name HB1 ))
   (  segid "    " and resid 69   and name HG2%)
 OR {  564}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 70   and name HG12))
 OR {  564}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 70   and name HG12))
 ASSI {  574}
   (( segid "    " and resid 88   and name HB2 ))
   (( segid "    " and resid 90   and name HN  ))
      4.700     2.700     1.300 peak   574 weight  0.10000E+01 volume  0.21890E-03 ppm1      3.939 ppm2      8.413 CV     1
 OR {  574}
   (( segid "    " and resid 88   and name HB1 ))
   (( segid "    " and resid 90   and name HN  ))
 OR {  574}
   (( segid "    " and resid 88   and name HB1 ))
   (( segid "    " and resid 115  and name HN  ))
 ASSI {  577}
   (( segid "    " and resid 88   and name HB1 ))
   (( segid "    " and resid 14   and name HG2 ))
      3.700     1.700     1.700 peak   577 weight  0.10000E+01 volume  0.56058E-03 ppm1      3.939 ppm2      2.122 CV     1
 OR {  577}
   (( segid "    " and resid 88   and name HB2 ))
   (( segid "    " and resid 14   and name HG2 ))
 OR {  577}
   (( segid "    " and resid 88   and name HB1 ))
   (( segid "    " and resid 87   and name HB2 ))
 OR {  577}
   (( segid "    " and resid 88   and name HB1 ))
   (( segid "    " and resid 89   and name HB2 ))
 OR {  577}
   (( segid "    " and resid 88   and name HB2 ))
   (( segid "    " and resid 89   and name HB2 ))
 OR {  577}
   (( segid "    " and resid 88   and name HB2 ))
   (( segid "    " and resid 87   and name HB2 ))
 ASSI {  579}
   (( segid "    " and resid 88   and name HB1 ))
   (( segid "    " and resid 87   and name HG1 ))
      4.400     2.400     1.600 peak   579 weight  0.10000E+01 volume  0.31740E-03 ppm1      3.946 ppm2      1.537 CV     1
 OR {  579}
   (( segid "    " and resid 88   and name HB1 ))
   (( segid "    " and resid 87   and name HG2 ))
 OR {  579}
   (( segid "    " and resid 88   and name HB2 ))
   (( segid "    " and resid 87   and name HG2 ))
 OR {  579}
   (( segid "    " and resid 88   and name HB2 ))
   (( segid "    " and resid 87   and name HG1 ))
 OR {  579}
   (( segid "    " and resid 88   and name HB2 ))
   (  segid "    " and resid 91   and name HG2%)
 OR {  579}
   (( segid "    " and resid 88   and name HB1 ))
   (  segid "    " and resid 91   and name HG2%)
 ASSI {  582}
   (( segid "    " and resid 30   and name HB2 ))
   (( segid "    " and resid 74   and name HB1 ))
      3.400     1.400     1.400 peak   582 weight  0.10000E+01 volume  0.91590E-03 ppm1      3.891 ppm2      3.008 CV     1
 OR {  582}
   (( segid "    " and resid 30   and name HB1 ))
   (( segid "    " and resid 74   and name HB1 ))
 OR {  582}
   (( segid "    " and resid 30   and name HB1 ))
   (( segid "    " and resid 29   and name HB2 ))
 OR {  582}
   (( segid "    " and resid 30   and name HB2 ))
   (( segid "    " and resid 29   and name HB2 ))
 ASSI {  586}
   (( segid "    " and resid 63   and name HB2 ))
   (  segid "    " and resid 64   and name HG1%)
      3.700     1.700     1.700 peak   586 weight  0.10000E+01 volume  0.74743E-03 ppm1      3.895 ppm2      0.195 CV     1
 OR {  586}
   (( segid "    " and resid 48   and name HA  ))
   (  segid "    " and resid 64   and name HG1%)
 ASSI {  587}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 49   and name HN  ))
      3.500     1.500     1.500 peak   587 weight  0.10000E+01 volume  0.90021E-03 ppm1      3.913 ppm2      7.152 CV     1
 OR {  587}
   (( segid "    " and resid 30   and name HB1 ))
   (  segid "    " and resid 29   and name HD% )
 OR {  587}
   (( segid "    " and resid 30   and name HB2 ))
   (  segid "    " and resid 29   and name HD% )
 ASSI {  588}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 61   and name HN  ))
      3.400     1.500     1.500 peak   588 weight  0.10000E+01 volume  0.79963E-03 ppm1      3.906 ppm2      7.631 CV     1
 OR {  588}
   (( segid "    " and resid 30   and name HB1 ))
   (( segid "    " and resid 74   and name HD22))
 ASSI {  594}
   (( segid "    " and resid 25   and name HB2 ))
   (( segid "    " and resid 3    and name HG2 ))
      3.700     1.700     1.700 peak   594 weight  0.10000E+01 volume  0.20165E-03 ppm1      3.863 ppm2      2.318 CV     1
 OR {  594}
   (( segid "    " and resid 25   and name HB2 ))
   (( segid "    " and resid 3    and name HG1 ))
 OR {  594}
   (( segid "    " and resid 7    and name HB2 ))
   (( segid "    " and resid 5    and name HG2 ))
 OR {  594}
   (( segid "    " and resid 7    and name HB1 ))
   (( segid "    " and resid 5    and name HG2 ))
 OR {  594}
   (( segid "    " and resid 25   and name HB1 ))
   (( segid "    " and resid 3    and name HG2 ))
 OR {  594}
   (( segid "    " and resid 25   and name HB1 ))
   (( segid "    " and resid 3    and name HG1 ))
 OR {  594}
   (( segid "    " and resid 7    and name HB2 ))
   (( segid "    " and resid 5    and name HG1 ))
 OR {  594}
   (( segid "    " and resid 7    and name HB1 ))
   (( segid "    " and resid 5    and name HG1 ))
 OR {  594}
   (( segid "    " and resid 25   and name HB2 ))
   (( segid "    " and resid 5    and name HG1 ))
 OR {  594}
   (( segid "    " and resid 25   and name HB2 ))
   (( segid "    " and resid 5    and name HG2 ))
 OR {  594}
   (( segid "    " and resid 25   and name HB1 ))
   (( segid "    " and resid 5    and name HG1 ))
 OR {  594}
   (( segid "    " and resid 25   and name HB1 ))
   (( segid "    " and resid 5    and name HG2 ))
 OR {  594}
   (( segid "    " and resid 7    and name HB1 ))
   (( segid "    " and resid 113  and name HB  ))
 ASSI {  599}
   (( segid "    " and resid 63   and name HB1 ))
   (  segid "    " and resid 61   and name HB% )
      4.900     3.000     1.100 peak   599 weight  0.10000E+01 volume  0.37792E-04 ppm1      3.818 ppm2      1.401 CV     1
 OR {  599}
   (( segid "    " and resid 63   and name HB1 ))
   (( segid "    " and resid 65   and name HG1 ))
 ASSI {  601}
   (( segid "    " and resid 63   and name HB1 ))
   (( segid "    " and resid 64   and name HN  ))
      5.700     4.000     0.300 peak   601 weight  0.10000E+01 volume  0.38006E-04 ppm1      3.826 ppm2      7.256 CV     1
 OR {  601}
   (( segid "    " and resid 63   and name HB1 ))
   (( segid "    " and resid 65   and name HN  ))
 ASSI {  606}
   (( segid "    " and resid 114  and name HB  ))
   (( segid "    " and resid 12   and name HN  ))
      4.100     2.100     1.900 peak   606 weight  0.10000E+01 volume  0.35813E-03 ppm1      3.879 ppm2      9.007 CV     1
 OR {  606}
   (( segid "    " and resid 114  and name HB  ))
   (( segid "    " and resid 113  and name HN  ))
 ASSI {  609}
   (( segid "    " and resid 114  and name HB  ))
   (( segid "    " and resid 113  and name HA  ))
      4.500     2.500     1.500 peak   609 weight  0.10000E+01 volume  0.49453E-03 ppm1      3.879 ppm2      4.369 CV     1
 OR {  609}
   (( segid "    " and resid 114  and name HB  ))
   (( segid "    " and resid 91   and name HB  ))
 ASSI {  618}
   (( segid "    " and resid 14   and name HA  ))
   (  segid "    " and resid 12   and name HG2%)
      4.100     2.100     1.900 peak   618 weight  0.10000E+01 volume  0.39680E-03 ppm1      3.878 ppm2      0.885 CV     1
 OR {  618}
   (( segid "    " and resid 14   and name HA  ))
   (  segid "    " and resid 86   and name HD2%)
 OR {  618}
   (( segid "    " and resid 14   and name HA  ))
   (  segid "    " and resid 11   and name HD2%)
 ASSI {  624}
   (( segid "    " and resid 57   and name HB1 ))
   (( segid "    " and resid 58   and name HA  ))
      4.600     2.700     1.400 peak   624 weight  0.10000E+01 volume  0.15290E-03 ppm1      3.869 ppm2      5.116 CV     1
 OR {  624}
   (( segid "    " and resid 57   and name HB2 ))
   (( segid "    " and resid 58   and name HA  ))
 OR {  624}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 37   and name HA  ))
 ASSI {  627}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 86   and name HB2 ))
      3.700     1.700     1.700 peak   627 weight  0.10000E+01 volume  0.49021E-03 ppm1      3.867 ppm2      1.257 CV     1
 OR {  627}
   (( segid "    " and resid 57   and name HB1 ))
   (  segid "    " and resid 58   and name HG2%)
 OR {  627}
   (( segid "    " and resid 57   and name HB2 ))
   (  segid "    " and resid 58   and name HG2%)
 OR {  627}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 86   and name HG  ))
 ASSI {  635}
   (( segid "    " and resid 49   and name HB1 ))
   (  segid "    " and resid 48   and name HG2%)
      3.400     1.500     1.500 peak   635 weight  0.10000E+01 volume  0.63503E-03 ppm1      3.822 ppm2      0.858 CV     1
 OR {  635}
   (( segid "    " and resid 49   and name HB1 ))
   (  segid "    " and resid 48   and name HG2%)
 OR {  635}
   (( segid "    " and resid 49   and name HB1 ))
   (  segid "    " and resid 64   and name HG2%)
 OR {  635}
   (( segid "    " and resid 25   and name HB2 ))
   (  segid "    " and resid 2    and name HG2%)
 OR {  635}
   (( segid "    " and resid 25   and name HB1 ))
   (  segid "    " and resid 2    and name HG2%)
 OR {  635}
   (( segid "    " and resid 49   and name HB1 ))
   (  segid "    " and resid 79   and name HD2%)
 ASSI {  636}
   (( segid "    " and resid 49   and name HB1 ))
   (  segid "    " and resid 70   and name HD1%)
      2.800     1.000     1.000 peak   636 weight  0.10000E+01 volume  0.28149E-02 ppm1      3.822 ppm2      1.018 CV     1
 OR {  636}
   (( segid "    " and resid 49   and name HB1 ))
   (  segid "    " and resid 48   and name HG1%)
 OR {  636}
   (( segid "    " and resid 49   and name HB1 ))
   (  segid "    " and resid 48   and name HG1%)
 OR {  636}
   (( segid "    " and resid 49   and name HB1 ))
   (  segid "    " and resid 70   and name HG2%)
 ASSI {  637}
   (( segid "    " and resid 7    and name HB2 ))
   (  segid "    " and resid 6    and name HB% )
      3.600     1.600     1.600 peak   637 weight  0.10000E+01 volume  0.13122E-02 ppm1      3.821 ppm2      1.859 CV     1
 OR {  637}
   (( segid "    " and resid 7    and name HB1 ))
   (  segid "    " and resid 6    and name HB% )
 OR {  637}
   (( segid "    " and resid 49   and name HB1 ))
   (( segid "    " and resid 83   and name HB2 ))
 ASSI {  640}
   (( segid "    " and resid 49   and name HB1 ))
   (  segid "    " and resid 60   and name HE% )
      4.200     2.200     1.800 peak   640 weight  0.10000E+01 volume  0.23418E-03 ppm1      3.822 ppm2      6.751 CV     1
 OR {  640}
   (( segid "    " and resid 49   and name HB1 ))
   (  segid "    " and resid 94   and name HE% )
 OR {  640}
   (( segid "    " and resid 49   and name HB1 ))
   (( segid "    " and resid 36   and name HZ3 ))
 ASSI {  645}
   (( segid "    " and resid 49   and name HB2 ))
   (  segid "    " and resid 64   and name HG2%)
      2.900     1.100     1.100 peak   645 weight  0.10000E+01 volume  0.11721E-02 ppm1      3.541 ppm2      0.846 CV     1
 OR {  645}
   (( segid "    " and resid 49   and name HB2 ))
   (  segid "    " and resid 48   and name HG2%)
 OR {  645}
   (( segid "    " and resid 49   and name HB2 ))
   (  segid "    " and resid 48   and name HG2%)
 OR {  645}
   (( segid "    " and resid 49   and name HB2 ))
   (  segid "    " and resid 79   and name HD2%)
 ASSI {  646}
   (( segid "    " and resid 49   and name HB2 ))
   (  segid "    " and resid 70   and name HD1%)
      2.800     1.000     1.000 peak   646 weight  0.10000E+01 volume  0.30228E-02 ppm1      3.542 ppm2      1.025 CV     1
 OR {  646}
   (( segid "    " and resid 49   and name HB2 ))
   (  segid "    " and resid 70   and name HG2%)
 OR {  646}
   (( segid "    " and resid 49   and name HB2 ))
   (  segid "    " and resid 48   and name HG1%)
 OR {  646}
   (( segid "    " and resid 49   and name HB2 ))
   (  segid "    " and resid 48   and name HG1%)
 ASSI {  658}
   (( segid "    " and resid 21   and name HB1 ))
   (( segid "    " and resid 81   and name HN  ))
      5.000     3.200     1.000 peak   658 weight  0.10000E+01 volume  0.13741E-03 ppm1      3.784 ppm2      8.505 CV     1
 OR {  658}
   (( segid "    " and resid 21   and name HB1 ))
   (( segid "    " and resid 79   and name HN  ))
 ASSI {  668}
   (( segid "    " and resid 21   and name HB1 ))
   (  segid "    " and resid 78   and name HG2%)
      3.400     1.500     1.500 peak   668 weight  0.10000E+01 volume  0.10647E-02 ppm1      3.785 ppm2      0.651 CV     1
 OR {  668}
   (( segid "    " and resid 17   and name HB2 ))
   (  segid "    " and resid 18   and name HD1%)
 OR {  668}
   (( segid "    " and resid 21   and name HB1 ))
   (( segid "    " and resid 81   and name HB1 ))
 ASSI {  675}
   (( segid "    " and resid 50   and name HB  ))
   (( segid "    " and resid 47   and name HZ2 ))
      3.300     1.300     1.300 peak   675 weight  0.10000E+01 volume  0.11415E-02 ppm1      4.126 ppm2      7.110 CV     1
 OR {  675}
   (( segid "    " and resid 50   and name HB  ))
   (  segid "    " and resid 59   and name HD% )
 ASSI {  676}
   (( segid "    " and resid 50   and name HB  ))
   (( segid "    " and resid 47   and name HH2 ))
      4.600     2.700     1.400 peak   676 weight  0.10000E+01 volume  0.29792E-03 ppm1      4.130 ppm2      6.856 CV     1
 OR {  676}
   (( segid "    " and resid 50   and name HB  ))
   (( segid "    " and resid 47   and name HD1 ))
 OR {  676}
   (( segid "    " and resid 50   and name HB  ))
   (  segid "    " and resid 59   and name HE% )
 ASSI {  685}
   (( segid "    " and resid 58   and name HB  ))
   (  segid "    " and resid 70   and name HG2%)
      3.000     1.100     1.100 peak   685 weight  0.10000E+01 volume  0.18766E-02 ppm1      3.862 ppm2      1.033 CV     1
 OR {  685}
   (( segid "    " and resid 58   and name HB  ))
   (  segid "    " and resid 70   and name HD1%)
 OR {  685}
   (( segid "    " and resid 58   and name HB  ))
   (( segid "    " and resid 51   and name HG12))
 ASSI {  697}
   (( segid "    " and resid 111  and name HB  ))
   (  segid "    " and resid 20   and name HG1%)
      5.400     3.700     0.600 peak   697 weight  0.10000E+01 volume  0.93172E-04 ppm1      3.733 ppm2      0.326 CV     1
 OR {  697}
   (( segid "    " and resid 111  and name HB  ))
   (  segid "    " and resid 93   and name HG2%)
 ASSI {  698}
   (( segid "    " and resid 111  and name HB  ))
   (( segid "    " and resid 20   and name HB  ))
      6.000     5.200     0.000 peak   698 weight  0.10000E+01 volume  0.40018E-04 ppm1      3.728 ppm2      2.068 CV     1
 OR {  698}
   (( segid "    " and resid 111  and name HB  ))
   (( segid "    " and resid 112  and name HB2 ))
 OR {  698}
   (( segid "    " and resid 111  and name HB  ))
   (( segid "    " and resid 112  and name HB1 ))
 ASSI {  706}
   (( segid "    " and resid 17   and name HB2 ))
   (( segid "    " and resid 18   and name HA  ))
      5.100     3.200     0.900 peak   706 weight  0.10000E+01 volume  0.10021E-03 ppm1      3.766 ppm2      4.296 CV     1
 OR {  706}
   (( segid "    " and resid 17   and name HB2 ))
   (( segid "    " and resid 16   and name HA2 ))
 ASSI {  707}
   (( segid "    " and resid 17   and name HB2 ))
   (( segid "    " and resid 18   and name HB2 ))
      5.200     3.300     0.800 peak   707 weight  0.10000E+01 volume  0.17766E-03 ppm1      3.762 ppm2      1.268 CV     1
 OR {  707}
   (( segid "    " and resid 17   and name HB2 ))
   (( segid "    " and resid 18   and name HB1 ))
 OR {  707}
   (( segid "    " and resid 17   and name HB2 ))
   (( segid "    " and resid 18   and name HG  ))
 OR {  707}
   (( segid "    " and resid 17   and name HB2 ))
   (( segid "    " and resid 86   and name HB2 ))
 OR {  707}
   (( segid "    " and resid 17   and name HB2 ))
   (( segid "    " and resid 86   and name HG  ))
 ASSI {  710}
   (( segid "    " and resid 17   and name HB1 ))
   (( segid "    " and resid 18   and name HB2 ))
      5.500     3.800     0.500 peak   710 weight  0.10000E+01 volume  0.82957E-04 ppm1      3.673 ppm2      1.282 CV     1
 OR {  710}
   (( segid "    " and resid 17   and name HB1 ))
   (( segid "    " and resid 86   and name HB2 ))
 OR {  710}
   (( segid "    " and resid 17   and name HB1 ))
   (( segid "    " and resid 18   and name HB1 ))
 OR {  710}
   (( segid "    " and resid 17   and name HB1 ))
   (( segid "    " and resid 86   and name HG  ))
 OR {  710}
   (( segid "    " and resid 17   and name HB1 ))
   (( segid "    " and resid 18   and name HG  ))
 ASSI {  711}
   (( segid "    " and resid 17   and name HB1 ))
   (( segid "    " and resid 16   and name HA2 ))
      4.500     2.500     1.500 peak   711 weight  0.10000E+01 volume  0.16386E-03 ppm1      3.676 ppm2      4.295 CV     1
 OR {  711}
   (( segid "    " and resid 17   and name HB1 ))
   (( segid "    " and resid 18   and name HA  ))
 ASSI {  722}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 39   and name HG2 ))
      3.500     1.500     1.500 peak   722 weight  0.10000E+01 volume  0.67532E-03 ppm1      4.222 ppm2      2.119 CV     1
 OR {  722}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 46   and name HB2 ))
 OR {  722}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 46   and name HG2 ))
 ASSI {  759}
   (( segid "    " and resid 15   and name HA1 ))
   (( segid "    " and resid 16   and name HN  ))
      3.700     1.700     1.700 peak   759 weight  0.10000E+01 volume  0.71864E-03 ppm1      3.538 ppm2      8.440 CV     1
 OR {  759}
   (( segid "    " and resid 15   and name HA1 ))
   (( segid "    " and resid 85   and name HN  ))
 ASSI {  771}
   (( segid "    " and resid 10   and name HA2 ))
   (  segid "    " and resid 11   and name HD1%)
      4.500     2.600     1.500 peak   771 weight  0.10000E+01 volume  0.27194E-03 ppm1      4.078 ppm2      0.809 CV     1
 OR {  771}
   (( segid "    " and resid 10   and name HA2 ))
   (  segid "    " and resid 11   and name HD2%)
 OR {  771}
   (( segid "    " and resid 10   and name HA2 ))
   (  segid "    " and resid 12   and name HG1%)
 OR {  771}
   (( segid "    " and resid 10   and name HA2 ))
   (  segid "    " and resid 12   and name HG2%)
 ASSI {  782}
   (( segid "    " and resid 9    and name HA1 ))
   (  segid "    " and resid 18   and name HD1%)
      3.900     1.900     1.900 peak   782 weight  0.10000E+01 volume  0.65495E-03 ppm1      3.911 ppm2      0.643 CV     1
 OR {  782}
   (( segid "    " and resid 9    and name HA1 ))
   (  segid "    " and resid 113  and name HG2%)
 ASSI {  786}
   (( segid "    " and resid 66   and name HA2 ))
   (( segid "    " and resid 67   and name HN  ))
      3.400     1.400     1.400 peak   786 weight  0.10000E+01 volume  0.74353E-03 ppm1      3.538 ppm2      7.671 CV     1
 OR {  786}
   (( segid "    " and resid 102  and name HA1 ))
   (( segid "    " and resid 103  and name HN  ))
 ASSI {  794}
   (( segid "    " and resid 9    and name HA2 ))
   (  segid "    " and resid 18   and name HD1%)
      2.800     1.000     1.000 peak   794 weight  0.10000E+01 volume  0.17669E-02 ppm1      3.541 ppm2      0.629 CV     1
 OR {  794}
   (( segid "    " and resid 9    and name HA2 ))
   (  segid "    " and resid 113  and name HG2%)
 ASSI {  797}
   (( segid "    " and resid 102  and name HA1 ))
   (  segid "    " and resid 103  and name HB% )
      4.000     2.000     2.000 peak   797 weight  0.10000E+01 volume  0.61609E-03 ppm1      3.540 ppm2      1.293 CV     1
 OR {  797}
   (( segid "    " and resid 15   and name HA1 ))
   (( segid "    " and resid 86   and name HB2 ))
 OR {  797}
   (( segid "    " and resid 9    and name HA2 ))
   (( segid "    " and resid 18   and name HG  ))
 OR {  797}
   (( segid "    " and resid 66   and name HA2 ))
   (( segid "    " and resid 67   and name HG1 ))
 OR {  797}
   (( segid "    " and resid 9    and name HA2 ))
   (( segid "    " and resid 18   and name HB1 ))
 OR {  797}
   (( segid "    " and resid 9    and name HA2 ))
   (( segid "    " and resid 18   and name HB2 ))
 ASSI {  798}
   (( segid "    " and resid 66   and name HA2 ))
   (( segid "    " and resid 65   and name HG1 ))
      3.700     1.700     1.700 peak   798 weight  0.10000E+01 volume  0.57010E-03 ppm1      3.537 ppm2      1.451 CV     1
 OR {  798}
   (( segid "    " and resid 66   and name HA2 ))
   (( segid "    " and resid 65   and name HG2 ))
 OR {  798}
   (( segid "    " and resid 66   and name HA2 ))
   (( segid "    " and resid 67   and name HG2 ))
 OR {  798}
   (( segid "    " and resid 15   and name HA1 ))
   (( segid "    " and resid 86   and name HB1 ))
 OR {  798}
   (( segid "    " and resid 102  and name HA1 ))
   (  segid "    " and resid 35   and name HB% )
 OR {  798}
   (( segid "    " and resid 9    and name HA2 ))
   (( segid "    " and resid 11   and name HG  ))
 OR {  798}
   (( segid "    " and resid 9    and name HA2 ))
   (( segid "    " and resid 11   and name HB1 ))
 ASSI {  815}
   (  segid "    " and resid 70   and name HG2%)
   (( segid "    " and resid 49   and name HG  ))
      4.000     2.000     2.000 peak   815 weight  0.10000E+01 volume  0.43635E-03 ppm1      1.029 ppm2      6.961 CV     1
 OR {  815}
   (  segid "    " and resid 70   and name HG2%)
   (  segid "    " and resid 60   and name HD% )
 OR {  815}
   (  segid "    " and resid 70   and name HG2%)
   (  segid "    " and resid 68   and name HD% )
 OR {  815}
   (  segid "    " and resid 70   and name HG2%)
   (( segid "    " and resid 36   and name HD1 ))
 ASSI {  818}
   (  segid "    " and resid 70   and name HG2%)
   (( segid "    " and resid 69   and name HA  ))
      3.900     1.900     1.900 peak   818 weight  0.10000E+01 volume  0.75778E-03 ppm1      1.030 ppm2      5.172 CV     1
 OR {  818}
   (  segid "    " and resid 70   and name HG2%)
   (( segid "    " and resid 58   and name HA  ))
 OR {  818}
   (  segid "    " and resid 70   and name HG2%)
   (( segid "    " and resid 51   and name HA  ))
 ASSI {  819}
   (  segid "    " and resid 70   and name HG2%)
   (( segid "    " and resid 58   and name HB  ))
      3.300     1.300     1.300 peak   819 weight  0.10000E+01 volume  0.10516E-02 ppm1      1.032 ppm2      3.847 CV     1
 OR {  819}
   (  segid "    " and resid 70   and name HG2%)
   (( segid "    " and resid 49   and name HB1 ))
 OR {  819}
   (  segid "    " and resid 70   and name HG2%)
   (( segid "    " and resid 69   and name HB  ))
 ASSI {  826}
   (  segid "    " and resid 34   and name HE% )
   (( segid "    " and resid 30   and name HN  ))
      3.400     1.400     1.400 peak   826 weight  0.10000E+01 volume  0.86393E-03 ppm1      1.765 ppm2      8.573 CV     1
 OR {  826}
   (  segid "    " and resid 34   and name HE% )
   (( segid "    " and resid 99   and name HN  ))
 OR {  826}
   (  segid "    " and resid 34   and name HE% )
   (( segid "    " and resid 97   and name HN  ))
 OR {  826}
   (  segid "    " and resid 34   and name HE% )
   (( segid "    " and resid 105  and name HN  ))
 ASSI {  834}
   (  segid "    " and resid 34   and name HE% )
   (( segid "    " and resid 29   and name HB2 ))
      5.000     3.100     1.000 peak   834 weight  0.10000E+01 volume  0.23352E-03 ppm1      1.769 ppm2      2.974 CV     1
 OR {  834}
   (  segid "    " and resid 34   and name HE% )
   (( segid "    " and resid 27   and name HB2 ))
 ASSI {  839}
   (  segid "    " and resid 34   and name HE% )
   (( segid "    " and resid 98   and name HG2 ))
      2.700     0.900     0.900 peak   839 weight  0.10000E+01 volume  0.34230E-02 ppm1      1.767 ppm2      1.003 CV     1
 OR {  839}
   (  segid "    " and resid 34   and name HE% )
   (( segid "    " and resid 98   and name HG1 ))
 OR {  839}
   (  segid "    " and resid 34   and name HE% )
   (  segid "    " and resid 24   and name HB% )
 ASSI {  843}
   (  segid "    " and resid 70   and name HD1%)
   (  segid "    " and resid 79   and name HD1%)
      3.100     1.200     1.200 peak   843 weight  0.10000E+01 volume  0.12273E-02 ppm1      1.079 ppm2      0.404 CV     1
 OR {  843}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 81   and name HG  ))
 ASSI {  853}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 58   and name HA  ))
      3.400     1.500     1.500 peak   853 weight  0.10000E+01 volume  0.29134E-03 ppm1      1.078 ppm2      5.177 CV     1
 OR {  853}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 69   and name HA  ))
 ASSI {  855}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 50   and name HA  ))
      3.400     1.400     1.400 peak   855 weight  0.10000E+01 volume  0.77443E-03 ppm1      1.076 ppm2      5.559 CV     1
 OR {  855}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 36   and name HA  ))
 ASSI {  856}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 35   and name HA  ))
      3.100     1.200     1.200 peak   856 weight  0.10000E+01 volume  0.11770E-02 ppm1      1.078 ppm2      5.723 CV     1
 OR {  856}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 80   and name HA  ))
 ASSI {  857}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 36   and name HD1 ))
      2.600     0.800     0.800 peak   857 weight  0.10000E+01 volume  0.26474E-02 ppm1      1.077 ppm2      6.934 CV     1
 OR {  857}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 49   and name HG  ))
 ASSI {  859}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 52   and name HN  ))
      3.700     1.700     1.700 peak   859 weight  0.10000E+01 volume  0.48465E-03 ppm1      1.077 ppm2      8.502 CV     1
 OR {  859}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 81   and name HN  ))
 OR {  859}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 79   and name HN  ))
 ASSI {  860}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 50   and name HN  ))
      3.500     1.600     1.600 peak   860 weight  0.10000E+01 volume  0.58104E-03 ppm1      1.082 ppm2      8.767 CV     1
 OR {  860}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 36   and name HN  ))
 ASSI {  863}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 34   and name HB2 ))
      3.500     1.500     1.500 peak   863 weight  0.10000E+01 volume  0.14789E-02 ppm1      1.076 ppm2      1.773 CV     1
 OR {  863}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 79   and name HG  ))
 OR {  863}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 79   and name HB1 ))
 OR {  863}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 72   and name HB2 ))
 ASSI {  865}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 52   and name HN  ))
      4.900     2.900     1.100 peak   865 weight  0.10000E+01 volume  0.12227E-03 ppm1      0.967 ppm2      8.508 CV     1
 OR {  865}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 71   and name HN  ))
 ASSI {  867}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 35   and name HN  ))
      4.000     2.000     2.000 peak   867 weight  0.10000E+01 volume  0.37269E-03 ppm1      0.970 ppm2      9.170 CV     1
 OR {  867}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 72   and name HN  ))
 OR {  867}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 80   and name HN  ))
 OR {  867}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 70   and name HN  ))
 ASSI {  869}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 35   and name HA  ))
      4.100     2.100     1.900 peak   869 weight  0.10000E+01 volume  0.20824E-03 ppm1      0.965 ppm2      5.694 CV     1
 OR {  869}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 34   and name HA  ))
 ASSI {  874}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 72   and name HD1 ))
      3.300     1.400     1.400 peak   874 weight  0.10000E+01 volume  0.10045E-02 ppm1      0.968 ppm2      3.012 CV     1
 OR {  874}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 52   and name HB1 ))
 OR {  874}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 53   and name HD2 ))
 ASSI {  875}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 53   and name HD1 ))
      3.700     1.800     1.800 peak   875 weight  0.10000E+01 volume  0.49711E-03 ppm1      0.968 ppm2      2.820 CV     1
 OR {  875}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 52   and name HB2 ))
 OR {  875}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 36   and name HB2 ))
 OR {  875}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 59   and name HB1 ))
 ASSI {  878}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 72   and name HB1 ))
      2.600     0.900     0.900 peak   878 weight  0.10000E+01 volume  0.21343E-02 ppm1      0.969 ppm2      1.950 CV     1
 OR {  878}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 34   and name HB1 ))
 OR {  878}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 70   and name HB  ))
 ASSI {  884}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 52   and name HN  ))
      4.600     2.600     1.400 peak   884 weight  0.10000E+01 volume  0.20972E-03 ppm1      0.836 ppm2      8.466 CV     1
 OR {  884}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 71   and name HN  ))
 ASSI {  886}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 58   and name HB  ))
      3.500     1.500     1.500 peak   886 weight  0.10000E+01 volume  0.13451E-02 ppm1      0.833 ppm2      3.875 CV     1
 OR {  886}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 71   and name HB1 ))
 OR {  886}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 71   and name HB2 ))
 ASSI {  890}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 72   and name HB1 ))
      3.100     1.200     1.200 peak   890 weight  0.10000E+01 volume  0.96019E-03 ppm1      0.835 ppm2      1.965 CV     1
 OR {  890}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 70   and name HB  ))
 ASSI {  892}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 70   and name HG12))
      2.300     0.700     0.700 peak   892 weight  0.10000E+01 volume  0.46197E-02 ppm1      0.834 ppm2      1.265 CV     1
 OR {  892}
   (  segid "    " and resid 51   and name HD1%)
   (  segid "    " and resid 58   and name HG2%)
 ASSI {  894}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 72   and name HA  ))
      5.100     3.300     0.900 peak   894 weight  0.10000E+01 volume  0.14489E-03 ppm1      0.833 ppm2      5.393 CV     1
 OR {  894}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 70   and name HA  ))
 ASSI {  895}
   (( segid "    " and resid 14   and name HD1 ))
   (( segid "    " and resid 116  and name HN  ))
      4.000     2.000     2.000 peak   895 weight  0.10000E+01 volume  0.28126E-03 ppm1      3.533 ppm2      8.448 CV     1
 OR {  895}
   (( segid "    " and resid 14   and name HD2 ))
   (( segid "    " and resid 116  and name HN  ))
 OR {  895}
   (( segid "    " and resid 14   and name HD2 ))
   (( segid "    " and resid 16   and name HN  ))
 OR {  895}
   (( segid "    " and resid 14   and name HD1 ))
   (( segid "    " and resid 16   and name HN  ))
 ASSI {  909}
   (  segid "    " and resid 83   and name HE% )
   (  segid "    " and resid 113  and name HG1%)
      2.900     1.100     1.100 peak   909 weight  0.10000E+01 volume  0.17801E-02 ppm1      0.953 ppm2      0.514 CV     1
 OR {  909}
   (  segid "    " and resid 83   and name HE% )
   (  segid "    " and resid 86   and name HD1%)
 ASSI {  914}
   (  segid "    " and resid 83   and name HE% )
   (( segid "    " and resid 94   and name HB2 ))
      3.700     1.700     1.700 peak   914 weight  0.10000E+01 volume  0.76698E-03 ppm1      0.954 ppm2      2.863 CV     1
 OR {  914}
   (  segid "    " and resid 83   and name HE% )
   (( segid "    " and resid 94   and name HB1 ))
 OR {  914}
   (  segid "    " and resid 83   and name HE% )
   (( segid "    " and resid 90   and name HB2 ))
 ASSI {  915}
   (  segid "    " and resid 83   and name HE% )
   (( segid "    " and resid 90   and name HB1 ))
      4.200     2.200     1.800 peak   915 weight  0.10000E+01 volume  0.33146E-03 ppm1      0.954 ppm2      3.071 CV     1
 OR {  915}
   (  segid "    " and resid 83   and name HE% )
   (( segid "    " and resid 36   and name HB1 ))
 OR {  915}
   (  segid "    " and resid 83   and name HE% )
   (( segid "    " and resid 95   and name HB2 ))
 ASSI {  916}
   (  segid "    " and resid 83   and name HE% )
   (( segid "    " and resid 17   and name HB2 ))
      4.200     2.200     1.800 peak   916 weight  0.10000E+01 volume  0.11947E-03 ppm1      0.954 ppm2      3.759 CV     1
 OR {  916}
   (  segid "    " and resid 83   and name HE% )
   (( segid "    " and resid 8    and name HA2 ))
 OR {  916}
   (  segid "    " and resid 83   and name HE% )
   (( segid "    " and resid 69   and name HB  ))
 OR {  916}
   (  segid "    " and resid 83   and name HE% )
   (( segid "    " and resid 49   and name HB1 ))
 OR {  916}
   (  segid "    " and resid 83   and name HE% )
   (( segid "    " and resid 111  and name HB  ))
 OR {  916}
   (  segid "    " and resid 83   and name HE% )
   (( segid "    " and resid 21   and name HB1 ))
 ASSI {  918}
   (  segid "    " and resid 83   and name HE% )
   (( segid "    " and resid 18   and name HA  ))
      4.000     2.000     2.000 peak   918 weight  0.10000E+01 volume  0.35781E-03 ppm1      0.952 ppm2      4.399 CV     1
 OR {  918}
   (  segid "    " and resid 83   and name HE% )
   (( segid "    " and resid 113  and name HA  ))
 OR {  918}
   (  segid "    " and resid 83   and name HE% )
   (( segid "    " and resid 93   and name HA  ))
 OR {  918}
   (  segid "    " and resid 83   and name HE% )
   (( segid "    " and resid 112  and name HA  ))
 ASSI {  922}
   (  segid "    " and resid 83   and name HE% )
   (( segid "    " and resid 20   and name HN  ))
      3.800     1.800     1.800 peak   922 weight  0.10000E+01 volume  0.35468E-03 ppm1      0.952 ppm2      8.150 CV     1
 OR {  922}
   (  segid "    " and resid 83   and name HE% )
   (( segid "    " and resid 19   and name HN  ))
 ASSI {  927}
   (  segid "    " and resid 83   and name HE% )
   (  segid "    " and resid 113  and name HG2%)
      2.600     0.900     0.900 peak   927 weight  0.10000E+01 volume  0.34810E-02 ppm1      0.952 ppm2      0.624 CV     1
 OR {  927}
   (  segid "    " and resid 83   and name HE% )
   (  segid "    " and resid 18   and name HD1%)
 ASSI {  932}
   (( segid "    " and resid 26   and name HA1 ))
   (( segid "    " and resid 2    and name HB  ))
      4.200     2.200     1.800 peak   932 weight  0.10000E+01 volume  0.22846E-03 ppm1      3.760 ppm2      1.946 CV     1
 OR {  932}
   (( segid "    " and resid 42   and name HA2 ))
   (( segid "    " and resid 43   and name HB2 ))
 ASSI {  950}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 86   and name HB1 ))
      5.500     3.800     0.500 peak   950 weight  0.10000E+01 volume  0.94970E-04 ppm1      3.645 ppm2      1.453 CV     1
 OR {  950}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 67   and name HG2 ))
 ASSI {  957}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 60   and name HB2 ))
      3.400     1.500     1.500 peak   957 weight  0.10000E+01 volume  0.63131E-03 ppm1      3.635 ppm2      2.938 CV     1
 OR {  957}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 68   and name HB2 ))
 ASSI {  958}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 66   and name HA1 ))
      4.600     2.700     1.400 peak   958 weight  0.10000E+01 volume  0.26660E-03 ppm1      3.631 ppm2      4.301 CV     1
 OR {  958}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 62   and name HA  ))
 ASSI {  964}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 60   and name HN  ))
      5.600     3.900     0.400 peak   964 weight  0.10000E+01 volume  0.19421E-04 ppm1      3.637 ppm2      8.902 CV     1
 OR {  964}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 69   and name HN  ))
 ASSI {  971}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 67   and name HB1 ))
      3.700     1.700     1.700 peak   971 weight  0.10000E+01 volume  0.57787E-03 ppm1      3.707 ppm2      1.609 CV     1
 OR {  971}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 87   and name HD1 ))
 OR {  971}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 87   and name HB1 ))
 ASSI {  975}
   (( segid "    " and resid 100  and name HB1 ))
   (  segid "    " and resid 103  and name HB% )
      3.700     1.700     1.700 peak   975 weight  0.10000E+01 volume  0.68461E-03 ppm1      3.719 ppm2      1.272 CV     1
 OR {  975}
   (( segid "    " and resid 100  and name HB2 ))
   (  segid "    " and resid 103  and name HB% )
 OR {  975}
   (( segid "    " and resid 100  and name HB2 ))
   (( segid "    " and resid 104  and name HB2 ))
 OR {  975}
   (( segid "    " and resid 100  and name HB1 ))
   (( segid "    " and resid 104  and name HB2 ))
 OR {  975}
   (( segid "    " and resid 100  and name HB1 ))
   (( segid "    " and resid 104  and name HB1 ))
 ASSI {  996}
   (( segid "    " and resid 78   and name HB  ))
   (( segid "    " and resid 76   and name HB1 ))
      4.500     2.500     1.500 peak   996 weight  0.10000E+01 volume  0.27432E-03 ppm1      3.481 ppm2      1.996 CV     1
 OR {  996}
   (( segid "    " and resid 78   and name HB  ))
   (( segid "    " and resid 72   and name HB1 ))
 ASSI {  998}
   (( segid "    " and resid 78   and name HB  ))
   (( segid "    " and resid 73   and name HB1 ))
      3.600     1.600     1.600 peak   998 weight  0.10000E+01 volume  0.72954E-03 ppm1      3.487 ppm2      3.080 CV     1
 OR {  998}
   (( segid "    " and resid 78   and name HB  ))
   (( segid "    " and resid 76   and name HE1 ))
 OR {  998}
   (( segid "    " and resid 78   and name HB  ))
   (( segid "    " and resid 76   and name HE2 ))
 ASSI { 1004}
   (( segid "    " and resid 59   and name HB2 ))
   (  segid "    " and resid 50   and name HG2%)
      3.900     1.900     1.900 peak  1004 weight  0.10000E+01 volume  0.12137E-03 ppm1      3.390 ppm2      1.218 CV     1
 OR { 1004}
   (( segid "    " and resid 59   and name HB2 ))
   (  segid "    " and resid 58   and name HG2%)
 ASSI { 1011}
   (( segid "    " and resid 59   and name HB2 ))
   (( segid "    " and resid 50   and name HN  ))
      3.900     1.900     1.900 peak  1011 weight  0.10000E+01 volume  0.55313E-03 ppm1      3.396 ppm2      8.878 CV     1
 OR { 1011}
   (( segid "    " and resid 59   and name HB2 ))
   (( segid "    " and resid 60   and name HN  ))
 ASSI { 1015}
   (( segid "    " and resid 67   and name HD2 ))
   (( segid "    " and resid 68   and name HB2 ))
      3.100     1.200     1.200 peak  1015 weight  0.10000E+01 volume  0.51288E-03 ppm1      3.305 ppm2      2.855 CV     1
 OR { 1015}
   (( segid "    " and resid 67   and name HD1 ))
   (( segid "    " and resid 87   and name HE2 ))
 OR { 1015}
   (( segid "    " and resid 67   and name HD1 ))
   (( segid "    " and resid 68   and name HB2 ))
 OR { 1015}
   (( segid "    " and resid 67   and name HD2 ))
   (( segid "    " and resid 87   and name HE2 ))
 OR { 1015}
   (( segid "    " and resid 67   and name HD1 ))
   (( segid "    " and resid 87   and name HE1 ))
 OR { 1015}
   (( segid "    " and resid 67   and name HD2 ))
   (( segid "    " and resid 87   and name HE1 ))
 OR { 1015}
   (( segid "    " and resid 67   and name HD2 ))
   (( segid "    " and resid 68   and name HB1 ))
 ASSI { 1024}
   (( segid "    " and resid 32   and name HB1 ))
   (( segid "    " and resid 98   and name HG1 ))
      3.900     1.900     1.900 peak  1024 weight  0.10000E+01 volume  0.39724E-03 ppm1      3.283 ppm2      1.019 CV     1
 OR { 1024}
   (( segid "    " and resid 32   and name HB1 ))
   (( segid "    " and resid 98   and name HG2 ))
 OR { 1024}
   (( segid "    " and resid 32   and name HB1 ))
   (  segid "    " and resid 106  and name HB% )
 OR { 1024}
   (( segid "    " and resid 32   and name HB1 ))
   (  segid "    " and resid 51   and name HG2%)
 ASSI { 1032}
   (( segid "    " and resid 32   and name HB1 ))
   (( segid "    " and resid 99   and name HN  ))
      4.900     3.000     1.100 peak  1032 weight  0.10000E+01 volume  0.84595E-04 ppm1      3.292 ppm2      8.485 CV     1
 OR { 1032}
   (( segid "    " and resid 32   and name HB1 ))
   (( segid "    " and resid 100  and name HN  ))
 OR { 1032}
   (( segid "    " and resid 32   and name HB1 ))
   (( segid "    " and resid 30   and name HN  ))
 ASSI { 1041}
   (( segid "    " and resid 22   and name HB2 ))
   (  segid "    " and resid 4    and name HD1%)
      5.300     3.400     0.700 peak  1041 weight  0.10000E+01 volume  0.81831E-04 ppm1      3.045 ppm2      0.612 CV     1
 OR { 1041}
   (( segid "    " and resid 22   and name HB2 ))
   (  segid "    " and resid 37   and name HG2%)
 OR { 1041}
   (( segid "    " and resid 22   and name HB2 ))
   (  segid "    " and resid 113  and name HG2%)
 ASSI { 1043}
   (( segid "    " and resid 22   and name HB2 ))
   (  segid "    " and resid 23   and name HB% )
      4.900     3.000     1.100 peak  1043 weight  0.10000E+01 volume  0.16003E-03 ppm1      3.048 ppm2      1.413 CV     1
 OR { 1043}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 4    and name HG  ))
 ASSI { 1044}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 96   and name HB2 ))
      3.100     1.200     1.200 peak  1044 weight  0.10000E+01 volume  0.16702E-02 ppm1      3.049 ppm2      1.785 CV     1
 OR { 1044}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 79   and name HB1 ))
 OR { 1044}
   (( segid "    " and resid 22   and name HB2 ))
   (  segid "    " and resid 6    and name HB% )
 OR { 1044}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 79   and name HG  ))
 ASSI { 1050}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 79   and name HN  ))
      4.400     2.400     1.600 peak  1050 weight  0.10000E+01 volume  0.12452E-03 ppm1      3.050 ppm2      8.472 CV     1
 OR { 1050}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 81   and name HN  ))
 ASSI { 1053}
   (( segid "    " and resid 22   and name HB1 ))
   (  segid "    " and resid 78   and name HG2%)
      4.600     2.600     1.400 peak  1053 weight  0.10000E+01 volume  0.23489E-03 ppm1      2.935 ppm2      0.652 CV     1
 OR { 1053}
   (( segid "    " and resid 22   and name HB1 ))
   (  segid "    " and resid 4    and name HD2%)
 OR { 1053}
   (( segid "    " and resid 22   and name HB1 ))
   (( segid "    " and resid 81   and name HB1 ))
 OR { 1053}
   (( segid "    " and resid 22   and name HB1 ))
   (  segid "    " and resid 81   and name HD1%)
 ASSI { 1054}
   (( segid "    " and resid 22   and name HB1 ))
   (( segid "    " and resid 79   and name HB2 ))
      3.800     1.800     1.800 peak  1054 weight  0.10000E+01 volume  0.68677E-03 ppm1      2.930 ppm2      1.078 CV     1
 OR { 1054}
   (( segid "    " and resid 22   and name HB1 ))
   (  segid "    " and resid 111  and name HG2%)
 ASSI { 1055}
   (( segid "    " and resid 22   and name HB1 ))
   (( segid "    " and resid 79   and name HB1 ))
      2.900     1.100     1.100 peak  1055 weight  0.10000E+01 volume  0.24454E-02 ppm1      2.933 ppm2      1.788 CV     1
 OR { 1055}
   (( segid "    " and resid 22   and name HB1 ))
   (( segid "    " and resid 96   and name HB2 ))
 OR { 1055}
   (( segid "    " and resid 22   and name HB1 ))
   (  segid "    " and resid 6    and name HB% )
 ASSI { 1061}
   (( segid "    " and resid 22   and name HB1 ))
   (( segid "    " and resid 79   and name HN  ))
      4.600     2.700     1.400 peak  1061 weight  0.10000E+01 volume  0.24459E-03 ppm1      2.931 ppm2      8.486 CV     1
 OR { 1061}
   (( segid "    " and resid 22   and name HB1 ))
   (( segid "    " and resid 81   and name HN  ))
 ASSI { 1064}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 76   and name HN  ))
      3.800     1.800     1.800 peak  1064 weight  0.10000E+01 volume  0.36434E-03 ppm1      3.090 ppm2      7.465 CV     1
 OR { 1064}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 78   and name HN  ))
 ASSI { 1065}
   (( segid "    " and resid 90   and name HB1 ))
   (  segid "    " and resid 94   and name HE% )
      3.700     1.700     1.700 peak  1065 weight  0.10000E+01 volume  0.11217E-02 ppm1      3.087 ppm2      6.664 CV     1
 OR { 1065}
   (( segid "    " and resid 73   and name HB1 ))
   (  segid "    " and resid 80   and name HE% )
 ASSI { 1067}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 78   and name HB  ))
      3.600     1.600     1.600 peak  1067 weight  0.10000E+01 volume  0.53077E-03 ppm1      3.089 ppm2      3.475 CV     1
 OR { 1067}
   (( segid "    " and resid 65   and name HE2 ))
   (( segid "    " and resid 66   and name HA2 ))
 ASSI { 1074}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 76   and name HA  ))
      3.700     1.700     1.700 peak  1074 weight  0.10000E+01 volume  0.46666E-03 ppm1      3.099 ppm2      4.331 CV     1
 OR { 1074}
   (( segid "    " and resid 65   and name HE2 ))
   (( segid "    " and resid 66   and name HA1 ))
 ASSI { 1078}
   (( segid "    " and resid 90   and name HB1 ))
   (  segid "    " and resid 86   and name HD2%)
      3.200     1.300     1.300 peak  1078 weight  0.10000E+01 volume  0.11016E-02 ppm1      3.071 ppm2      0.915 CV     1
 OR { 1078}
   (( segid "    " and resid 90   and name HB1 ))
   (  segid "    " and resid 83   and name HE% )
 OR { 1078}
   (( segid "    " and resid 90   and name HB1 ))
   (  segid "    " and resid 48   and name HG1%)
 OR { 1078}
   (( segid "    " and resid 73   and name HB1 ))
   (  segid "    " and resid 79   and name HD2%)
 ASSI { 1079}
   (( segid "    " and resid 90   and name HB1 ))
   (  segid "    " and resid 115  and name HG1%)
      3.000     1.100     1.100 peak  1079 weight  0.10000E+01 volume  0.13001E-02 ppm1      3.068 ppm2      0.651 CV     1
 OR { 1079}
   (( segid "    " and resid 90   and name HB1 ))
   (( segid "    " and resid 38   and name HB1 ))
 OR { 1079}
   (( segid "    " and resid 73   and name HB1 ))
   (  segid "    " and resid 78   and name HG2%)
 ASSI { 1090}
   (( segid "    " and resid 59   and name HB1 ))
   (( segid "    " and resid 60   and name HN  ))
      3.700     1.700     1.700 peak  1090 weight  0.10000E+01 volume  0.67192E-03 ppm1      2.832 ppm2      8.863 CV     1
 OR { 1090}
   (( segid "    " and resid 59   and name HB1 ))
   (( segid "    " and resid 50   and name HN  ))
 ASSI { 1105}
   (( segid "    " and resid 90   and name HB2 ))
   (( segid "    " and resid 86   and name HB1 ))
      3.200     1.300     1.300 peak  1105 weight  0.10000E+01 volume  0.14628E-02 ppm1      2.829 ppm2      1.412 CV     1
 OR { 1105}
   (( segid "    " and resid 90   and name HB2 ))
   (( segid "    " and resid 87   and name HG2 ))
 OR { 1105}
   (( segid "    " and resid 90   and name HB2 ))
   (  segid "    " and resid 91   and name HG2%)
 OR { 1105}
   (( segid "    " and resid 90   and name HB2 ))
   (( segid "    " and resid 38   and name HG2 ))
 OR { 1105}
   (( segid "    " and resid 90   and name HB2 ))
   (( segid "    " and resid 38   and name HG1 ))
 ASSI { 1106}
   (( segid "    " and resid 90   and name HB2 ))
   (  segid "    " and resid 86   and name HD2%)
      3.400     1.400     1.400 peak  1106 weight  0.10000E+01 volume  0.10738E-02 ppm1      2.828 ppm2      0.912 CV     1
 OR { 1106}
   (( segid "    " and resid 90   and name HB2 ))
   (  segid "    " and resid 83   and name HE% )
 ASSI { 1107}
   (( segid "    " and resid 90   and name HB2 ))
   (  segid "    " and resid 115  and name HG1%)
      3.500     1.600     1.600 peak  1107 weight  0.10000E+01 volume  0.77153E-03 ppm1      2.824 ppm2      0.645 CV     1
 OR { 1107}
   (( segid "    " and resid 90   and name HB2 ))
   (( segid "    " and resid 38   and name HB1 ))
 OR { 1107}
   (( segid "    " and resid 90   and name HB2 ))
   (( segid "    " and resid 38   and name HB2 ))
 ASSI { 1110}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 65   and name HN  ))
      4.200     2.200     1.800 peak  1110 weight  0.10000E+01 volume  0.16308E-03 ppm1      2.945 ppm2      7.276 CV     1
 OR { 1110}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 64   and name HN  ))
 ASSI { 1115}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 65   and name HG2 ))
      3.100     1.200     1.200 peak  1115 weight  0.10000E+01 volume  0.23994E-02 ppm1      2.945 ppm2      1.400 CV     1
 OR { 1115}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 65   and name HG1 ))
 OR { 1115}
   (( segid "    " and resid 60   and name HB2 ))
   (  segid "    " and resid 61   and name HB% )
 ASSI { 1132}
   (( segid "    " and resid 29   and name HB2 ))
   (  segid "    " and resid 24   and name HB% )
      4.600     2.600     1.400 peak  1132 weight  0.10000E+01 volume  0.30297E-03 ppm1      3.041 ppm2      1.027 CV     1
 OR { 1132}
   (( segid "    " and resid 29   and name HB2 ))
   (( segid "    " and resid 79   and name HB2 ))
 OR { 1132}
   (( segid "    " and resid 29   and name HB2 ))
   (  segid "    " and resid 79   and name HD2%)
 OR { 1132}
   (( segid "    " and resid 29   and name HB2 ))
   (  segid "    " and resid 51   and name HG2%)
 OR { 1132}
   (( segid "    " and resid 29   and name HB2 ))
   (( segid "    " and resid 98   and name HG2 ))
 OR { 1132}
   (( segid "    " and resid 29   and name HB2 ))
   (( segid "    " and resid 98   and name HG1 ))
 ASSI { 1142}
   (( segid "    " and resid 52   and name HB1 ))
   (( segid "    " and resid 57   and name HB1 ))
      4.500     2.500     1.500 peak  1142 weight  0.10000E+01 volume  0.25844E-03 ppm1      3.102 ppm2      3.877 CV     1
 OR { 1142}
   (( segid "    " and resid 52   and name HB1 ))
   (( segid "    " and resid 57   and name HB2 ))
 OR { 1142}
   (( segid "    " and resid 52   and name HB1 ))
   (( segid "    " and resid 56   and name HA2 ))
 OR { 1142}
   (( segid "    " and resid 52   and name HB1 ))
   (( segid "    " and resid 54   and name HA1 ))
 OR { 1142}
   (( segid "    " and resid 52   and name HB1 ))
   (( segid "    " and resid 58   and name HB  ))
 OR { 1142}
   (( segid "    " and resid 52   and name HB1 ))
   (( segid "    " and resid 54   and name HA2 ))
 ASSI { 1144}
   (( segid "    " and resid 52   and name HB1 ))
   (  segid "    " and resid 58   and name HG2%)
      4.600     2.600     1.400 peak  1144 weight  0.10000E+01 volume  0.16967E-03 ppm1      3.118 ppm2      1.201 CV     1
 OR { 1144}
   (( segid "    " and resid 52   and name HB1 ))
   (  segid "    " and resid 50   and name HG2%)
 ASSI { 1147}
   (( segid "    " and resid 27   and name HB1 ))
   (  segid "    " and resid 24   and name HB% )
      4.300     2.400     1.700 peak  1147 weight  0.10000E+01 volume  0.25589E-03 ppm1      3.086 ppm2      1.027 CV     1
 OR { 1147}
   (( segid "    " and resid 27   and name HB1 ))
   (( segid "    " and resid 98   and name HG1 ))
 OR { 1147}
   (( segid "    " and resid 27   and name HB1 ))
   (( segid "    " and resid 98   and name HG2 ))
 ASSI { 1155}
   (( segid "    " and resid 84   and name HB2 ))
   (( segid "    " and resid 85   and name HB2 ))
      3.900     1.900     1.900 peak  1155 weight  0.10000E+01 volume  0.50152E-03 ppm1      3.094 ppm2      3.696 CV     1
 OR { 1155}
   (( segid "    " and resid 84   and name HB2 ))
   (( segid "    " and resid 85   and name HA  ))
 OR { 1155}
   (( segid "    " and resid 84   and name HB2 ))
   (( segid "    " and resid 17   and name HB2 ))
 ASSI { 1169}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 64   and name HB  ))
      2.800     1.000     1.000 peak  1169 weight  0.10000E+01 volume  0.24796E-02 ppm1      2.915 ppm2      1.028 CV     1
 OR { 1169}
   (( segid "    " and resid 68   and name HB1 ))
   (( segid "    " and resid 64   and name HB  ))
 OR { 1169}
   (( segid "    " and resid 68   and name HB1 ))
   (  segid "    " and resid 70   and name HG2%)
 OR { 1169}
   (( segid "    " and resid 68   and name HB1 ))
   (( segid "    " and resid 83   and name HB1 ))
 OR { 1169}
   (( segid "    " and resid 68   and name HB2 ))
   (  segid "    " and resid 70   and name HG2%)
 ASSI { 1179}
   (( segid "    " and resid 94   and name HB2 ))
   (  segid "    " and resid 20   and name HG1%)
      3.400     1.400     1.400 peak  1179 weight  0.10000E+01 volume  0.83417E-03 ppm1      2.904 ppm2      0.329 CV     1
 OR { 1179}
   (( segid "    " and resid 94   and name HB1 ))
   (  segid "    " and resid 20   and name HG1%)
 OR { 1179}
   (( segid "    " and resid 94   and name HB2 ))
   (  segid "    " and resid 93   and name HG2%)
 ASSI { 1182}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 64   and name HB  ))
      2.700     0.900     0.900 peak  1182 weight  0.10000E+01 volume  0.29878E-02 ppm1      2.924 ppm2      1.047 CV     1
 OR { 1182}
   (( segid "    " and resid 68   and name HB1 ))
   (( segid "    " and resid 64   and name HB  ))
 OR { 1182}
   (( segid "    " and resid 68   and name HB1 ))
   (  segid "    " and resid 70   and name HG2%)
 OR { 1182}
   (( segid "    " and resid 68   and name HB2 ))
   (  segid "    " and resid 70   and name HG2%)
 ASSI { 1183}
   (( segid "    " and resid 27   and name HB2 ))
   (  segid "    " and resid 2    and name HG1%)
      3.400     1.400     1.400 peak  1183 weight  0.10000E+01 volume  0.99551E-03 ppm1      2.936 ppm2      0.701 CV     1
 OR { 1183}
   (( segid "    " and resid 94   and name HB2 ))
   (( segid "    " and resid 38   and name HB1 ))
 OR { 1183}
   (( segid "    " and resid 94   and name HB2 ))
   (  segid "    " and resid 81   and name HD1%)
 ASSI { 1184}
   (( segid "    " and resid 94   and name HB1 ))
   (( segid "    " and resid 36   and name HE3 ))
      3.400     1.400     1.400 peak  1184 weight  0.10000E+01 volume  0.73594E-03 ppm1      2.916 ppm2      7.700 CV     1
 OR { 1184}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 67   and name HN  ))
 OR { 1184}
   (( segid "    " and resid 94   and name HB2 ))
   (( segid "    " and resid 36   and name HE3 ))
 ASSI { 1186}
   (( segid "    " and resid 94   and name HB1 ))
   (  segid "    " and resid 113  and name HG2%)
      3.700     1.700     1.700 peak  1186 weight  0.10000E+01 volume  0.11478E-02 ppm1      2.872 ppm2      0.674 CV     1
 OR { 1186}
   (( segid "    " and resid 94   and name HB1 ))
   (( segid "    " and resid 38   and name HB1 ))
 OR { 1186}
   (( segid "    " and resid 94   and name HB1 ))
   (  segid "    " and resid 37   and name HG2%)
 ASSI { 1196}
   (( segid "    " and resid 77   and name HB2 ))
   (( segid "    " and resid 29   and name HN  ))
      4.600     2.600     1.400 peak  1196 weight  0.10000E+01 volume  0.12405E-03 ppm1      2.858 ppm2      8.219 CV     1
 OR { 1196}
   (( segid "    " and resid 77   and name HB2 ))
   (( segid "    " and resid 24   and name HN  ))
 ASSI { 1198}
   (( segid "    " and resid 77   and name HB2 ))
   (( segid "    " and resid 78   and name HN  ))
      5.500     3.800     0.500 peak  1198 weight  0.10000E+01 volume  0.80391E-04 ppm1      2.861 ppm2      7.460 CV     1
 OR { 1198}
   (( segid "    " and resid 77   and name HB2 ))
   (( segid "    " and resid 76   and name HN  ))
 ASSI { 1206}
   (( segid "    " and resid 80   and name HB1 ))
   (( segid "    " and resid 81   and name HN  ))
      3.400     1.500     1.500 peak  1206 weight  0.10000E+01 volume  0.66893E-03 ppm1      2.759 ppm2      8.513 CV     1
 OR { 1206}
   (( segid "    " and resid 80   and name HB1 ))
   (( segid "    " and resid 71   and name HN  ))
 ASSI { 1215}
   (( segid "    " and resid 110  and name HA2 ))
   (( segid "    " and resid 95   and name HA  ))
      3.600     1.600     1.600 peak  1215 weight  0.10000E+01 volume  0.52700E-03 ppm1      2.660 ppm2      4.888 CV     1
 OR { 1215}
   (( segid "    " and resid 110  and name HA2 ))
   (( segid "    " and resid 111  and name HA  ))
 ASSI { 1226}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 78   and name HN  ))
      5.100     3.300     0.900 peak  1226 weight  0.10000E+01 volume  0.89309E-04 ppm1      2.684 ppm2      7.420 CV     1
 OR { 1226}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 76   and name HN  ))
 ASSI { 1235}
   (( segid "    " and resid 62   and name HB1 ))
   (( segid "    " and resid 65   and name HN  ))
      4.800     2.900     1.200 peak  1235 weight  0.10000E+01 volume  0.19866E-03 ppm1      2.720 ppm2      7.268 CV     1
 OR { 1235}
   (( segid "    " and resid 62   and name HB1 ))
   (( segid "    " and resid 64   and name HN  ))
 OR { 1235}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 65   and name HN  ))
 OR { 1235}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 64   and name HN  ))
 ASSI { 1255}
   (( segid "    " and resid 84   and name HB1 ))
   (( segid "    " and resid 85   and name HB1 ))
      5.400     3.700     0.600 peak  1255 weight  0.10000E+01 volume  0.15526E-03 ppm1      2.780 ppm2      4.000 CV     1
 OR { 1255}
   (( segid "    " and resid 84   and name HB1 ))
   (( segid "    " and resid 83   and name HA  ))
 ASSI { 1263}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 57   and name HB1 ))
      3.900     1.900     1.900 peak  1263 weight  0.10000E+01 volume  0.44005E-03 ppm1      2.744 ppm2      3.906 CV     1
 OR { 1263}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 57   and name HB2 ))
 OR { 1263}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 58   and name HB  ))
 OR { 1263}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 56   and name HA2 ))
 OR { 1263}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 54   and name HA1 ))
 OR { 1263}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 56   and name HA1 ))
 OR { 1263}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 54   and name HA2 ))
 ASSI { 1273}
   (( segid "    " and resid 77   and name HB1 ))
   (  segid "    " and resid 23   and name HB% )
      5.600     3.900     0.400 peak  1273 weight  0.10000E+01 volume  0.80428E-04 ppm1      2.663 ppm2      1.385 CV     1
 OR { 1273}
   (( segid "    " and resid 77   and name HB1 ))
   (( segid "    " and resid 76   and name HG1 ))
 ASSI { 1276}
   (( segid "    " and resid 87   and name HE2 ))
   (( segid "    " and resid 64   and name HA  ))
      3.500     1.500     1.500 peak  1276 weight  0.10000E+01 volume  0.25531E-03 ppm1      2.879 ppm2      4.055 CV     1
 OR { 1276}
   (( segid "    " and resid 87   and name HE1 ))
   (( segid "    " and resid 64   and name HA  ))
 OR { 1276}
   (( segid "    " and resid 87   and name HE1 ))
   (( segid "    " and resid 85   and name HB1 ))
 ASSI { 1282}
   (( segid "    " and resid 33   and name HB1 ))
   (( segid "    " and resid 32   and name HB2 ))
      3.200     1.300     1.300 peak  1282 weight  0.10000E+01 volume  0.13957E-02 ppm1      3.278 ppm2      2.694 CV     1
 OR { 1282}
   (( segid "    " and resid 33   and name HB1 ))
   (( segid "    " and resid 99   and name HB1 ))
 OR { 1282}
   (( segid "    " and resid 33   and name HB1 ))
   (( segid "    " and resid 99   and name HB2 ))
 ASSI { 1289}
   (( segid "    " and resid 47   and name HB1 ))
   (  segid "    " and resid 61   and name HB% )
      4.300     2.300     1.700 peak  1289 weight  0.10000E+01 volume  0.34378E-03 ppm1      3.229 ppm2      1.420 CV     1
 OR { 1289}
   (( segid "    " and resid 47   and name HB2 ))
   (  segid "    " and resid 35   and name HB% )
 OR { 1289}
   (( segid "    " and resid 47   and name HB2 ))
   (  segid "    " and resid 61   and name HB% )
 OR { 1289}
   (( segid "    " and resid 47   and name HB1 ))
   (  segid "    " and resid 35   and name HB% )
 ASSI { 1304}
   (( segid "    " and resid 36   and name HB1 ))
   (( segid "    " and resid 48   and name HB  ))
      3.700     1.700     1.700 peak  1304 weight  0.10000E+01 volume  0.55855E-03 ppm1      3.105 ppm2      1.945 CV     1
 OR { 1304}
   (( segid "    " and resid 36   and name HB1 ))
   (( segid "    " and resid 37   and name HB  ))
 OR { 1304}
   (( segid "    " and resid 36   and name HB1 ))
   (( segid "    " and resid 70   and name HB  ))
 ASSI { 1306}
   (( segid "    " and resid 36   and name HB1 ))
   (  segid "    " and resid 48   and name HG2%)
      3.600     1.700     1.700 peak  1306 weight  0.10000E+01 volume  0.50741E-03 ppm1      3.101 ppm2      0.859 CV     1
 OR { 1306}
   (( segid "    " and resid 36   and name HB1 ))
   (  segid "    " and resid 48   and name HG2%)
 OR { 1306}
   (( segid "    " and resid 36   and name HB1 ))
   (  segid "    " and resid 37   and name HG1%)
 ASSI { 1307}
   (( segid "    " and resid 36   and name HB1 ))
   (  segid "    " and resid 48   and name HG2%)
      3.700     1.800     1.800 peak  1307 weight  0.10000E+01 volume  0.52668E-03 ppm1      3.102 ppm2      0.966 CV     1
 OR { 1307}
   (( segid "    " and resid 36   and name HB1 ))
   (  segid "    " and resid 48   and name HG1%)
 OR { 1307}
   (( segid "    " and resid 36   and name HB1 ))
   (  segid "    " and resid 48   and name HG1%)
 OR { 1307}
   (( segid "    " and resid 36   and name HB1 ))
   (  segid "    " and resid 79   and name HD2%)
 ASSI { 1308}
   (( segid "    " and resid 36   and name HB1 ))
   (  segid "    " and resid 81   and name HD1%)
      4.400     2.400     1.600 peak  1308 weight  0.10000E+01 volume  0.29611E-03 ppm1      3.108 ppm2      0.648 CV     1
 OR { 1308}
   (( segid "    " and resid 36   and name HB1 ))
   (  segid "    " and resid 37   and name HG2%)
 OR { 1308}
   (( segid "    " and resid 36   and name HB1 ))
   (( segid "    " and resid 81   and name HB1 ))
 ASSI { 1323}
   (( segid "    " and resid 33   and name HB2 ))
   (( segid "    " and resid 32   and name HB2 ))
      3.800     1.800     1.800 peak  1323 weight  0.10000E+01 volume  0.65693E-03 ppm1      2.882 ppm2      2.687 CV     1
 OR { 1323}
   (( segid "    " and resid 33   and name HB2 ))
   (( segid "    " and resid 99   and name HB1 ))
 OR { 1323}
   (( segid "    " and resid 33   and name HB2 ))
   (( segid "    " and resid 99   and name HB2 ))
 ASSI { 1328}
   (( segid "    " and resid 33   and name HB2 ))
   (( segid "    " and resid 99   and name HN  ))
      4.800     2.900     1.200 peak  1328 weight  0.10000E+01 volume  0.69427E-04 ppm1      2.881 ppm2      8.466 CV     1
 OR { 1328}
   (( segid "    " and resid 33   and name HB2 ))
   (( segid "    " and resid 52   and name HN  ))
 ASSI { 1337}
   (( segid "    " and resid 36   and name HB2 ))
   (( segid "    " and resid 48   and name HB  ))
      3.600     1.600     1.600 peak  1337 weight  0.10000E+01 volume  0.65463E-03 ppm1      2.776 ppm2      1.956 CV     1
 OR { 1337}
   (( segid "    " and resid 36   and name HB2 ))
   (( segid "    " and resid 70   and name HB  ))
 OR { 1337}
   (( segid "    " and resid 36   and name HB2 ))
   (( segid "    " and resid 37   and name HB  ))
 ASSI { 1338}
   (( segid "    " and resid 36   and name HB2 ))
   (  segid "    " and resid 48   and name HG2%)
      3.600     1.600     1.600 peak  1338 weight  0.10000E+01 volume  0.74394E-03 ppm1      2.771 ppm2      0.862 CV     1
 OR { 1338}
   (( segid "    " and resid 36   and name HB2 ))
   (  segid "    " and resid 48   and name HG2%)
 OR { 1338}
   (( segid "    " and resid 36   and name HB2 ))
   (  segid "    " and resid 37   and name HG1%)
 ASSI { 1339}
   (( segid "    " and resid 36   and name HB2 ))
   (  segid "    " and resid 81   and name HD1%)
      4.000     2.000     2.000 peak  1339 weight  0.10000E+01 volume  0.46243E-03 ppm1      2.777 ppm2      0.647 CV     1
 OR { 1339}
   (( segid "    " and resid 36   and name HB2 ))
   (  segid "    " and resid 37   and name HG2%)
 OR { 1339}
   (( segid "    " and resid 36   and name HB2 ))
   (( segid "    " and resid 81   and name HB1 ))
 ASSI { 1344}
   (( segid "    " and resid 109  and name HG2 ))
   (  segid "    " and resid 95   and name HE% )
      3.900     1.900     1.900 peak  1344 weight  0.10000E+01 volume  0.38464E-03 ppm1      2.614 ppm2      6.791 CV     1
 OR { 1344}
   (( segid "    " and resid 109  and name HG1 ))
   (  segid "    " and resid 95   and name HE% )
 OR { 1344}
   (( segid "    " and resid 109  and name HG1 ))
   (( segid "    " and resid 5    and name HE22))
 ASSI { 1356}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 33   and name HB1 ))
      4.100     2.100     1.900 peak  1356 weight  0.10000E+01 volume  0.21091E-03 ppm1      2.427 ppm2      3.255 CV     1
 OR { 1356}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 32   and name HB1 ))
 ASSI { 1361}
   (( segid "    " and resid 34   and name HG1 ))
   (  segid "    " and resid 51   and name HG2%)
      3.600     1.600     1.600 peak  1361 weight  0.10000E+01 volume  0.63798E-03 ppm1      2.480 ppm2      0.953 CV     1
 OR { 1361}
   (( segid "    " and resid 34   and name HG1 ))
   (  segid "    " and resid 79   and name HD2%)
 ASSI { 1362}
   (( segid "    " and resid 34   and name HG2 ))
   (  segid "    " and resid 51   and name HG2%)
      4.200     2.200     1.800 peak  1362 weight  0.10000E+01 volume  0.56628E-03 ppm1      2.425 ppm2      0.953 CV     1
 OR { 1362}
   (( segid "    " and resid 34   and name HG2 ))
   (  segid "    " and resid 79   and name HD2%)
 ASSI { 1365}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 32   and name HB2 ))
      4.500     2.500     1.500 peak  1365 weight  0.10000E+01 volume  0.23886E-03 ppm1      2.433 ppm2      2.696 CV     1
 OR { 1365}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 99   and name HB1 ))
 OR { 1365}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 99   and name HB2 ))
 ASSI { 1372}
   (( segid "    " and resid 13   and name HG2 ))
   (( segid "    " and resid 117  and name HA  ))
      3.700     1.700     1.700 peak  1372 weight  0.10000E+01 volume  0.96350E-03 ppm1      2.437 ppm2      4.487 CV     1
 OR { 1372}
   (( segid "    " and resid 13   and name HG2 ))
   (( segid "    " and resid 12   and name HA  ))
 OR { 1372}
   (( segid "    " and resid 13   and name HG1 ))
   (( segid "    " and resid 117  and name HA  ))
 OR { 1372}
   (( segid "    " and resid 13   and name HG1 ))
   (( segid "    " and resid 12   and name HA  ))
 ASSI { 1373}
   (( segid "    " and resid 13   and name HG2 ))
   (( segid "    " and resid 14   and name HA  ))
      3.600     1.600     1.600 peak  1373 weight  0.10000E+01 volume  0.61995E-03 ppm1      2.437 ppm2      3.903 CV     1
 OR { 1373}
   (( segid "    " and resid 13   and name HG1 ))
   (( segid "    " and resid 14   and name HA  ))
 OR { 1373}
   (( segid "    " and resid 13   and name HG2 ))
   (( segid "    " and resid 117  and name HB2 ))
 OR { 1373}
   (( segid "    " and resid 13   and name HG1 ))
   (( segid "    " and resid 117  and name HB2 ))
 ASSI { 1374}
   (( segid "    " and resid 13   and name HG2 ))
   (( segid "    " and resid 16   and name HA1 ))
      4.000     2.000     2.000 peak  1374 weight  0.10000E+01 volume  0.32422E-03 ppm1      2.438 ppm2      3.721 CV     1
 OR { 1374}
   (( segid "    " and resid 13   and name HG1 ))
   (( segid "    " and resid 16   and name HA1 ))
 OR { 1374}
   (( segid "    " and resid 13   and name HG2 ))
   (( segid "    " and resid 116  and name HB1 ))
 OR { 1374}
   (( segid "    " and resid 13   and name HG1 ))
   (( segid "    " and resid 116  and name HB1 ))
 OR { 1374}
   (( segid "    " and resid 13   and name HG2 ))
   (( segid "    " and resid 85   and name HA  ))
 ASSI { 1380}
   (( segid "    " and resid 13   and name HG2 ))
   (( segid "    " and resid 16   and name HN  ))
      3.800     1.800     1.800 peak  1380 weight  0.10000E+01 volume  0.48442E-03 ppm1      2.434 ppm2      8.463 CV     1
 OR { 1380}
   (( segid "    " and resid 13   and name HG1 ))
   (( segid "    " and resid 16   and name HN  ))
 OR { 1380}
   (( segid "    " and resid 13   and name HG2 ))
   (( segid "    " and resid 116  and name HN  ))
 OR { 1380}
   (( segid "    " and resid 13   and name HG1 ))
   (( segid "    " and resid 116  and name HN  ))
 ASSI { 1385}
   (( segid "    " and resid 39   and name HG1 ))
   (( segid "    " and resid 45   and name HA  ))
      4.500     2.500     1.500 peak  1385 weight  0.10000E+01 volume  0.27051E-03 ppm1      2.227 ppm2      4.217 CV     1
 OR { 1385}
   (( segid "    " and resid 39   and name HG1 ))
   (( segid "    " and resid 44   and name HA2 ))
 ASSI { 1387}
   (( segid "    " and resid 39   and name HG1 ))
   (  segid "    " and resid 45   and name HD1%)
      4.300     2.400     1.700 peak  1387 weight  0.10000E+01 volume  0.33947E-03 ppm1      2.226 ppm2      0.329 CV     1
 OR { 1387}
   (( segid "    " and resid 39   and name HG1 ))
   (  segid "    " and resid 45   and name HD2%)
 OR { 1387}
   (( segid "    " and resid 39   and name HG1 ))
   (  segid "    " and resid 93   and name HG2%)
 ASSI { 1397}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 104  and name HN  ))
      4.100     2.100     1.900 peak  1397 weight  0.10000E+01 volume  0.19224E-03 ppm1      2.404 ppm2      8.121 CV     1
 OR { 1397}
   (( segid "    " and resid 105  and name HB1 ))
   (( segid "    " and resid 104  and name HN  ))
 OR { 1397}
   (( segid "    " and resid 105  and name HB1 ))
   (( segid "    " and resid 98   and name HN  ))
 OR { 1397}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 98   and name HN  ))
 ASSI { 1398}
   (( segid "    " and resid 105  and name HB1 ))
   (( segid "    " and resid 107  and name HN  ))
      5.300     3.500     0.700 peak  1398 weight  0.10000E+01 volume  0.95540E-04 ppm1      2.407 ppm2      7.953 CV     1
 OR { 1398}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 107  and name HN  ))
 OR { 1398}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 102  and name HN  ))
 ASSI { 1404}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 104  and name HB1 ))
      3.400     1.400     1.400 peak  1404 weight  0.10000E+01 volume  0.98231E-03 ppm1      2.406 ppm2      1.360 CV     1
 OR { 1404}
   (( segid "    " and resid 105  and name HB1 ))
   (( segid "    " and resid 104  and name HB1 ))
 OR { 1404}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 104  and name HG  ))
 OR { 1404}
   (( segid "    " and resid 105  and name HB1 ))
   (( segid "    " and resid 98   and name HB2 ))
 ASSI { 1406}
   (( segid "    " and resid 105  and name HB1 ))
   (  segid "    " and resid 4    and name HD1%)
      4.000     2.000     2.000 peak  1406 weight  0.10000E+01 volume  0.37792E-03 ppm1      2.405 ppm2      0.662 CV     1
 OR { 1406}
   (( segid "    " and resid 105  and name HB1 ))
   (( segid "    " and resid 98   and name HD2 ))
 OR { 1406}
   (( segid "    " and resid 105  and name HB1 ))
   (  segid "    " and resid 4    and name HD2%)
 OR { 1406}
   (( segid "    " and resid 105  and name HB2 ))
   (  segid "    " and resid 4    and name HD1%)
 OR { 1406}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 98   and name HD2 ))
 OR { 1406}
   (( segid "    " and resid 105  and name HB2 ))
   (  segid "    " and resid 4    and name HD2%)
 ASSI { 1410}
   (( segid "    " and resid 96   and name HB1 ))
   (( segid "    " and resid 36   and name HA  ))
      4.800     2.900     1.200 peak  1410 weight  0.10000E+01 volume  0.14478E-03 ppm1      2.384 ppm2      5.458 CV     1
 OR { 1410}
   (( segid "    " and resid 96   and name HB1 ))
   (( segid "    " and resid 22   and name HA  ))
 ASSI { 1414}
   (( segid "    " and resid 96   and name HB1 ))
   (  segid "    " and resid 79   and name HD1%)
      3.100     1.200     1.200 peak  1414 weight  0.10000E+01 volume  0.80874E-03 ppm1      2.390 ppm2      0.396 CV     1
 OR { 1414}
   (( segid "    " and resid 96   and name HB1 ))
   (  segid "    " and resid 104  and name HD2%)
 ASSI { 1415}
   (( segid "    " and resid 96   and name HB1 ))
   (  segid "    " and resid 4    and name HD1%)
      4.100     2.100     1.900 peak  1415 weight  0.10000E+01 volume  0.46956E-03 ppm1      2.391 ppm2      0.608 CV     1
 OR { 1415}
   (( segid "    " and resid 96   and name HB1 ))
   (  segid "    " and resid 37   and name HG2%)
 ASSI { 1416}
   (( segid "    " and resid 96   and name HB1 ))
   (( segid "    " and resid 79   and name HB2 ))
      4.000     2.000     2.000 peak  1416 weight  0.10000E+01 volume  0.36237E-03 ppm1      2.391 ppm2      1.084 CV     1
 OR { 1416}
   (( segid "    " and resid 96   and name HB1 ))
   (  segid "    " and resid 97   and name HB% )
 OR { 1416}
   (( segid "    " and resid 96   and name HB1 ))
   (  segid "    " and resid 24   and name HB% )
 OR { 1416}
   (( segid "    " and resid 96   and name HB1 ))
   (( segid "    " and resid 98   and name HG2 ))
 ASSI { 1417}
   (( segid "    " and resid 96   and name HB1 ))
   (( segid "    " and resid 4    and name HB1 ))
      4.500     2.600     1.500 peak  1417 weight  0.10000E+01 volume  0.18342E-03 ppm1      2.393 ppm2      1.438 CV     1
 OR { 1417}
   (( segid "    " and resid 96   and name HB1 ))
   (( segid "    " and resid 4    and name HB2 ))
 OR { 1417}
   (( segid "    " and resid 96   and name HB1 ))
   (( segid "    " and resid 98   and name HB1 ))
 ASSI { 1420}
   (( segid "    " and resid 60   and name HB1 ))
   (( segid "    " and resid 65   and name HN  ))
      4.400     2.400     1.600 peak  1420 weight  0.10000E+01 volume  0.19331E-03 ppm1      2.481 ppm2      7.302 CV     1
 OR { 1420}
   (( segid "    " and resid 60   and name HB1 ))
   (( segid "    " and resid 64   and name HN  ))
 ASSI { 1425}
   (( segid "    " and resid 60   and name HB1 ))
   (( segid "    " and resid 65   and name HG2 ))
      3.500     1.500     1.500 peak  1425 weight  0.10000E+01 volume  0.65651E-03 ppm1      2.497 ppm2      1.423 CV     1
 OR { 1425}
   (( segid "    " and resid 60   and name HB1 ))
   (( segid "    " and resid 65   and name HG1 ))
 OR { 1425}
   (( segid "    " and resid 60   and name HB1 ))
   (  segid "    " and resid 61   and name HB% )
 ASSI { 1430}
   (( segid "    " and resid 38   and name HD2 ))
   (( segid "    " and resid 93   and name HN  ))
      5.000     3.100     1.000 peak  1430 weight  0.10000E+01 volume  0.15053E-03 ppm1      2.548 ppm2      7.807 CV     1
 OR { 1430}
   (( segid "    " and resid 38   and name HD2 ))
   (( segid "    " and resid 91   and name HN  ))
 OR { 1430}
   (( segid "    " and resid 38   and name HD1 ))
   (( segid "    " and resid 93   and name HN  ))
 OR { 1430}
   (( segid "    " and resid 38   and name HD1 ))
   (( segid "    " and resid 48   and name HN  ))
 OR { 1430}
   (( segid "    " and resid 38   and name HD1 ))
   (( segid "    " and resid 91   and name HN  ))
 OR { 1430}
   (( segid "    " and resid 38   and name HD2 ))
   (( segid "    " and resid 48   and name HN  ))
 ASSI { 1436}
   (( segid "    " and resid 38   and name HD2 ))
   (  segid "    " and resid 92   and name HB% )
      3.000     1.100     1.100 peak  1436 weight  0.10000E+01 volume  0.15478E-02 ppm1      2.551 ppm2      1.086 CV     1
 OR { 1436}
   (( segid "    " and resid 38   and name HD1 ))
   (  segid "    " and resid 48   and name HG1%)
 OR { 1436}
   (( segid "    " and resid 38   and name HD1 ))
   (  segid "    " and resid 92   and name HB% )
 OR { 1436}
   (( segid "    " and resid 38   and name HD2 ))
   (  segid "    " and resid 48   and name HG1%)
 ASSI { 1448}
   (( segid "    " and resid 96   and name HB2 ))
   (  segid "    " and resid 4    and name HD1%)
      4.200     2.200     1.800 peak  1448 weight  0.10000E+01 volume  0.31293E-03 ppm1      1.816 ppm2      0.604 CV     1
 OR { 1448}
   (( segid "    " and resid 96   and name HB2 ))
   (  segid "    " and resid 37   and name HG2%)
 ASSI { 1449}
   (( segid "    " and resid 96   and name HB2 ))
   (  segid "    " and resid 79   and name HD1%)
      3.300     1.400     1.400 peak  1449 weight  0.10000E+01 volume  0.61291E-03 ppm1      1.824 ppm2      0.396 CV     1
 OR { 1449}
   (( segid "    " and resid 96   and name HB2 ))
   (( segid "    " and resid 98   and name HD1 ))
 OR { 1449}
   (( segid "    " and resid 96   and name HB2 ))
   (  segid "    " and resid 104  and name HD2%)
 OR { 1449}
   (( segid "    " and resid 96   and name HB2 ))
   (  segid "    " and resid 20   and name HG1%)
 ASSI { 1454}
   (( segid "    " and resid 98   and name HE2 ))
   (( segid "    " and resid 77   and name HD22))
      3.600     1.600     1.600 peak  1454 weight  0.10000E+01 volume  0.29298E-03 ppm1      1.907 ppm2      6.897 CV     1
 OR { 1454}
   (( segid "    " and resid 98   and name HE2 ))
   (( segid "    " and resid 107  and name HD1 ))
 OR { 1454}
   (( segid "    " and resid 98   and name HE2 ))
   (  segid "    " and resid 95   and name HD% )
 ASSI { 1458}
   (( segid "    " and resid 70   and name HB  ))
   (( segid "    " and resid 82   and name HN  ))
      6.000     5.300     0.000 peak  1458 weight  0.10000E+01 volume  0.22715E-04 ppm1      1.982 ppm2      8.865 CV     1
 OR { 1458}
   (( segid "    " and resid 70   and name HB  ))
   (( segid "    " and resid 69   and name HN  ))
 OR { 1458}
   (( segid "    " and resid 70   and name HB  ))
   (( segid "    " and resid 50   and name HN  ))
 ASSI { 1460}
   (( segid "    " and resid 70   and name HB  ))
   (( segid "    " and resid 49   and name HG  ))
      3.800     1.800     1.800 peak  1460 weight  0.10000E+01 volume  0.48363E-03 ppm1      1.979 ppm2      6.938 CV     1
 OR { 1460}
   (( segid "    " and resid 70   and name HB  ))
   (( segid "    " and resid 36   and name HD1 ))
 OR { 1460}
   (( segid "    " and resid 70   and name HB  ))
   (  segid "    " and resid 68   and name HD% )
 ASSI { 1462}
   (( segid "    " and resid 70   and name HB  ))
   (( segid "    " and resid 69   and name HA  ))
      5.500     3.700     0.500 peak  1462 weight  0.10000E+01 volume  0.11081E-03 ppm1      1.980 ppm2      5.144 CV     1
 OR { 1462}
   (( segid "    " and resid 70   and name HB  ))
   (( segid "    " and resid 58   and name HA  ))
 ASSI { 1463}
   (( segid "    " and resid 70   and name HB  ))
   (( segid "    " and resid 49   and name HB1 ))
      3.900     1.900     1.900 peak  1463 weight  0.10000E+01 volume  0.32318E-03 ppm1      1.983 ppm2      3.825 CV     1
 OR { 1463}
   (( segid "    " and resid 70   and name HB  ))
   (( segid "    " and resid 58   and name HB  ))
 OR { 1463}
   (( segid "    " and resid 70   and name HB  ))
   (( segid "    " and resid 69   and name HB  ))
 ASSI { 1470}
   (( segid "    " and resid 70   and name HB  ))
   (( segid "    " and resid 81   and name HG  ))
      5.000     3.200     1.000 peak  1470 weight  0.10000E+01 volume  0.79890E-04 ppm1      1.974 ppm2      0.451 CV     1
 OR { 1470}
   (( segid "    " and resid 70   and name HB  ))
   (  segid "    " and resid 79   and name HD1%)
 ASSI { 1471}
   (( segid "    " and resid 70   and name HB  ))
   (  segid "    " and resid 60   and name HE% )
      5.100     3.300     0.900 peak  1471 weight  0.10000E+01 volume  0.66948E-04 ppm1      1.979 ppm2      6.752 CV     1
 OR { 1471}
   (( segid "    " and resid 70   and name HB  ))
   (  segid "    " and resid 94   and name HE% )
 ASSI { 1478}
   (( segid "    " and resid 89   and name HG1 ))
   (( segid "    " and resid 87   and name HB1 ))
      2.900     1.000     1.000 peak  1478 weight  0.10000E+01 volume  0.16987E-02 ppm1      2.285 ppm2      1.606 CV     1
 OR { 1478}
   (( segid "    " and resid 89   and name HG1 ))
   (( segid "    " and resid 87   and name HG1 ))
 OR { 1478}
   (( segid "    " and resid 89   and name HG1 ))
   (( segid "    " and resid 87   and name HG2 ))
 OR { 1478}
   (( segid "    " and resid 89   and name HG1 ))
   (( segid "    " and resid 87   and name HD1 ))
 OR { 1478}
   (( segid "    " and resid 89   and name HG1 ))
   (( segid "    " and resid 87   and name HD2 ))
 OR { 1478}
   (( segid "    " and resid 127  and name HG2 ))
   (( segid "    " and resid 129  and name HB2 ))
 OR { 1478}
   (( segid "    " and resid 127  and name HG1 ))
   (( segid "    " and resid 129  and name HB2 ))
 OR { 1478}
   (( segid "    " and resid 127  and name HG2 ))
   (( segid "    " and resid 129  and name HG  ))
 OR { 1478}
   (( segid "    " and resid 127  and name HG1 ))
   (( segid "    " and resid 129  and name HG  ))
 OR { 1478}
   (( segid "    " and resid 127  and name HG2 ))
   (( segid "    " and resid 129  and name HB1 ))
 OR { 1478}
   (( segid "    " and resid 127  and name HG1 ))
   (( segid "    " and resid 129  and name HB1 ))
 ASSI { 1479}
   (( segid "    " and resid 127  and name HG2 ))
   (  segid "    " and resid 129  and name HD1%)
      3.700     1.700     1.700 peak  1479 weight  0.10000E+01 volume  0.53947E-03 ppm1      2.261 ppm2      0.855 CV     1
 OR { 1479}
   (( segid "    " and resid 127  and name HG1 ))
   (  segid "    " and resid 129  and name HD1%)
 OR { 1479}
   (( segid "    " and resid 127  and name HG2 ))
   (  segid "    " and resid 129  and name HD2%)
 OR { 1479}
   (( segid "    " and resid 127  and name HG1 ))
   (  segid "    " and resid 129  and name HD2%)
 OR { 1479}
   (( segid "    " and resid 126  and name HG2 ))
   (  segid "    " and resid 129  and name HD1%)
 ASSI { 1485}
   (( segid "    " and resid 87   and name HB2 ))
   (( segid "    " and resid 88   and name HN  ))
      4.100     2.100     1.900 peak  1485 weight  0.10000E+01 volume  0.17281E-03 ppm1      2.145 ppm2      9.152 CV     1
 OR { 1485}
   (( segid "    " and resid 87   and name HB2 ))
   (( segid "    " and resid 89   and name HN  ))
 ASSI { 1488}
   (( segid "    " and resid 87   and name HB2 ))
   (( segid "    " and resid 86   and name HA  ))
      4.800     2.800     1.200 peak  1488 weight  0.10000E+01 volume  0.21410E-03 ppm1      2.142 ppm2      3.940 CV     1
 OR { 1488}
   (( segid "    " and resid 46   and name HG2 ))
   (( segid "    " and resid 48   and name HA  ))
 OR { 1488}
   (( segid "    " and resid 87   and name HB2 ))
   (( segid "    " and resid 88   and name HB1 ))
 OR { 1488}
   (( segid "    " and resid 87   and name HB2 ))
   (( segid "    " and resid 88   and name HB2 ))
 ASSI { 1516}
   (( segid "    " and resid 39   and name HB1 ))
   (  segid "    " and resid 45   and name HD1%)
      3.700     1.700     1.700 peak  1516 weight  0.10000E+01 volume  0.65085E-03 ppm1      2.289 ppm2      0.333 CV     1
 OR { 1516}
   (( segid "    " and resid 39   and name HB1 ))
   (  segid "    " and resid 93   and name HG2%)
 OR { 1516}
   (( segid "    " and resid 39   and name HB1 ))
   (  segid "    " and resid 45   and name HD2%)
 ASSI { 1520}
   (( segid "    " and resid 109  and name HB2 ))
   (( segid "    " and resid 5    and name HA  ))
      3.000     1.200     1.200 peak  1520 weight  0.10000E+01 volume  0.13618E-02 ppm1      2.234 ppm2      4.860 CV     1
 OR { 1520}
   (( segid "    " and resid 14   and name HB1 ))
   (( segid "    " and resid 87   and name HA  ))
 OR { 1520}
   (( segid "    " and resid 14   and name HB1 ))
   (( segid "    " and resid 115  and name HA  ))
 ASSI { 1533}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 85   and name HB1 ))
      3.900     1.900     1.900 peak  1533 weight  0.10000E+01 volume  0.62119E-03 ppm1      2.181 ppm2      4.042 CV     1
 OR { 1533}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 64   and name HA  ))
 OR { 1533}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 83   and name HA  ))
 ASSI { 1551}
   (( segid "    " and resid 14   and name HG2 ))
   (( segid "    " and resid 115  and name HA  ))
      3.700     1.700     1.700 peak  1551 weight  0.10000E+01 volume  0.12141E-02 ppm1      2.134 ppm2      4.820 CV     1
 OR { 1551}
   (( segid "    " and resid 14   and name HG2 ))
   (( segid "    " and resid 87   and name HA  ))
 ASSI { 1570}
   (( segid "    " and resid 43   and name HB1 ))
   (( segid "    " and resid 44   and name HN  ))
      2.900     1.100     1.100 peak  1570 weight  0.10000E+01 volume  0.13055E-02 ppm1      2.029 ppm2      8.188 CV     1
 OR { 1570}
   (( segid "    " and resid 43   and name HB1 ))
   (( segid "    " and resid 45   and name HN  ))
 ASSI { 1573}
   (( segid "    " and resid 43   and name HB1 ))
   (( segid "    " and resid 44   and name HA2 ))
      4.800     2.800     1.200 peak  1573 weight  0.10000E+01 volume  0.19711E-03 ppm1      2.030 ppm2      4.262 CV     1
 OR { 1573}
   (( segid "    " and resid 43   and name HB1 ))
   (( segid "    " and resid 45   and name HA  ))
 ASSI { 1582}
   (( segid "    " and resid 72   and name HB1 ))
   (  segid "    " and resid 80   and name HD% )
      3.900     1.900     1.900 peak  1582 weight  0.10000E+01 volume  0.63384E-03 ppm1      1.978 ppm2      6.885 CV     1
 OR { 1582}
   (( segid "    " and resid 72   and name HB1 ))
   (  segid "    " and resid 80   and name HE% )
 OR { 1582}
   (( segid "    " and resid 72   and name HB1 ))
   (( segid "    " and resid 36   and name HD1 ))
 ASSI { 1586}
   (( segid "    " and resid 37   and name HB  ))
   (( segid "    " and resid 45   and name HA  ))
      4.700     2.800     1.300 peak  1586 weight  0.10000E+01 volume  0.10852E-03 ppm1      1.973 ppm2      4.241 CV     1
 OR { 1586}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 44   and name HA2 ))
 ASSI { 1595}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 44   and name HN  ))
      3.300     1.300     1.300 peak  1595 weight  0.10000E+01 volume  0.88375E-03 ppm1      1.966 ppm2      8.182 CV     1
 OR { 1595}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 45   and name HN  ))
 ASSI { 1600}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 44   and name HA1 ))
      4.300     2.400     1.700 peak  1600 weight  0.10000E+01 volume  0.24397E-03 ppm1      1.965 ppm2      3.735 CV     1
 OR { 1600}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 42   and name HA2 ))
 ASSI { 1601}
   (( segid "    " and resid 37   and name HB  ))
   (( segid "    " and resid 95   and name HB1 ))
      5.200     3.300     0.800 peak  1601 weight  0.10000E+01 volume  0.15662E-03 ppm1      1.957 ppm2      2.519 CV     1
 OR { 1601}
   (( segid "    " and resid 37   and name HB  ))
   (( segid "    " and resid 38   and name HD2 ))
 ASSI { 1605}
   (( segid "    " and resid 12   and name HB  ))
   (( segid "    " and resid 16   and name HN  ))
      4.900     2.900     1.100 peak  1605 weight  0.10000E+01 volume  0.16226E-03 ppm1      1.858 ppm2      8.422 CV     1
 OR { 1605}
   (( segid "    " and resid 12   and name HB  ))
   (( segid "    " and resid 116  and name HN  ))
 OR { 1605}
   (( segid "    " and resid 12   and name HB  ))
   (( segid "    " and resid 114  and name HN  ))
 ASSI { 1611}
   (( segid "    " and resid 12   and name HB  ))
   (( segid "    " and resid 18   and name HB2 ))
      4.200     2.200     1.800 peak  1611 weight  0.10000E+01 volume  0.29862E-03 ppm1      1.862 ppm2      1.283 CV     1
 OR { 1611}
   (( segid "    " and resid 12   and name HB  ))
   (( segid "    " and resid 86   and name HB2 ))
 OR { 1611}
   (( segid "    " and resid 12   and name HB  ))
   (( segid "    " and resid 18   and name HG  ))
 OR { 1611}
   (( segid "    " and resid 12   and name HB  ))
   (( segid "    " and resid 18   and name HB1 ))
 OR { 1611}
   (( segid "    " and resid 12   and name HB  ))
   (( segid "    " and resid 86   and name HG  ))
 ASSI { 1612}
   (( segid "    " and resid 12   and name HB  ))
   (  segid "    " and resid 86   and name HD1%)
      3.000     1.100     1.100 peak  1612 weight  0.10000E+01 volume  0.25119E-02 ppm1      1.861 ppm2      0.509 CV     1
 OR { 1612}
   (( segid "    " and resid 12   and name HB  ))
   (  segid "    " and resid 115  and name HG2%)
 ASSI { 1625}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 79   and name HA  ))
      4.200     2.200     1.800 peak  1625 weight  0.10000E+01 volume  0.17922E-03 ppm1      1.771 ppm2      4.973 CV     1
 OR { 1625}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 73   and name HA  ))
 ASSI { 1626}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 71   and name HA  ))
      3.400     1.400     1.400 peak  1626 weight  0.10000E+01 volume  0.41244E-03 ppm1      1.772 ppm2      4.687 CV     1
 OR { 1626}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 74   and name HA  ))
 ASSI { 1630}
   (( segid "    " and resid 72   and name HB2 ))
   (  segid "    " and resid 79   and name HD2%)
      2.800     1.000     1.000 peak  1630 weight  0.10000E+01 volume  0.27942E-02 ppm1      1.776 ppm2      0.947 CV     1
 OR { 1630}
   (( segid "    " and resid 72   and name HB2 ))
   (  segid "    " and resid 51   and name HG2%)
 ASSI { 1635}
   (( segid "    " and resid 39   and name HG2 ))
   (( segid "    " and resid 45   and name HA  ))
      3.800     1.900     1.900 peak  1635 weight  0.10000E+01 volume  0.28973E-03 ppm1      2.147 ppm2      4.231 CV     1
 OR { 1635}
   (( segid "    " and resid 39   and name HG2 ))
   (( segid "    " and resid 44   and name HA2 ))
 ASSI { 1637}
   (( segid "    " and resid 39   and name HG2 ))
   (  segid "    " and resid 45   and name HD1%)
      2.900     1.100     1.100 peak  1637 weight  0.10000E+01 volume  0.15825E-02 ppm1      2.138 ppm2      0.317 CV     1
 OR { 1637}
   (( segid "    " and resid 39   and name HG2 ))
   (  segid "    " and resid 93   and name HG2%)
 OR { 1637}
   (( segid "    " and resid 39   and name HG2 ))
   (  segid "    " and resid 45   and name HD2%)
 ASSI { 1642}
   (( segid "    " and resid 20   and name HB  ))
   (( segid "    " and resid 19   and name HG2 ))
      3.400     1.500     1.500 peak  1642 weight  0.10000E+01 volume  0.11782E-02 ppm1      2.074 ppm2      1.347 CV     1
 OR { 1642}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 38   and name HG1 ))
 OR { 1642}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 38   and name HG2 ))
 OR { 1642}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 45   and name HB2 ))
 OR { 1642}
   (( segid "    " and resid 20   and name HB  ))
   (( segid "    " and resid 18   and name HB1 ))
 OR { 1642}
   (( segid "    " and resid 20   and name HB  ))
   (( segid "    " and resid 83   and name HG1 ))
 OR { 1642}
   (( segid "    " and resid 20   and name HB  ))
   (( segid "    " and resid 19   and name HG1 ))
 OR { 1642}
   (( segid "    " and resid 46   and name HB2 ))
   (  segid "    " and resid 61   and name HB% )
 OR { 1642}
   (( segid "    " and resid 20   and name HB  ))
   (( segid "    " and resid 18   and name HG  ))
 OR { 1642}
   (( segid "    " and resid 20   and name HB  ))
   (( segid "    " and resid 18   and name HB2 ))
 ASSI { 1645}
   (( segid "    " and resid 20   and name HB  ))
   (  segid "    " and resid 113  and name HG1%)
      4.800     2.900     1.200 peak  1645 weight  0.10000E+01 volume  0.18319E-03 ppm1      2.074 ppm2      0.503 CV     1
 OR { 1645}
   (( segid "    " and resid 20   and name HB  ))
   (( segid "    " and resid 81   and name HG  ))
 ASSI { 1646}
   (( segid "    " and resid 20   and name HB  ))
   (( segid "    " and resid 81   and name HB1 ))
      3.800     1.800     1.800 peak  1646 weight  0.10000E+01 volume  0.67891E-03 ppm1      2.074 ppm2      0.669 CV     1
 OR { 1646}
   (( segid "    " and resid 20   and name HB  ))
   (  segid "    " and resid 81   and name HD1%)
 OR { 1646}
   (( segid "    " and resid 20   and name HB  ))
   (  segid "    " and resid 18   and name HD2%)
 OR { 1646}
   (( segid "    " and resid 20   and name HB  ))
   (  segid "    " and resid 113  and name HG2%)
 OR { 1646}
   (( segid "    " and resid 20   and name HB  ))
   (  segid "    " and resid 18   and name HD1%)
 ASSI { 1647}
   (( segid "    " and resid 20   and name HB  ))
   (  segid "    " and resid 111  and name HG2%)
      3.200     1.200     1.200 peak  1647 weight  0.10000E+01 volume  0.18253E-02 ppm1      2.077 ppm2      1.051 CV     1
 OR { 1647}
   (( segid "    " and resid 20   and name HB  ))
   (  segid "    " and resid 83   and name HE% )
 ASSI { 1648}
   (( segid "    " and resid 20   and name HB  ))
   (( segid "    " and resid 8    and name HA2 ))
      4.500     2.500     1.500 peak  1648 weight  0.10000E+01 volume  0.20400E-03 ppm1      2.079 ppm2      3.762 CV     1
 OR { 1648}
   (( segid "    " and resid 20   and name HB  ))
   (( segid "    " and resid 21   and name HB1 ))
 OR { 1648}
   (( segid "    " and resid 20   and name HB  ))
   (( segid "    " and resid 111  and name HB  ))
 ASSI { 1650}
   (( segid "    " and resid 20   and name HB  ))
   (  segid "    " and resid 94   and name HD% )
      3.700     1.700     1.700 peak  1650 weight  0.10000E+01 volume  0.71874E-03 ppm1      2.060 ppm2      6.956 CV     1
 OR { 1650}
   (( segid "    " and resid 20   and name HB  ))
   (( segid "    " and resid 36   and name HZ2 ))
 ASSI { 1713}
   (( segid "    " and resid 79   and name HG  ))
   (( segid "    " and resid 36   and name HZ2 ))
      3.800     1.800     1.800 peak  1713 weight  0.10000E+01 volume  0.76675E-03 ppm1      1.751 ppm2      6.935 CV     1
 OR { 1713}
   (( segid "    " and resid 79   and name HG  ))
   (( segid "    " and resid 36   and name HD1 ))
 OR { 1713}
   (( segid "    " and resid 79   and name HG  ))
   (  segid "    " and resid 80   and name HD% )
 ASSI { 1721}
   (( segid "    " and resid 14   and name HG1 ))
   (  segid "    " and resid 115  and name HG1%)
      4.700     2.800     1.300 peak  1721 weight  0.10000E+01 volume  0.20605E-03 ppm1      1.749 ppm2      0.599 CV     1
 OR { 1721}
   (( segid "    " and resid 79   and name HG  ))
   (  segid "    " and resid 78   and name HG2%)
 ASSI { 1722}
   (( segid "    " and resid 14   and name HG1 ))
   (  segid "    " and resid 12   and name HG1%)
      4.700     2.700     1.300 peak  1722 weight  0.10000E+01 volume  0.16871E-03 ppm1      1.748 ppm2      0.739 CV     1
 OR { 1722}
   (( segid "    " and resid 79   and name HG  ))
   (( segid "    " and resid 81   and name HB1 ))
 ASSI { 1724}
   (  segid "    " and resid 6    and name HB% )
   (  segid "    " and resid 20   and name HG1%)
      3.900     1.900     1.900 peak  1724 weight  0.10000E+01 volume  0.55161E-03 ppm1      1.784 ppm2      0.350 CV     1
 OR { 1724}
   (  segid "    " and resid 6    and name HB% )
   (  segid "    " and resid 93   and name HG2%)
 OR { 1724}
   (  segid "    " and resid 6    and name HB% )
   (  segid "    " and resid 45   and name HD1%)
 ASSI { 1725}
   (  segid "    " and resid 6    and name HB% )
   (  segid "    " and resid 113  and name HG1%)
      4.000     2.000     2.000 peak  1725 weight  0.10000E+01 volume  0.56458E-03 ppm1      1.781 ppm2      0.549 CV     1
 OR { 1725}
   (  segid "    " and resid 6    and name HB% )
   (  segid "    " and resid 4    and name HD1%)
 OR { 1725}
   (  segid "    " and resid 6    and name HB% )
   (  segid "    " and resid 37   and name HG2%)
 OR { 1725}
   (  segid "    " and resid 6    and name HB% )
   (  segid "    " and resid 113  and name HG2%)
 ASSI { 1727}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 109  and name HB2 ))
      3.500     1.500     1.500 peak  1727 weight  0.10000E+01 volume  0.88076E-03 ppm1      1.780 ppm2      2.323 CV     1
 OR { 1727}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 96   and name HB1 ))
 OR { 1727}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 109  and name HB1 ))
 OR { 1727}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 5    and name HG2 ))
 OR { 1727}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 5    and name HG1 ))
 ASSI { 1728}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 110  and name HA2 ))
      3.200     1.300     1.300 peak  1728 weight  0.10000E+01 volume  0.85790E-03 ppm1      1.782 ppm2      2.657 CV     1
 OR { 1728}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 109  and name HG1 ))
 ASSI { 1729}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 22   and name HB1 ))
      3.400     1.400     1.400 peak  1729 weight  0.10000E+01 volume  0.86356E-03 ppm1      1.784 ppm2      2.897 CV     1
 OR { 1729}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 94   and name HB1 ))
 OR { 1729}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 94   and name HB2 ))
 ASSI { 1730}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 22   and name HB2 ))
      3.600     1.600     1.600 peak  1730 weight  0.10000E+01 volume  0.75116E-03 ppm1      1.784 ppm2      3.007 CV     1
 OR { 1730}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 22   and name HB1 ))
 OR { 1730}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 94   and name HB2 ))
 ASSI { 1733}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 95   and name HA  ))
      3.400     1.500     1.500 peak  1733 weight  0.10000E+01 volume  0.13635E-02 ppm1      1.782 ppm2      4.886 CV     1
 OR { 1733}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 5    and name HA  ))
 OR { 1733}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 111  and name HA  ))
 ASSI { 1736}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 36   and name HH2 ))
      2.900     1.000     1.000 peak  1736 weight  0.10000E+01 volume  0.19812E-02 ppm1      1.781 ppm2      6.736 CV     1
 OR { 1736}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 36   and name HZ3 ))
 OR { 1736}
   (  segid "    " and resid 6    and name HB% )
   (  segid "    " and resid 95   and name HE% )
 ASSI { 1737}
   (  segid "    " and resid 6    and name HB% )
   (  segid "    " and resid 95   and name HD% )
      3.000     1.100     1.100 peak  1737 weight  0.10000E+01 volume  0.23256E-02 ppm1      1.781 ppm2      6.916 CV     1
 OR { 1737}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 36   and name HZ2 ))
 OR { 1737}
   (  segid "    " and resid 6    and name HB% )
   (  segid "    " and resid 94   and name HD% )
 ASSI { 1740}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 23   and name HN  ))
      4.200     2.200     1.800 peak  1740 weight  0.10000E+01 volume  0.38017E-03 ppm1      1.783 ppm2      8.333 CV     1
 OR { 1740}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 5    and name HN  ))
 ASSI { 1742}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 111  and name HN  ))
      3.100     1.200     1.200 peak  1742 weight  0.10000E+01 volume  0.14045E-02 ppm1      1.782 ppm2      8.814 CV     1
 OR { 1742}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 96   and name HN  ))
 ASSI { 1743}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 22   and name HN  ))
      5.000     3.100     1.000 peak  1743 weight  0.10000E+01 volume  0.15733E-03 ppm1      1.783 ppm2      9.137 CV     1
 OR { 1743}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 94   and name HN  ))
 ASSI { 1767}
   (( segid "    " and resid 82   and name HB1 ))
   (( segid "    " and resid 19   and name HA  ))
      6.000     6.000     0.000 peak  1767 weight  0.10000E+01 volume  0.21433E-04 ppm1      1.976 ppm2      5.116 CV     1
 OR { 1767}
   (( segid "    " and resid 82   and name HB1 ))
   (( segid "    " and resid 84   and name HA  ))
 ASSI { 1785}
   (( segid "    " and resid 46   and name HB1 ))
   (  segid "    " and resid 48   and name HG2%)
      4.500     2.500     1.500 peak  1785 weight  0.10000E+01 volume  0.22225E-03 ppm1      1.858 ppm2      0.822 CV     1
 OR { 1785}
   (( segid "    " and resid 46   and name HB1 ))
   (  segid "    " and resid 48   and name HG2%)
 OR { 1785}
   (( segid "    " and resid 46   and name HB1 ))
   (  segid "    " and resid 37   and name HG1%)
 ASSI { 1794}
   (( segid "    " and resid 82   and name HG1 ))
   (( segid "    " and resid 69   and name HB  ))
      3.700     1.700     1.700 peak  1794 weight  0.10000E+01 volume  0.67758E-03 ppm1      2.352 ppm2      3.821 CV     1
 OR { 1794}
   (( segid "    " and resid 113  and name HB  ))
   (( segid "    " and resid 9    and name HA1 ))
 OR { 1794}
   (( segid "    " and resid 113  and name HB  ))
   (( segid "    " and resid 114  and name HB  ))
 ASSI { 1803}
   (( segid "    " and resid 112  and name HG2 ))
   (  segid "    " and resid 40   and name HB% )
      3.800     1.800     1.800 peak  1803 weight  0.10000E+01 volume  0.29646E-03 ppm1      2.262 ppm2      1.467 CV     1
 OR { 1803}
   (( segid "    " and resid 112  and name HG2 ))
   (( segid "    " and resid 11   and name HG  ))
 OR { 1803}
   (( segid "    " and resid 112  and name HG2 ))
   (( segid "    " and resid 11   and name HB1 ))
 ASSI { 1819}
   (( segid "    " and resid 34   and name HB2 ))
   (  segid "    " and resid 51   and name HG2%)
      2.800     1.000     1.000 peak  1819 weight  0.10000E+01 volume  0.33504E-02 ppm1      1.715 ppm2      0.923 CV     1
 OR { 1819}
   (( segid "    " and resid 34   and name HB2 ))
   (  segid "    " and resid 79   and name HD2%)
 ASSI { 1831}
   (( segid "    " and resid 48   and name HB  ))
   (  segid "    " and resid 64   and name HG1%)
      3.900     1.900     1.900 peak  1831 weight  0.10000E+01 volume  0.36324E-03 ppm1      1.969 ppm2      0.166 CV     1
 OR { 1831}
   (( segid "    " and resid 48   and name HB  ))
   (  segid "    " and resid 81   and name HD2%)
 ASSI { 1838}
   (( segid "    " and resid 76   and name HB1 ))
   (  segid "    " and resid 78   and name HG2%)
      4.100     2.100     1.900 peak  1838 weight  0.10000E+01 volume  0.58785E-03 ppm1      2.008 ppm2      0.649 CV     1
 OR { 1838}
   (( segid "    " and resid 112  and name HG1 ))
   (  segid "    " and resid 113  and name HG2%)
 ASSI { 1876}
   (( segid "    " and resid 93   and name HB  ))
   (( segid "    " and resid 112  and name HE21))
      3.800     1.800     1.800 peak  1876 weight  0.10000E+01 volume  0.72747E-03 ppm1      1.977 ppm2      6.705 CV     1
 OR { 1876}
   (( segid "    " and resid 93   and name HB  ))
   (  segid "    " and resid 94   and name HE% )
 OR { 1876}
   (( segid "    " and resid 93   and name HB  ))
   (( segid "    " and resid 36   and name HZ3 ))
 ASSI { 1880}
   (( segid "    " and resid 93   and name HB  ))
   (( segid "    " and resid 112  and name HG2 ))
      2.700     0.900     0.900 peak  1880 weight  0.10000E+01 volume  0.27932E-02 ppm1      1.978 ppm2      2.265 CV     1
 OR { 1880}
   (( segid "    " and resid 93   and name HB  ))
   (( segid "    " and resid 39   and name HB1 ))
 ASSI { 1888}
   (( segid "    " and resid 39   and name HB2 ))
   (  segid "    " and resid 45   and name HD1%)
      3.100     1.200     1.200 peak  1888 weight  0.10000E+01 volume  0.10887E-02 ppm1      1.742 ppm2      0.329 CV     1
 OR { 1888}
   (( segid "    " and resid 39   and name HB2 ))
   (  segid "    " and resid 93   and name HG2%)
 OR { 1888}
   (( segid "    " and resid 39   and name HB2 ))
   (  segid "    " and resid 45   and name HD2%)
 ASSI { 1920}
   (( segid "    " and resid 4    and name HB2 ))
   (( segid "    " and resid 3    and name HG2 ))
      4.800     2.800     1.200 peak  1920 weight  0.10000E+01 volume  0.17692E-03 ppm1      1.470 ppm2      2.310 CV     1
 OR { 1920}
   (( segid "    " and resid 4    and name HB1 ))
   (( segid "    " and resid 5    and name HG1 ))
 OR { 1920}
   (( segid "    " and resid 4    and name HB1 ))
   (( segid "    " and resid 5    and name HG2 ))
 OR { 1920}
   (( segid "    " and resid 4    and name HB2 ))
   (( segid "    " and resid 5    and name HG1 ))
 OR { 1920}
   (( segid "    " and resid 4    and name HB2 ))
   (( segid "    " and resid 5    and name HG2 ))
 OR { 1920}
   (( segid "    " and resid 4    and name HB2 ))
   (( segid "    " and resid 109  and name HB1 ))
 ASSI { 1931}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 46   and name HN  ))
      4.000     2.000     2.000 peak  1931 weight  0.10000E+01 volume  0.29691E-03 ppm1      1.400 ppm2      9.376 CV     1
 OR { 1931}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 38   and name HN  ))
 ASSI { 1937}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 16   and name HN  ))
      3.800     1.800     1.800 peak  1937 weight  0.10000E+01 volume  0.25360E-03 ppm1      1.441 ppm2      8.428 CV     1
 OR { 1937}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 115  and name HN  ))
 ASSI { 1947}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 3    and name HN  ))
      3.800     1.800     1.800 peak  1947 weight  0.10000E+01 volume  0.54880E-03 ppm1      1.058 ppm2      8.444 CV     1
 OR { 1947}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 79   and name HN  ))
 ASSI { 1952}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 27   and name HN  ))
      4.200     2.200     1.800 peak  1952 weight  0.10000E+01 volume  0.25139E-03 ppm1      1.058 ppm2      7.488 CV     1
 OR { 1952}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 78   and name HN  ))
 ASSI { 1954}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 28   and name HA  ))
      4.400     2.400     1.600 peak  1954 weight  0.10000E+01 volume  0.30193E-03 ppm1      1.054 ppm2      4.266 CV     1
 OR { 1954}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 29   and name HA  ))
 OR { 1954}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 28   and name HB  ))
 ASSI { 1955}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 77   and name HA  ))
      4.700     2.800     1.300 peak  1955 weight  0.10000E+01 volume  0.15037E-03 ppm1      1.056 ppm2      3.786 CV     1
 OR { 1955}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 26   and name HA1 ))
 ASSI { 1956}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 29   and name HB2 ))
      3.500     1.500     1.500 peak  1956 weight  0.10000E+01 volume  0.10288E-02 ppm1      1.053 ppm2      3.063 CV     1
 OR { 1956}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 27   and name HB1 ))
 ASSI { 1957}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 27   and name HB2 ))
      3.200     1.300     1.300 peak  1957 weight  0.10000E+01 volume  0.11049E-02 ppm1      1.054 ppm2      2.871 CV     1
 OR { 1957}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 77   and name HB2 ))
 OR { 1957}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 29   and name HB1 ))
 ASSI { 1959}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 96   and name HB1 ))
      3.700     1.700     1.700 peak  1959 weight  0.10000E+01 volume  0.33799E-03 ppm1      1.055 ppm2      2.301 CV     1
 OR { 1959}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 3    and name HG2 ))
 OR { 1959}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 3    and name HG1 ))
 OR { 1959}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 5    and name HG1 ))
 OR { 1959}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 5    and name HG2 ))
 ASSI { 1960}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 98   and name HE2 ))
      3.500     1.500     1.500 peak  1960 weight  0.10000E+01 volume  0.67753E-03 ppm1      1.054 ppm2      1.958 CV     1
 OR { 1960}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 2    and name HB  ))
 OR { 1960}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 34   and name HB1 ))
 ASSI { 1961}
   (  segid "    " and resid 24   and name HB% )
   (  segid "    " and resid 34   and name HE% )
      3.600     1.600     1.600 peak  1961 weight  0.10000E+01 volume  0.54218E-03 ppm1      1.053 ppm2      1.761 CV     1
 OR { 1961}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 98   and name HE1 ))
 OR { 1961}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 79   and name HB1 ))
 ASSI { 1962}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 4    and name HG  ))
      2.900     1.100     1.100 peak  1962 weight  0.10000E+01 volume  0.22882E-02 ppm1      1.053 ppm2      1.403 CV     1
 OR { 1962}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 4    and name HB1 ))
 OR { 1962}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 4    and name HB2 ))
 OR { 1962}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 98   and name HB1 ))
 ASSI { 1963}
   (  segid "    " and resid 24   and name HB% )
   (  segid "    " and resid 4    and name HD2%)
      2.500     0.800     0.800 peak  1963 weight  0.10000E+01 volume  0.54692E-02 ppm1      1.054 ppm2      0.677 CV     1
 OR { 1963}
   (  segid "    " and resid 24   and name HB% )
   (  segid "    " and resid 4    and name HD1%)
 OR { 1963}
   (  segid "    " and resid 24   and name HB% )
   (  segid "    " and resid 2    and name HG1%)
 OR { 1963}
   (  segid "    " and resid 24   and name HB% )
   (  segid "    " and resid 78   and name HG2%)
 ASSI { 1969}
   (( segid "    " and resid 18   and name HB2 ))
   (( segid "    " and resid 17   and name HB2 ))
      4.800     2.900     1.200 peak  1969 weight  0.10000E+01 volume  0.18400E-03 ppm1      1.299 ppm2      3.723 CV     1
 OR { 1969}
   (( segid "    " and resid 18   and name HB1 ))
   (( segid "    " and resid 17   and name HB2 ))
 OR { 1969}
   (( segid "    " and resid 18   and name HB2 ))
   (( segid "    " and resid 17   and name HB1 ))
 OR { 1969}
   (( segid "    " and resid 18   and name HB1 ))
   (( segid "    " and resid 17   and name HB1 ))
 OR { 1969}
   (( segid "    " and resid 18   and name HB1 ))
   (( segid "    " and resid 16   and name HA1 ))
 ASSI { 1970}
   (( segid "    " and resid 18   and name HB1 ))
   (( segid "    " and resid 83   and name HB2 ))
      3.800     1.800     1.800 peak  1970 weight  0.10000E+01 volume  0.10003E-02 ppm1      1.298 ppm2      1.761 CV     1
 OR { 1970}
   (( segid "    " and resid 18   and name HB2 ))
   (( segid "    " and resid 83   and name HB2 ))
 OR { 1970}
   (( segid "    " and resid 18   and name HB1 ))
   (( segid "    " and resid 19   and name HB1 ))
 OR { 1970}
   (( segid "    " and resid 18   and name HB2 ))
   (( segid "    " and resid 19   and name HB1 ))
 ASSI { 1971}
   (( segid "    " and resid 18   and name HB1 ))
   (  segid "    " and resid 83   and name HE% )
      2.700     0.900     0.900 peak  1971 weight  0.10000E+01 volume  0.23817E-02 ppm1      1.298 ppm2      0.971 CV     1
 OR { 1971}
   (( segid "    " and resid 18   and name HB2 ))
   (  segid "    " and resid 83   and name HE% )
 OR { 1971}
   (( segid "    " and resid 18   and name HB2 ))
   (  segid "    " and resid 86   and name HD2%)
 OR { 1971}
   (( segid "    " and resid 18   and name HB1 ))
   (  segid "    " and resid 86   and name HD2%)
 OR { 1971}
   (( segid "    " and resid 18   and name HB2 ))
   (( segid "    " and resid 83   and name HB1 ))
 ASSI { 1989}
   (( segid "    " and resid 98   and name HB2 ))
   (( segid "    " and resid 32   and name HB2 ))
      5.400     3.700     0.600 peak  1989 weight  0.10000E+01 volume  0.60206E-04 ppm1      1.371 ppm2      2.703 CV     1
 OR { 1989}
   (( segid "    " and resid 98   and name HB2 ))
   (( segid "    " and resid 99   and name HB1 ))
 OR { 1989}
   (( segid "    " and resid 98   and name HB2 ))
   (( segid "    " and resid 99   and name HB2 ))
 ASSI { 1994}
   (( segid "    " and resid 98   and name HB1 ))
   (  segid "    " and resid 97   and name HB% )
      3.700     1.700     1.700 peak  1994 weight  0.10000E+01 volume  0.98286E-03 ppm1      1.466 ppm2      1.168 CV     1
 OR { 1994}
   (( segid "    " and resid 98   and name HB1 ))
   (( segid "    " and resid 104  and name HB2 ))
 ASSI { 2000}
   (( segid "    " and resid 87   and name HB1 ))
   (( segid "    " and resid 86   and name HA  ))
      4.800     2.900     1.200 peak  2000 weight  0.10000E+01 volume  0.20682E-03 ppm1      1.635 ppm2      3.910 CV     1
 OR { 2000}
   (( segid "    " and resid 87   and name HB1 ))
   (( segid "    " and resid 88   and name HB1 ))
 OR { 2000}
   (( segid "    " and resid 87   and name HB1 ))
   (( segid "    " and resid 88   and name HB2 ))
 ASSI { 2019}
   (( segid "    " and resid 83   and name HG1 ))
   (  segid "    " and resid 81   and name HD1%)
      3.100     1.200     1.200 peak  2019 weight  0.10000E+01 volume  0.92537E-03 ppm1      1.346 ppm2      0.653 CV     1
 OR { 2019}
   (( segid "    " and resid 83   and name HG1 ))
   (  segid "    " and resid 113  and name HG2%)
 ASSI { 2020}
   (( segid "    " and resid 83   and name HG1 ))
   (( segid "    " and resid 81   and name HG  ))
      3.500     1.500     1.500 peak  2020 weight  0.10000E+01 volume  0.92169E-03 ppm1      1.346 ppm2      0.472 CV     1
 OR { 2020}
   (( segid "    " and resid 83   and name HG1 ))
   (  segid "    " and resid 86   and name HD1%)
 OR { 2020}
   (( segid "    " and resid 83   and name HG1 ))
   (  segid "    " and resid 113  and name HG1%)
 ASSI { 2025}
   (( segid "    " and resid 67   and name HB1 ))
   (( segid "    " and resid 85   and name HB1 ))
      4.600     2.700     1.400 peak  2025 weight  0.10000E+01 volume  0.25328E-03 ppm1      1.617 ppm2      4.048 CV     1
 OR { 2025}
   (( segid "    " and resid 67   and name HB1 ))
   (( segid "    " and resid 64   and name HA  ))
 ASSI { 2032}
   (( segid "    " and resid 70   and name HG12))
   (( segid "    " and resid 36   and name HD1 ))
      5.100     3.300     0.900 peak  2032 weight  0.10000E+01 volume  0.25221E-03 ppm1      1.267 ppm2      6.932 CV     1
 OR { 2032}
   (( segid "    " and resid 70   and name HG12))
   (( segid "    " and resid 49   and name HG  ))
 ASSI { 2038}
   (( segid "    " and resid 129  and name HG  ))
   (( segid "    " and resid 128  and name HB1 ))
      5.000     3.100     1.000 peak  2038 weight  0.10000E+01 volume  0.11183E-03 ppm1      1.610 ppm2      2.673 CV     1
 OR { 2038}
   (( segid "    " and resid 129  and name HG  ))
   (( segid "    " and resid 130  and name HB2 ))
 OR { 2038}
   (( segid "    " and resid 129  and name HG  ))
   (( segid "    " and resid 130  and name HB1 ))
 ASSI { 2055}
   (( segid "    " and resid 72   and name HG1 ))
   (  segid "    " and resid 51   and name HD1%)
      3.600     1.600     1.600 peak  2055 weight  0.10000E+01 volume  0.91797E-03 ppm1      1.614 ppm2      0.868 CV     1
 OR { 2055}
   (( segid "    " and resid 72   and name HG1 ))
   (  segid "    " and resid 79   and name HD2%)
 ASSI { 2060}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 97   and name HN  ))
      3.600     1.600     1.600 peak  2060 weight  0.10000E+01 volume  0.61567E-03 ppm1      1.467 ppm2      8.524 CV     1
 OR { 2060}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 99   and name HN  ))
 ASSI { 2062}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 49   and name HN  ))
      3.600     1.600     1.600 peak  2062 weight  0.10000E+01 volume  0.88959E-03 ppm1      1.468 ppm2      7.137 CV     1
 OR { 2062}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 47   and name HZ2 ))
 ASSI { 2066}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 50   and name HA  ))
      3.200     1.300     1.300 peak  2066 weight  0.10000E+01 volume  0.11160E-02 ppm1      1.469 ppm2      5.537 CV     1
 OR { 2066}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 36   and name HA  ))
 ASSI { 2068}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 47   and name HB2 ))
      4.400     2.400     1.600 peak  2068 weight  0.10000E+01 volume  0.32245E-03 ppm1      1.473 ppm2      3.264 CV     1
 OR { 2068}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 33   and name HB1 ))
 OR { 2068}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 47   and name HB1 ))
 ASSI { 2069}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 36   and name HB2 ))
      3.500     1.500     1.500 peak  2069 weight  0.10000E+01 volume  0.13767E-02 ppm1      1.468 ppm2      2.701 CV     1
 OR { 2069}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 99   and name HB1 ))
 OR { 2069}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 99   and name HB2 ))
 OR { 2069}
   (( segid "    " and resid 76   and name HG2 ))
   (( segid "    " and resid 73   and name HB2 ))
 ASSI { 2072}
   (  segid "    " and resid 35   and name HB% )
   (  segid "    " and resid 50   and name HG2%)
      2.300     0.700     0.700 peak  2072 weight  0.10000E+01 volume  0.88922E-02 ppm1      1.470 ppm2      1.151 CV     1
 OR { 2072}
   (  segid "    " and resid 35   and name HB% )
   (  segid "    " and resid 97   and name HB% )
 ASSI { 2073}
   (  segid "    " and resid 35   and name HB% )
   (  segid "    " and resid 104  and name HD1%)
      2.900     1.100     1.100 peak  2073 weight  0.10000E+01 volume  0.17962E-02 ppm1      1.468 ppm2      0.576 CV     1
 OR { 2073}
   (  segid "    " and resid 35   and name HB% )
   (  segid "    " and resid 37   and name HG2%)
 ASSI { 2075}
   (  segid "    " and resid 35   and name HB% )
   (  segid "    " and resid 37   and name HG1%)
      2.900     1.000     1.000 peak  2075 weight  0.10000E+01 volume  0.20148E-02 ppm1      1.448 ppm2      0.830 CV     1
 OR { 2075}
   (  segid "    " and resid 35   and name HB% )
   (  segid "    " and resid 79   and name HD2%)
 ASSI { 2077}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 104  and name HA  ))
      4.500     2.600     1.500 peak  2077 weight  0.10000E+01 volume  0.19607E-03 ppm1      1.473 ppm2      3.893 CV     1
 OR { 2077}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 48   and name HA  ))
 ASSI { 2078}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 37   and name HA  ))
      3.700     1.700     1.700 peak  2078 weight  0.10000E+01 volume  0.76946E-03 ppm1      1.468 ppm2      5.012 CV     1
 OR { 2078}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 49   and name HA  ))
 OR { 2078}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 99   and name HA  ))
 ASSI { 2082}
   (( segid "    " and resid 87   and name HG1 ))
   (( segid "    " and resid 86   and name HA  ))
      4.000     2.000     2.000 peak  2082 weight  0.10000E+01 volume  0.25750E-03 ppm1      1.504 ppm2      3.902 CV     1
 OR { 2082}
   (( segid "    " and resid 87   and name HG2 ))
   (( segid "    " and resid 86   and name HA  ))
 OR { 2082}
   (( segid "    " and resid 87   and name HG1 ))
   (( segid "    " and resid 88   and name HB1 ))
 OR { 2082}
   (( segid "    " and resid 87   and name HG2 ))
   (( segid "    " and resid 88   and name HB1 ))
 OR { 2082}
   (( segid "    " and resid 87   and name HG2 ))
   (( segid "    " and resid 88   and name HB2 ))
 OR { 2082}
   (( segid "    " and resid 87   and name HG1 ))
   (( segid "    " and resid 88   and name HB2 ))
 ASSI { 2085}
   (( segid "    " and resid 65   and name HG2 ))
   (( segid "    " and resid 66   and name HN  ))
      4.000     2.000     2.000 peak  2085 weight  0.10000E+01 volume  0.37587E-03 ppm1      1.428 ppm2      9.055 CV     1
 OR { 2085}
   (( segid "    " and resid 65   and name HG2 ))
   (( segid "    " and resid 62   and name HN  ))
 OR { 2085}
   (( segid "    " and resid 65   and name HG1 ))
   (( segid "    " and resid 66   and name HN  ))
 OR { 2085}
   (( segid "    " and resid 65   and name HG1 ))
   (( segid "    " and resid 62   and name HN  ))
 ASSI { 2086}
   (( segid "    " and resid 43   and name HG1 ))
   (( segid "    " and resid 44   and name HN  ))
      5.100     3.300     0.900 peak  2086 weight  0.10000E+01 volume  0.10558E-03 ppm1      1.431 ppm2      8.186 CV     1
 OR { 2086}
   (( segid "    " and resid 65   and name HG1 ))
   (( segid "    " and resid 63   and name HN  ))
 ASSI { 2103}
   (( segid "    " and resid 11   and name HG  ))
   (( segid "    " and resid 114  and name HN  ))
      5.400     3.600     0.600 peak  2103 weight  0.10000E+01 volume  0.50594E-04 ppm1      1.451 ppm2      8.461 CV     1
 OR { 2103}
   (( segid "    " and resid 11   and name HG  ))
   (( segid "    " and resid 116  and name HN  ))
 ASSI { 2112}
   (( segid "    " and resid 19   and name HG1 ))
   (( segid "    " and resid 82   and name HA  ))
      3.200     1.300     1.300 peak  2112 weight  0.10000E+01 volume  0.61342E-03 ppm1      1.360 ppm2      4.200 CV     1
 OR { 2112}
   (( segid "    " and resid 4    and name HG  ))
   (( segid "    " and resid 108  and name HA2 ))
 ASSI { 2116}
   (( segid "    " and resid 45   and name HG  ))
   (( segid "    " and resid 46   and name HN  ))
      4.100     2.100     1.900 peak  2116 weight  0.10000E+01 volume  0.33353E-03 ppm1      1.262 ppm2      9.380 CV     1
 OR { 2116}
   (( segid "    " and resid 45   and name HG  ))
   (( segid "    " and resid 38   and name HN  ))
 ASSI { 2118}
   (( segid "    " and resid 45   and name HG  ))
   (  segid "    " and resid 95   and name HE% )
      4.200     2.300     1.800 peak  2118 weight  0.10000E+01 volume  0.34923E-03 ppm1      1.261 ppm2      6.765 CV     1
 OR { 2118}
   (( segid "    " and resid 19   and name HG2 ))
   (( segid "    " and resid 36   and name HH2 ))
 ASSI { 2121}
   (( segid "    " and resid 19   and name HG2 ))
   (( segid "    " and resid 21   and name HN  ))
      5.400     3.600     0.600 peak  2121 weight  0.10000E+01 volume  0.98907E-04 ppm1      1.263 ppm2      8.835 CV     1
 OR { 2121}
   (( segid "    " and resid 19   and name HG2 ))
   (( segid "    " and resid 83   and name HN  ))
 OR { 2121}
   (( segid "    " and resid 19   and name HG2 ))
   (( segid "    " and resid 82   and name HN  ))
 ASSI { 2125}
   (( segid "    " and resid 45   and name HG  ))
   (( segid "    " and resid 37   and name HB  ))
      2.700     0.900     0.900 peak  2125 weight  0.10000E+01 volume  0.20506E-02 ppm1      1.270 ppm2      1.933 CV     1
 OR { 2125}
   (( segid "    " and resid 19   and name HG2 ))
   (( segid "    " and resid 82   and name HB2 ))
 OR { 2125}
   (( segid "    " and resid 19   and name HG2 ))
   (( segid "    " and resid 82   and name HB1 ))
 ASSI { 2134}
   (( segid "    " and resid 67   and name HG2 ))
   (( segid "    " and resid 85   and name HB1 ))
      5.300     3.500     0.700 peak  2134 weight  0.10000E+01 volume  0.11166E-03 ppm1      1.452 ppm2      4.049 CV     1
 OR { 2134}
   (( segid "    " and resid 67   and name HG2 ))
   (( segid "    " and resid 64   and name HA  ))
 ASSI { 2144}
   (( segid "    " and resid 86   and name HG  ))
   (( segid "    " and resid 16   and name HN  ))
      4.600     2.600     1.400 peak  2144 weight  0.10000E+01 volume  0.11402E-03 ppm1      1.287 ppm2      8.433 CV     1
 OR { 2144}
   (( segid "    " and resid 86   and name HG  ))
   (( segid "    " and resid 90   and name HN  ))
 OR { 2144}
   (( segid "    " and resid 86   and name HG  ))
   (( segid "    " and resid 115  and name HN  ))
 OR { 2144}
   (( segid "    " and resid 86   and name HG  ))
   (( segid "    " and resid 116  and name HN  ))
 ASSI { 2148}
   (( segid "    " and resid 86   and name HG  ))
   (( segid "    " and resid 85   and name HA  ))
      3.900     1.900     1.900 peak  2148 weight  0.10000E+01 volume  0.12598E-03 ppm1      1.276 ppm2      3.700 CV     1
 OR { 2148}
   (( segid "    " and resid 86   and name HG  ))
   (( segid "    " and resid 16   and name HA1 ))
 OR { 2148}
   (( segid "    " and resid 86   and name HG  ))
   (( segid "    " and resid 17   and name HB1 ))
 OR { 2148}
   (( segid "    " and resid 86   and name HG  ))
   (( segid "    " and resid 85   and name HB2 ))
 OR { 2148}
   (( segid "    " and resid 86   and name HG  ))
   (( segid "    " and resid 17   and name HB2 ))
 ASSI { 2157}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 24   and name HA  ))
      3.700     1.700     1.700 peak  2157 weight  0.10000E+01 volume  0.88784E-03 ppm1      1.409 ppm2      5.070 CV     1
 OR { 2157}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 78   and name HA  ))
 ASSI { 2161}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 77   and name HB1 ))
      5.300     3.600     0.700 peak  2161 weight  0.10000E+01 volume  0.85234E-04 ppm1      1.414 ppm2      2.649 CV     1
 OR { 2161}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 109  and name HG1 ))
 OR { 2161}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 73   and name HB2 ))
 ASSI { 2170}
   (  segid "    " and resid 91   and name HG2%)
   (( segid "    " and resid 112  and name HE22))
      3.800     1.800     1.800 peak  2170 weight  0.10000E+01 volume  0.34166E-03 ppm1      1.506 ppm2      6.962 CV     1
 OR { 2170}
   (  segid "    " and resid 91   and name HG2%)
   (  segid "    " and resid 94   and name HD% )
 ASSI { 2173}
   (  segid "    " and resid 91   and name HG2%)
   (( segid "    " and resid 114  and name HB  ))
      4.200     2.200     1.800 peak  2173 weight  0.10000E+01 volume  0.58927E-03 ppm1      1.506 ppm2      3.839 CV     1
 OR { 2173}
   (  segid "    " and resid 91   and name HG2%)
   (( segid "    " and resid 116  and name HB1 ))
 ASSI { 2174}
   (  segid "    " and resid 91   and name HG2%)
   (( segid "    " and resid 116  and name HB2 ))
      4.000     2.000     2.000 peak  2174 weight  0.10000E+01 volume  0.33113E-03 ppm1      1.510 ppm2      3.639 CV     1
 OR { 2174}
   (  segid "    " and resid 91   and name HG2%)
   (( segid "    " and resid 41   and name HD2 ))
 ASSI { 2177}
   (  segid "    " and resid 91   and name HG2%)
   (( segid "    " and resid 112  and name HG2 ))
      4.000     2.000     2.000 peak  2177 weight  0.10000E+01 volume  0.28529E-03 ppm1      1.507 ppm2      2.207 CV     1
 OR { 2177}
   (  segid "    " and resid 91   and name HG2%)
   (( segid "    " and resid 41   and name HG2 ))
 OR { 2177}
   (  segid "    " and resid 91   and name HG2%)
   (( segid "    " and resid 41   and name HB1 ))
 OR { 2177}
   (  segid "    " and resid 91   and name HG2%)
   (( segid "    " and resid 14   and name HG2 ))
 ASSI { 2178}
   (  segid "    " and resid 91   and name HG2%)
   (( segid "    " and resid 115  and name HB  ))
      3.700     1.700     1.700 peak  2178 weight  0.10000E+01 volume  0.75222E-03 ppm1      1.505 ppm2      1.921 CV     1
 OR { 2178}
   (  segid "    " and resid 91   and name HG2%)
   (( segid "    " and resid 112  and name HG1 ))
 ASSI { 2180}
   (  segid "    " and resid 91   and name HG2%)
   (  segid "    " and resid 11   and name HD2%)
      4.100     2.100     1.900 peak  2180 weight  0.10000E+01 volume  0.40240E-03 ppm1      1.513 ppm2      0.845 CV     1
 OR { 2180}
   (  segid "    " and resid 91   and name HG2%)
   (  segid "    " and resid 11   and name HD1%)
 OR { 2180}
   (  segid "    " and resid 91   and name HG2%)
   (  segid "    " and resid 93   and name HG1%)
 OR { 2180}
   (  segid "    " and resid 91   and name HG2%)
   (  segid "    " and resid 86   and name HD2%)
 ASSI { 2187}
   (  segid "    " and resid 58   and name HG2%)
   (  segid "    " and resid 59   and name HD% )
      4.600     2.600     1.400 peak  2187 weight  0.10000E+01 volume  0.25596E-03 ppm1      1.269 ppm2      7.108 CV     1
 OR { 2187}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 47   and name HZ2 ))
 ASSI { 2188}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 52   and name HD21))
      3.900     1.900     1.900 peak  2188 weight  0.10000E+01 volume  0.31280E-03 ppm1      1.265 ppm2      6.936 CV     1
 OR { 2188}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 49   and name HG  ))
 OR { 2188}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 36   and name HD1 ))
 ASSI { 2194}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 70   and name HB  ))
      4.300     2.400     1.700 peak  2194 weight  0.10000E+01 volume  0.44721E-03 ppm1      1.268 ppm2      1.990 CV     1
 OR { 2194}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 72   and name HB1 ))
 ASSI { 2197}
   (  segid "    " and resid 58   and name HG2%)
   (  segid "    " and resid 70   and name HG2%)
      2.000     0.500     0.500 peak  2197 weight  0.10000E+01 volume  0.15902E-01 ppm1      1.263 ppm2      1.031 CV     1
 OR { 2197}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 51   and name HG12))
 OR { 2197}
   (  segid "    " and resid 58   and name HG2%)
   (  segid "    " and resid 51   and name HG2%)
 ASSI { 2199}
   (  segid "    " and resid 103  and name HB% )
   (( segid "    " and resid 100  and name HN  ))
      4.900     3.000     1.100 peak  2199 weight  0.10000E+01 volume  0.10820E-03 ppm1      1.298 ppm2      8.497 CV     1
 OR { 2199}
   (  segid "    " and resid 103  and name HB% )
   (( segid "    " and resid 105  and name HN  ))
 OR { 2199}
   (  segid "    " and resid 103  and name HB% )
   (( segid "    " and resid 99   and name HN  ))
 ASSI { 2203}
   (  segid "    " and resid 103  and name HB% )
   (( segid "    " and resid 104  and name HA  ))
      3.500     1.500     1.500 peak  2203 weight  0.10000E+01 volume  0.53786E-03 ppm1      1.297 ppm2      3.899 CV     1
 OR { 2203}
   (  segid "    " and resid 103  and name HB% )
   (( segid "    " and resid 102  and name HA2 ))
 OR { 2203}
   (  segid "    " and resid 103  and name HB% )
   (( segid "    " and resid 101  and name HA1 ))
 ASSI { 2204}
   (  segid "    " and resid 103  and name HB% )
   (( segid "    " and resid 101  and name HA1 ))
      3.100     1.200     1.200 peak  2204 weight  0.10000E+01 volume  0.47402E-03 ppm1      1.296 ppm2      3.730 CV     1
 OR { 2204}
   (  segid "    " and resid 103  and name HB% )
   (( segid "    " and resid 100  and name HB1 ))
 OR { 2204}
   (  segid "    " and resid 103  and name HB% )
   (( segid "    " and resid 100  and name HB2 ))
 ASSI { 2205}
   (  segid "    " and resid 103  and name HB% )
   (( segid "    " and resid 102  and name HA1 ))
      3.900     1.900     1.900 peak  2205 weight  0.10000E+01 volume  0.13734E-03 ppm1      1.299 ppm2      3.559 CV     1
 OR { 2205}
   (  segid "    " and resid 103  and name HB% )
   (( segid "    " and resid 101  and name HA2 ))
 ASSI { 2230}
   (  segid "    " and resid 75   and name HB% )
   (( segid "    " and resid 74   and name HB1 ))
      3.500     1.600     1.600 peak  2230 weight  0.10000E+01 volume  0.53680E-03 ppm1      1.557 ppm2      2.995 CV     1
 OR { 2230}
   (  segid "    " and resid 75   and name HB% )
   (( segid "    " and resid 74   and name HB2 ))
 OR { 2230}
   (  segid "    " and resid 75   and name HB% )
   (( segid "    " and resid 76   and name HE1 ))
 OR { 2230}
   (  segid "    " and resid 75   and name HB% )
   (( segid "    " and resid 76   and name HE2 ))
 ASSI { 2235}
   (  segid "    " and resid 40   and name HB% )
   (( segid "    " and resid 41   and name HB1 ))
      3.700     1.700     1.700 peak  2235 weight  0.10000E+01 volume  0.11185E-02 ppm1      1.463 ppm2      2.234 CV     1
 OR { 2235}
   (  segid "    " and resid 40   and name HB% )
   (( segid "    " and resid 39   and name HG1 ))
 ASSI { 2248}
   (  segid "    " and resid 61   and name HB% )
   (( segid "    " and resid 47   and name HZ3 ))
      3.400     1.400     1.400 peak  2248 weight  0.10000E+01 volume  0.89575E-03 ppm1      1.410 ppm2      7.276 CV     1
 OR { 2248}
   (  segid "    " and resid 61   and name HB% )
   (( segid "    " and resid 64   and name HN  ))
 ASSI { 2249}
   (  segid "    " and resid 61   and name HB% )
   (( segid "    " and resid 47   and name HZ2 ))
      3.500     1.600     1.600 peak  2249 weight  0.10000E+01 volume  0.81246E-03 ppm1      1.407 ppm2      7.033 CV     1
 OR { 2249}
   (  segid "    " and resid 61   and name HB% )
   (  segid "    " and resid 60   and name HD% )
 OR { 2249}
   (  segid "    " and resid 61   and name HB% )
   (  segid "    " and resid 68   and name HD% )
 OR { 2249}
   (  segid "    " and resid 61   and name HB% )
   (  segid "    " and resid 68   and name HE% )
 ASSI { 2255}
   (  segid "    " and resid 61   and name HB% )
   (( segid "    " and resid 48   and name HB  ))
      4.000     2.000     2.000 peak  2255 weight  0.10000E+01 volume  0.77089E-03 ppm1      1.417 ppm2      1.920 CV     1
 OR { 2255}
   (  segid "    " and resid 61   and name HB% )
   (( segid "    " and resid 65   and name HB2 ))
 OR { 2255}
   (  segid "    " and resid 61   and name HB% )
   (( segid "    " and resid 65   and name HD2 ))
 ASSI { 2257}
   (  segid "    " and resid 61   and name HB% )
   (  segid "    " and resid 48   and name HG2%)
      2.700     0.900     0.900 peak  2257 weight  0.10000E+01 volume  0.20989E-02 ppm1      1.411 ppm2      0.846 CV     1
 OR { 2257}
   (  segid "    " and resid 61   and name HB% )
   (  segid "    " and resid 48   and name HG2%)
 OR { 2257}
   (  segid "    " and resid 61   and name HB% )
   (  segid "    " and resid 64   and name HG2%)
 ASSI { 2261}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 52   and name HN  ))
      5.000     3.100     1.000 peak  2261 weight  0.10000E+01 volume  0.10115E-03 ppm1      1.204 ppm2      8.483 CV     1
 OR { 2261}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 99   and name HN  ))
 ASSI { 2264}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 47   and name HZ2 ))
      3.100     1.200     1.200 peak  2264 weight  0.10000E+01 volume  0.19346E-02 ppm1      1.203 ppm2      7.063 CV     1
 OR { 2264}
   (  segid "    " and resid 50   and name HG2%)
   (  segid "    " and resid 59   and name HD% )
 ASSI { 2265}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 47   and name HD1 ))
      3.300     1.400     1.400 peak  2265 weight  0.10000E+01 volume  0.47572E-03 ppm1      1.204 ppm2      6.738 CV     1
 OR { 2265}
   (  segid "    " and resid 50   and name HG2%)
   (  segid "    " and resid 99   and name HD% )
 OR { 2265}
   (  segid "    " and resid 50   and name HG2%)
   (  segid "    " and resid 60   and name HE% )
 OR { 2265}
   (  segid "    " and resid 50   and name HG2%)
   (  segid "    " and resid 59   and name HE% )
 ASSI { 2269}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 51   and name HA  ))
      4.200     2.200     1.800 peak  2269 weight  0.10000E+01 volume  0.28436E-03 ppm1      1.204 ppm2      5.183 CV     1
 OR { 2269}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 58   and name HA  ))
 ASSI { 2273}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 52   and name HB1 ))
      3.900     1.900     1.900 peak  2273 weight  0.10000E+01 volume  0.40690E-03 ppm1      1.208 ppm2      3.082 CV     1
 OR { 2273}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 53   and name HD2 ))
 OR { 2273}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 36   and name HB1 ))
 ASSI { 2274}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 33   and name HB2 ))
      2.900     1.100     1.100 peak  2274 weight  0.10000E+01 volume  0.17615E-02 ppm1      1.203 ppm2      2.859 CV     1
 OR { 2274}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 59   and name HB1 ))
 ASSI { 2275}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 52   and name HB2 ))
      3.700     1.700     1.700 peak  2275 weight  0.10000E+01 volume  0.55846E-03 ppm1      1.202 ppm2      2.709 CV     1
 OR { 2275}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 99   and name HB1 ))
 OR { 2275}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 36   and name HB2 ))
 ASSI { 2276}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 51   and name HB  ))
      4.100     2.100     1.900 peak  2276 weight  0.10000E+01 volume  0.49191E-03 ppm1      1.206 ppm2      1.665 CV     1
 OR { 2276}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 34   and name HB2 ))
 OR { 2276}
   (  segid "    " and resid 50   and name HG2%)
   (( segid "    " and resid 51   and name HG11))
 ASSI { 2280}
   (  segid "    " and resid 28   and name HG2%)
   (( segid "    " and resid 27   and name HN  ))
      5.200     3.400     0.800 peak  2280 weight  0.10000E+01 volume  0.10106E-03 ppm1      1.233 ppm2      7.450 CV     1
 OR { 2280}
   (  segid "    " and resid 28   and name HG2%)
   (( segid "    " and resid 76   and name HN  ))
 OR { 2280}
   (  segid "    " and resid 28   and name HG2%)
   (( segid "    " and resid 78   and name HN  ))
 ASSI { 2285}
   (  segid "    " and resid 28   and name HG2%)
   (( segid "    " and resid 30   and name HB1 ))
      4.000     2.000     2.000 peak  2285 weight  0.10000E+01 volume  0.35031E-03 ppm1      1.231 ppm2      3.848 CV     1
 OR { 2285}
   (  segid "    " and resid 28   and name HG2%)
   (( segid "    " and resid 30   and name HB2 ))
 OR { 2285}
   (  segid "    " and resid 28   and name HG2%)
   (( segid "    " and resid 77   and name HA  ))
 ASSI { 2287}
   (  segid "    " and resid 28   and name HG2%)
   (( segid "    " and resid 29   and name HB2 ))
      4.300     2.300     1.700 peak  2287 weight  0.10000E+01 volume  0.34404E-03 ppm1      1.233 ppm2      3.026 CV     1
 OR { 2287}
   (  segid "    " and resid 28   and name HG2%)
   (( segid "    " and resid 27   and name HB1 ))
 OR { 2287}
   (  segid "    " and resid 28   and name HG2%)
   (( segid "    " and resid 27   and name HB2 ))
 ASSI { 2293}
   (  segid "    " and resid 69   and name HG2%)
   (( segid "    " and resid 84   and name HD22))
      4.500     2.500     1.500 peak  2293 weight  0.10000E+01 volume  0.20938E-03 ppm1      1.190 ppm2      6.740 CV     1
 OR { 2293}
   (  segid "    " and resid 69   and name HG2%)
   (  segid "    " and resid 80   and name HE% )
 ASSI { 2298}
   (  segid "    " and resid 28   and name HG2%)
   (  segid "    " and resid 34   and name HE% )
      4.400     2.400     1.600 peak  2298 weight  0.10000E+01 volume  0.29016E-03 ppm1      1.192 ppm2      1.751 CV     1
 OR { 2298}
   (  segid "    " and resid 69   and name HG2%)
   (( segid "    " and resid 83   and name HB2 ))
 OR { 2298}
   (  segid "    " and resid 69   and name HG2%)
   (( segid "    " and resid 72   and name HG2 ))
 OR { 2298}
   (  segid "    " and resid 69   and name HG2%)
   (( segid "    " and resid 72   and name HB2 ))
 OR { 2298}
   (  segid "    " and resid 69   and name HG2%)
   (( segid "    " and resid 19   and name HB1 ))
 OR { 2298}
   (  segid "    " and resid 28   and name HG2%)
   (( segid "    " and resid 53   and name HG1 ))
 OR { 2298}
   (  segid "    " and resid 69   and name HG2%)
   (( segid "    " and resid 79   and name HG  ))
 ASSI { 2300}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 37   and name HN  ))
      3.500     1.500     1.500 peak  2300 weight  0.10000E+01 volume  0.26334E-03 ppm1      1.126 ppm2      9.492 CV     1
 OR { 2300}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 95   and name HN  ))
 ASSI { 2303}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 36   and name HN  ))
      4.100     2.100     1.900 peak  2303 weight  0.10000E+01 volume  0.12105E-03 ppm1      1.129 ppm2      8.791 CV     1
 OR { 2303}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 33   and name HN  ))
 ASSI { 2306}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 107  and name HN  ))
      4.300     2.300     1.700 peak  2306 weight  0.10000E+01 volume  0.27631E-03 ppm1      1.127 ppm2      7.926 CV     1
 OR { 2306}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 108  and name HN  ))
 ASSI { 2309}
   (  segid "    " and resid 97   and name HB% )
   (  segid "    " and resid 95   and name HE% )
      3.500     1.600     1.600 peak  2309 weight  0.10000E+01 volume  0.89985E-03 ppm1      1.128 ppm2      6.720 CV     1
 OR { 2309}
   (  segid "    " and resid 97   and name HB% )
   (  segid "    " and resid 99   and name HD% )
 ASSI { 2312}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 96   and name HA  ))
      3.600     1.600     1.600 peak  2312 weight  0.10000E+01 volume  0.84066E-03 ppm1      1.128 ppm2      5.032 CV     1
 OR { 2312}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 107  and name HA  ))
 OR { 2312}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 98   and name HA  ))
 ASSI { 2314}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 106  and name HA  ))
      3.800     1.800     1.800 peak  2314 weight  0.10000E+01 volume  0.60477E-03 ppm1      1.129 ppm2      4.156 CV     1
 OR { 2314}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 108  and name HA1 ))
 OR { 2314}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 108  and name HA2 ))
 ASSI { 2317}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 95   and name HB1 ))
      3.400     1.400     1.400 peak  2317 weight  0.10000E+01 volume  0.67822E-03 ppm1      1.127 ppm2      2.439 CV     1
 OR { 2317}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 96   and name HB1 ))
 OR { 2317}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 105  and name HB2 ))
 OR { 2317}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 105  and name HB1 ))
 OR { 2317}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 34   and name HG2 ))
 ASSI { 2319}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 96   and name HB2 ))
      3.500     1.500     1.500 peak  2319 weight  0.10000E+01 volume  0.59682E-03 ppm1      1.130 ppm2      1.763 CV     1
 OR { 2319}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 98   and name HE1 ))
 OR { 2319}
   (  segid "    " and resid 97   and name HB% )
   (  segid "    " and resid 34   and name HE% )
 ASSI { 2320}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 37   and name HB  ))
      3.600     1.600     1.600 peak  2320 weight  0.10000E+01 volume  0.58950E-03 ppm1      1.128 ppm2      1.952 CV     1
 OR { 2320}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 98   and name HE2 ))
 OR { 2320}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 34   and name HB1 ))
 ASSI { 2322}
   (  segid "    " and resid 97   and name HB% )
   (  segid "    " and resid 35   and name HB% )
      2.800     1.000     1.000 peak  2322 weight  0.10000E+01 volume  0.39726E-02 ppm1      1.128 ppm2      1.451 CV     1
 OR { 2322}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 98   and name HB1 ))
 OR { 2322}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 98   and name HB2 ))
 OR { 2322}
   (  segid "    " and resid 97   and name HB% )
   (( segid "    " and resid 4    and name HG  ))
 ASSI { 2332}
   (( segid "    " and resid 51   and name HG12))
   (( segid "    " and resid 56   and name HA2 ))
      4.300     2.300     1.700 peak  2332 weight  0.10000E+01 volume  0.23989E-03 ppm1      1.097 ppm2      3.859 CV     1
 OR { 2332}
   (( segid "    " and resid 51   and name HG12))
   (( segid "    " and resid 58   and name HB  ))
 OR { 2332}
   (( segid "    " and resid 51   and name HG12))
   (( segid "    " and resid 57   and name HB1 ))
 OR { 2332}
   (( segid "    " and resid 51   and name HG12))
   (( segid "    " and resid 57   and name HB2 ))
 ASSI { 2338}
   (( segid "    " and resid 64   and name HB  ))
   (( segid "    " and resid 68   and name HB2 ))
      3.400     1.500     1.500 peak  2338 weight  0.10000E+01 volume  0.71446E-03 ppm1      1.053 ppm2      2.907 CV     1
 OR { 2338}
   (( segid "    " and resid 64   and name HB  ))
   (( segid "    " and resid 68   and name HB1 ))
 OR { 2338}
   (( segid "    " and resid 64   and name HB  ))
   (( segid "    " and resid 60   and name HB2 ))
 ASSI { 2351}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 92   and name HN  ))
      4.300     2.300     1.700 peak  2351 weight  0.10000E+01 volume  0.38043E-03 ppm1      1.112 ppm2      9.057 CV     1
 OR { 2351}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 12   and name HN  ))
 ASSI { 2365}
   (  segid "    " and resid 92   and name HB% )
   (( segid "    " and resid 40   and name HN  ))
      3.600     1.600     1.600 peak  2365 weight  0.10000E+01 volume  0.59728E-03 ppm1      1.114 ppm2      9.460 CV     1
 OR { 2365}
   (  segid "    " and resid 92   and name HB% )
   (( segid "    " and resid 95   and name HN  ))
 ASSI { 2366}
   (  segid "    " and resid 92   and name HB% )
   (( segid "    " and resid 39   and name HN  ))
      3.000     1.100     1.100 peak  2366 weight  0.10000E+01 volume  0.20621E-02 ppm1      1.113 ppm2      9.244 CV     1
 OR { 2366}
   (  segid "    " and resid 92   and name HB% )
   (( segid "    " and resid 94   and name HN  ))
 ASSI { 2373}
   (  segid "    " and resid 92   and name HB% )
   (( segid "    " and resid 40   and name HA  ))
      3.200     1.300     1.300 peak  2373 weight  0.10000E+01 volume  0.13684E-02 ppm1      1.113 ppm2      4.841 CV     1
 OR { 2373}
   (  segid "    " and resid 92   and name HB% )
   (( segid "    " and resid 39   and name HA  ))
 ASSI { 2375}
   (  segid "    " and resid 92   and name HB% )
   (( segid "    " and resid 90   and name HB2 ))
      4.000     2.000     2.000 peak  2375 weight  0.10000E+01 volume  0.35421E-03 ppm1      1.115 ppm2      2.913 CV     1
 OR { 2375}
   (  segid "    " and resid 92   and name HB% )
   (( segid "    " and resid 94   and name HB2 ))
 OR { 2375}
   (  segid "    " and resid 92   and name HB% )
   (( segid "    " and resid 94   and name HB1 ))
 ASSI { 2387}
   (  segid "    " and resid 111  and name HG2%)
   (( segid "    " and resid 36   and name HZ3 ))
      3.500     1.600     1.600 peak  2387 weight  0.10000E+01 volume  0.67270E-03 ppm1      1.068 ppm2      6.747 CV     1
 OR { 2387}
   (  segid "    " and resid 111  and name HG2%)
   (( segid "    " and resid 36   and name HH2 ))
 OR { 2387}
   (  segid "    " and resid 111  and name HG2%)
   (  segid "    " and resid 94   and name HE% )
 ASSI { 2388}
   (  segid "    " and resid 111  and name HG2%)
   (( segid "    " and resid 6    and name HA  ))
      3.400     1.500     1.500 peak  2388 weight  0.10000E+01 volume  0.28262E-03 ppm1      1.066 ppm2      5.747 CV     1
 OR { 2388}
   (  segid "    " and resid 111  and name HG2%)
   (( segid "    " and resid 38   and name HA  ))
 ASSI { 2390}
   (  segid "    " and resid 111  and name HG2%)
   (( segid "    " and resid 112  and name HA  ))
      3.900     1.900     1.900 peak  2390 weight  0.10000E+01 volume  0.40192E-03 ppm1      1.075 ppm2      4.429 CV     1
 OR { 2390}
   (  segid "    " and resid 111  and name HG2%)
   (( segid "    " and resid 93   and name HA  ))
 OR { 2390}
   (  segid "    " and resid 111  and name HG2%)
   (( segid "    " and resid 113  and name HA  ))
 ASSI { 2397}
   (  segid "    " and resid 111  and name HG2%)
   (( segid "    " and resid 20   and name HB  ))
      3.400     1.500     1.500 peak  2397 weight  0.10000E+01 volume  0.94887E-03 ppm1      1.067 ppm2      2.065 CV     1
 OR { 2397}
   (  segid "    " and resid 111  and name HG2%)
   (( segid "    " and resid 112  and name HB2 ))
 OR { 2397}
   (  segid "    " and resid 111  and name HG2%)
   (( segid "    " and resid 112  and name HB1 ))
 OR { 2397}
   (  segid "    " and resid 111  and name HG2%)
   (( segid "    " and resid 112  and name HG1 ))
 ASSI { 2399}
   (  segid "    " and resid 111  and name HG2%)
   (  segid "    " and resid 20   and name HG1%)
      3.000     1.100     1.100 peak  2399 weight  0.10000E+01 volume  0.20828E-02 ppm1      1.070 ppm2      0.307 CV     1
 OR { 2399}
   (  segid "    " and resid 111  and name HG2%)
   (  segid "    " and resid 93   and name HG2%)
 ASSI { 2406}
   (  segid "    " and resid 124  and name HG2%)
   (( segid "    " and resid 126  and name HG2 ))
      5.300     3.500     0.700 peak  2406 weight  0.10000E+01 volume  0.77328E-04 ppm1      0.895 ppm2      2.236 CV     1
 OR { 2406}
   (  segid "    " and resid 124  and name HG2%)
   (( segid "    " and resid 126  and name HG1 ))
 OR { 2406}
   (  segid "    " and resid 124  and name HG2%)
   (( segid "    " and resid 127  and name HG1 ))
 OR { 2406}
   (  segid "    " and resid 124  and name HG2%)
   (( segid "    " and resid 127  and name HG2 ))
 ASSI { 2416}
   (  segid "    " and resid 106  and name HB% )
   (  segid "    " and resid 27   and name HE% )
      3.900     1.900     1.900 peak  2416 weight  0.10000E+01 volume  0.16631E-03 ppm1      0.980 ppm2      6.918 CV     1
 OR { 2416}
   (  segid "    " and resid 106  and name HB% )
   (  segid "    " and resid 27   and name HD% )
 OR { 2416}
   (  segid "    " and resid 106  and name HB% )
   (( segid "    " and resid 27   and name HZ  ))
 OR { 2416}
   (  segid "    " and resid 106  and name HB% )
   (( segid "    " and resid 107  and name HD1 ))
 ASSI { 2423}
   (  segid "    " and resid 106  and name HB% )
   (( segid "    " and resid 98   and name HB2 ))
      3.300     1.400     1.400 peak  2423 weight  0.10000E+01 volume  0.13420E-02 ppm1      0.979 ppm2      1.417 CV     1
 OR { 2423}
   (  segid "    " and resid 106  and name HB% )
   (( segid "    " and resid 4    and name HG  ))
 OR { 2423}
   (  segid "    " and resid 106  and name HB% )
   (( segid "    " and resid 4    and name HB2 ))
 OR { 2423}
   (  segid "    " and resid 106  and name HB% )
   (( segid "    " and resid 4    and name HB1 ))
 ASSI { 2426}
   (  segid "    " and resid 106  and name HB% )
   (  segid "    " and resid 104  and name HD2%)
      3.100     1.200     1.200 peak  2426 weight  0.10000E+01 volume  0.55336E-03 ppm1      0.979 ppm2      0.332 CV     1
 OR { 2426}
   (  segid "    " and resid 106  and name HB% )
   (  segid "    " and resid 45   and name HD2%)
 ASSI { 2429}
   (  segid "    " and resid 93   and name HG1%)
   (( segid "    " and resid 111  and name HN  ))
      4.700     2.800     1.300 peak  2429 weight  0.10000E+01 volume  0.18793E-03 ppm1      0.947 ppm2      8.765 CV     1
 OR { 2429}
   (  segid "    " and resid 93   and name HG1%)
   (( segid "    " and resid 112  and name HN  ))
 ASSI { 2430}
   (  segid "    " and resid 93   and name HG1%)
   (( segid "    " and resid 114  and name HN  ))
      5.000     3.100     1.000 peak  2430 weight  0.10000E+01 volume  0.15379E-03 ppm1      0.946 ppm2      8.442 CV     1
 OR { 2430}
   (  segid "    " and resid 93   and name HG1%)
   (( segid "    " and resid 115  and name HN  ))
 OR { 2430}
   (  segid "    " and resid 93   and name HG1%)
   (( segid "    " and resid 90   and name HN  ))
 ASSI { 2433}
   (  segid "    " and resid 93   and name HG1%)
   (( segid "    " and resid 112  and name HE22))
      3.800     1.800     1.800 peak  2433 weight  0.10000E+01 volume  0.45602E-03 ppm1      0.948 ppm2      6.951 CV     1
 OR { 2433}
   (  segid "    " and resid 93   and name HG1%)
   (  segid "    " and resid 94   and name HD% )
 ASSI { 2434}
   (  segid "    " and resid 93   and name HG1%)
   (( segid "    " and resid 40   and name HA  ))
      4.300     2.300     1.700 peak  2434 weight  0.10000E+01 volume  0.19275E-03 ppm1      0.951 ppm2      4.867 CV     1
 OR { 2434}
   (  segid "    " and resid 93   and name HG1%)
   (( segid "    " and resid 94   and name HA  ))
 OR { 2434}
   (  segid "    " and resid 93   and name HG1%)
   (( segid "    " and resid 111  and name HA  ))
 ASSI { 2437}
   (  segid "    " and resid 93   and name HG1%)
   (( segid "    " and resid 39   and name HB1 ))
      2.900     1.100     1.100 peak  2437 weight  0.10000E+01 volume  0.15077E-02 ppm1      0.947 ppm2      2.261 CV     1
 OR { 2437}
   (  segid "    " and resid 93   and name HG1%)
   (( segid "    " and resid 112  and name HG2 ))
 ASSI { 2442}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 36   and name HN  ))
      4.500     2.500     1.500 peak  2442 weight  0.10000E+01 volume  0.31475E-03 ppm1      0.984 ppm2      8.823 CV     1
 OR { 2442}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 36   and name HN  ))
 OR { 2442}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 50   and name HN  ))
 OR { 2442}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 50   and name HN  ))
 OR { 2442}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 60   and name HN  ))
 OR { 2442}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 60   and name HN  ))
 ASSI { 2446}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 38   and name HE  ))
      2.700     0.900     0.900 peak  2446 weight  0.10000E+01 volume  0.30565E-02 ppm1      0.986 ppm2      7.206 CV     1
 OR { 2446}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 38   and name HE  ))
 OR { 2446}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 64   and name HN  ))
 ASSI { 2447}
   (  segid "    " and resid 48   and name HG1%)
   (  segid "    " and resid 68   and name HE% )
      2.900     1.000     1.000 peak  2447 weight  0.10000E+01 volume  0.29884E-02 ppm1      0.985 ppm2      6.946 CV     1
 OR { 2447}
   (  segid "    " and resid 48   and name HG1%)
   (  segid "    " and resid 68   and name HE% )
 OR { 2447}
   (  segid "    " and resid 48   and name HG1%)
   (  segid "    " and resid 68   and name HD% )
 OR { 2447}
   (  segid "    " and resid 48   and name HG1%)
   (  segid "    " and resid 68   and name HD% )
 OR { 2447}
   (  segid "    " and resid 48   and name HG1%)
   (  segid "    " and resid 60   and name HD% )
 OR { 2447}
   (  segid "    " and resid 48   and name HG1%)
   (  segid "    " and resid 60   and name HD% )
 OR { 2447}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 68   and name HZ  ))
 OR { 2447}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 68   and name HZ  ))
 OR { 2447}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 49   and name HG  ))
 OR { 2447}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 49   and name HG  ))
 OR { 2447}
   (  segid "    " and resid 48   and name HG1%)
   (  segid "    " and resid 94   and name HD% )
 OR { 2447}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 47   and name HD1 ))
 OR { 2447}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 47   and name HD1 ))
 ASSI { 2454}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 60   and name HB2 ))
      3.600     1.600     1.600 peak  2454 weight  0.10000E+01 volume  0.80630E-03 ppm1      0.987 ppm2      2.895 CV     1
 OR { 2454}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 68   and name HB2 ))
 OR { 2454}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 68   and name HB2 ))
 OR { 2454}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 68   and name HB1 ))
 OR { 2454}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 68   and name HB1 ))
 ASSI { 2463}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 87   and name HD1 ))
      3.700     1.700     1.700 peak  2463 weight  0.10000E+01 volume  0.24570E-03 ppm1      0.990 ppm2      1.597 CV     1
 OR { 2463}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 87   and name HD1 ))
 OR { 2463}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 87   and name HD2 ))
 OR { 2463}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 87   and name HD2 ))
 OR { 2463}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 87   and name HB1 ))
 OR { 2463}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 87   and name HB1 ))
 OR { 2463}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 51   and name HB  ))
 OR { 2463}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 51   and name HB  ))
 OR { 2463}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 67   and name HB1 ))
 OR { 2463}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 67   and name HB1 ))
 ASSI { 2464}
   (  segid "    " and resid 79   and name HD2%)
   (( segid "    " and resid 80   and name HN  ))
      3.500     1.500     1.500 peak  2464 weight  0.10000E+01 volume  0.89810E-03 ppm1      0.944 ppm2      9.214 CV     1
 OR { 2464}
   (  segid "    " and resid 79   and name HD2%)
   (( segid "    " and resid 22   and name HN  ))
 ASSI { 2468}
   (  segid "    " and resid 79   and name HD2%)
   (( segid "    " and resid 73   and name HN  ))
      3.700     1.700     1.700 peak  2468 weight  0.10000E+01 volume  0.74320E-03 ppm1      0.943 ppm2      9.002 CV     1
 OR { 2468}
   (  segid "    " and resid 79   and name HD2%)
   (( segid "    " and resid 72   and name HN  ))
 ASSI { 2471}
   (  segid "    " and resid 79   and name HD2%)
   (( segid "    " and resid 36   and name HZ2 ))
      2.900     1.100     1.100 peak  2471 weight  0.10000E+01 volume  0.29469E-02 ppm1      0.932 ppm2      6.963 CV     1
 OR { 2471}
   (  segid "    " and resid 79   and name HD2%)
   (  segid "    " and resid 80   and name HD% )
 ASSI { 2472}
   (  segid "    " and resid 79   and name HD2%)
   (( segid "    " and resid 80   and name HA  ))
      3.300     1.300     1.300 peak  2472 weight  0.10000E+01 volume  0.68751E-03 ppm1      0.944 ppm2      5.659 CV     1
 OR { 2472}
   (  segid "    " and resid 79   and name HD2%)
   (( segid "    " and resid 35   and name HA  ))
 OR { 2472}
   (  segid "    " and resid 79   and name HD2%)
   (( segid "    " and resid 34   and name HA  ))
 ASSI { 2473}
   (  segid "    " and resid 79   and name HD2%)
   (( segid "    " and resid 72   and name HA  ))
      3.700     1.700     1.700 peak  2473 weight  0.10000E+01 volume  0.76427E-03 ppm1      0.944 ppm2      5.387 CV     1
 OR { 2473}
   (  segid "    " and resid 79   and name HD2%)
   (( segid "    " and resid 70   and name HA  ))
 ASSI { 2474}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 84   and name HA  ))
      3.300     1.400     1.400 peak  2474 weight  0.10000E+01 volume  0.48469E-03 ppm1      0.940 ppm2      5.169 CV     1
 OR { 2474}
   (  segid "    " and resid 79   and name HD2%)
   (( segid "    " and resid 78   and name HA  ))
 OR { 2474}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 11   and name HA  ))
 OR { 2474}
   (  segid "    " and resid 79   and name HD2%)
   (( segid "    " and resid 51   and name HA  ))
 OR { 2474}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 19   and name HA  ))
 OR { 2474}
   (  segid "    " and resid 79   and name HD2%)
   (( segid "    " and resid 98   and name HA  ))
 ASSI { 2476}
   (  segid "    " and resid 79   and name HD2%)
   (( segid "    " and resid 72   and name HD1 ))
      2.700     0.900     0.900 peak  2476 weight  0.10000E+01 volume  0.16794E-02 ppm1      0.927 ppm2      3.049 CV     1
 OR { 2476}
   (  segid "    " and resid 79   and name HD2%)
   (( segid "    " and resid 80   and name HB2 ))
 OR { 2476}
   (  segid "    " and resid 79   and name HD2%)
   (( segid "    " and resid 22   and name HB2 ))
 ASSI { 2477}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 90   and name HB2 ))
      2.900     1.100     1.100 peak  2477 weight  0.10000E+01 volume  0.21881E-02 ppm1      0.924 ppm2      2.822 CV     1
 OR { 2477}
   (  segid "    " and resid 79   and name HD2%)
   (( segid "    " and resid 22   and name HB1 ))
 OR { 2477}
   (  segid "    " and resid 79   and name HD2%)
   (( segid "    " and resid 80   and name HB1 ))
 OR { 2477}
   (  segid "    " and resid 79   and name HD2%)
   (( segid "    " and resid 36   and name HB2 ))
 ASSI { 2478}
   (  segid "    " and resid 79   and name HD2%)
   (( segid "    " and resid 34   and name HG1 ))
      2.900     1.100     1.100 peak  2478 weight  0.10000E+01 volume  0.14427E-02 ppm1      0.944 ppm2      2.435 CV     1
 OR { 2478}
   (  segid "    " and resid 79   and name HD2%)
   (( segid "    " and resid 34   and name HG2 ))
 OR { 2478}
   (  segid "    " and resid 79   and name HD2%)
   (( segid "    " and resid 96   and name HB1 ))
 ASSI { 2480}
   (  segid "    " and resid 79   and name HD2%)
   (( segid "    " and resid 72   and name HB1 ))
      2.600     0.900     0.900 peak  2480 weight  0.10000E+01 volume  0.25390E-02 ppm1      0.943 ppm2      1.953 CV     1
 OR { 2480}
   (  segid "    " and resid 79   and name HD2%)
   (( segid "    " and resid 34   and name HB1 ))
 OR { 2480}
   (  segid "    " and resid 79   and name HD2%)
   (( segid "    " and resid 70   and name HB  ))
 ASSI { 2486}
   (  segid "    " and resid 79   and name HD2%)
   (  segid "    " and resid 81   and name HD2%)
      4.700     2.700     1.300 peak  2486 weight  0.10000E+01 volume  0.19362E-03 ppm1      0.924 ppm2      0.175 CV     1
 OR { 2486}
   (  segid "    " and resid 86   and name HD2%)
   (  segid "    " and resid 81   and name HD2%)
 ASSI { 2501}
   (  segid "    " and resid 11   and name HD1%)
   (( segid "    " and resid 114  and name HN  ))
      3.600     1.600     1.600 peak  2501 weight  0.10000E+01 volume  0.59079E-03 ppm1      0.843 ppm2      8.439 CV     1
 OR { 2501}
   (  segid "    " and resid 11   and name HD2%)
   (( segid "    " and resid 114  and name HN  ))
 OR { 2501}
   (  segid "    " and resid 11   and name HD2%)
   (( segid "    " and resid 116  and name HN  ))
 OR { 2501}
   (  segid "    " and resid 11   and name HD1%)
   (( segid "    " and resid 116  and name HN  ))
 ASSI { 2504}
   (  segid "    " and resid 11   and name HD1%)
   (( segid "    " and resid 12   and name HA  ))
      4.100     2.100     1.900 peak  2504 weight  0.10000E+01 volume  0.42481E-03 ppm1      0.846 ppm2      4.454 CV     1
 OR { 2504}
   (  segid "    " and resid 11   and name HD2%)
   (( segid "    " and resid 12   and name HA  ))
 OR { 2504}
   (  segid "    " and resid 11   and name HD2%)
   (( segid "    " and resid 91   and name HA  ))
 OR { 2504}
   (  segid "    " and resid 11   and name HD1%)
   (( segid "    " and resid 91   and name HA  ))
 ASSI { 2508}
   (  segid "    " and resid 11   and name HD2%)
   (( segid "    " and resid 116  and name HB2 ))
      3.300     1.400     1.400 peak  2508 weight  0.10000E+01 volume  0.93811E-03 ppm1      0.842 ppm2      3.535 CV     1
 OR { 2508}
   (  segid "    " and resid 11   and name HD1%)
   (( segid "    " and resid 116  and name HB2 ))
 OR { 2508}
   (  segid "    " and resid 11   and name HD1%)
   (( segid "    " and resid 9    and name HA2 ))
 ASSI { 2515}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 97   and name HN  ))
      3.800     1.800     1.800 peak  2515 weight  0.10000E+01 volume  0.51564E-03 ppm1      0.862 ppm2      8.514 CV     1
 OR { 2515}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 105  and name HN  ))
 ASSI { 2518}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 47   and name HD1 ))
      3.100     1.200     1.200 peak  2518 weight  0.10000E+01 volume  0.18043E-02 ppm1      0.865 ppm2      6.853 CV     1
 OR { 2518}
   (  segid "    " and resid 37   and name HG1%)
   (  segid "    " and resid 95   and name HD% )
 ASSI { 2522}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 47   and name HB2 ))
      3.500     1.500     1.500 peak  2522 weight  0.10000E+01 volume  0.12473E-02 ppm1      0.866 ppm2      3.199 CV     1
 OR { 2522}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 47   and name HB1 ))
 OR { 2522}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 95   and name HB2 ))
 ASSI { 2524}
   (  segid "    " and resid 37   and name HG1%)
   (  segid "    " and resid 35   and name HB% )
      2.700     0.900     0.900 peak  2524 weight  0.10000E+01 volume  0.26377E-02 ppm1      0.863 ppm2      1.434 CV     1
 OR { 2524}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 45   and name HB2 ))
 OR { 2524}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 38   and name HG2 ))
 ASSI { 2526}
   (  segid "    " and resid 37   and name HG1%)
   (  segid "    " and resid 104  and name HD2%)
      2.900     1.000     1.000 peak  2526 weight  0.10000E+01 volume  0.26013E-02 ppm1      0.866 ppm2      0.346 CV     1
 OR { 2526}
   (  segid "    " and resid 37   and name HG1%)
   (  segid "    " and resid 45   and name HD2%)
 OR { 2526}
   (  segid "    " and resid 37   and name HG1%)
   (  segid "    " and resid 45   and name HD1%)
 ASSI { 2528}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 35   and name HA  ))
      5.400     3.600     0.600 peak  2528 weight  0.10000E+01 volume  0.10430E-03 ppm1      0.870 ppm2      5.774 CV     1
 OR { 2528}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 38   and name HA  ))
 ASSI { 2531}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 45   and name HB1 ))
      3.100     1.200     1.200 peak  2531 weight  0.10000E+01 volume  0.20213E-02 ppm1      0.862 ppm2      1.096 CV     1
 OR { 2531}
   (  segid "    " and resid 37   and name HG1%)
   (  segid "    " and resid 97   and name HB% )
 OR { 2531}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 104  and name HB2 ))
 OR { 2531}
   (  segid "    " and resid 37   and name HG1%)
   (  segid "    " and resid 48   and name HG1%)
 OR { 2531}
   (  segid "    " and resid 37   and name HG1%)
   (  segid "    " and resid 48   and name HG1%)
 ASSI { 2533}
   (  segid "    " and resid 12   and name HG2%)
   (( segid "    " and resid 17   and name HN  ))
      3.900     1.900     1.900 peak  2533 weight  0.10000E+01 volume  0.52089E-03 ppm1      0.859 ppm2      7.863 CV     1
 OR { 2533}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 48   and name HN  ))
 ASSI { 2534}
   (  segid "    " and resid 12   and name HG2%)
   (( segid "    " and resid 16   and name HN  ))
      3.700     1.700     1.700 peak  2534 weight  0.10000E+01 volume  0.55754E-03 ppm1      0.859 ppm2      8.404 CV     1
 OR { 2534}
   (  segid "    " and resid 12   and name HG2%)
   (( segid "    " and resid 114  and name HN  ))
 ASSI { 2535}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 45   and name HN  ))
      3.700     1.700     1.700 peak  2535 weight  0.10000E+01 volume  0.10360E-02 ppm1      0.860 ppm2      8.152 CV     1
 OR { 2535}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 104  and name HN  ))
 OR { 2535}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 98   and name HN  ))
 ASSI { 2536}
   (  segid "    " and resid 12   and name HG2%)
   (( segid "    " and resid 17   and name HA  ))
      4.800     2.900     1.200 peak  2536 weight  0.10000E+01 volume  0.11161E-03 ppm1      0.860 ppm2      5.557 CV     1
 OR { 2536}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 50   and name HA  ))
 ASSI { 2538}
   (  segid "    " and resid 12   and name HG2%)
   (( segid "    " and resid 115  and name HA  ))
      3.700     1.700     1.700 peak  2538 weight  0.10000E+01 volume  0.62639E-03 ppm1      0.860 ppm2      4.815 CV     1
 OR { 2538}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 97   and name HA  ))
 ASSI { 2540}
   (  segid "    " and resid 12   and name HG2%)
   (( segid "    " and resid 16   and name HA2 ))
      3.700     1.700     1.700 peak  2540 weight  0.10000E+01 volume  0.14174E-02 ppm1      0.860 ppm2      4.298 CV     1
 OR { 2540}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 45   and name HA  ))
 ASSI { 2542}
   (  segid "    " and resid 12   and name HG2%)
   (( segid "    " and resid 14   and name HA  ))
      3.800     1.800     1.800 peak  2542 weight  0.10000E+01 volume  0.69537E-03 ppm1      0.860 ppm2      3.905 CV     1
 OR { 2542}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 48   and name HA  ))
 OR { 2542}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 49   and name HB1 ))
 OR { 2542}
   (  segid "    " and resid 12   and name HG2%)
   (( segid "    " and resid 10   and name HA1 ))
 OR { 2542}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 104  and name HA  ))
 OR { 2542}
   (  segid "    " and resid 12   and name HG2%)
   (( segid "    " and resid 86   and name HA  ))
 OR { 2542}
   (  segid "    " and resid 12   and name HG2%)
   (( segid "    " and resid 114  and name HB  ))
 ASSI { 2543}
   (  segid "    " and resid 12   and name HG2%)
   (( segid "    " and resid 14   and name HD1 ))
      5.000     3.100     1.000 peak  2543 weight  0.10000E+01 volume  0.12709E-03 ppm1      0.863 ppm2      3.527 CV     1
 OR { 2543}
   (  segid "    " and resid 12   and name HG2%)
   (( segid "    " and resid 14   and name HD2 ))
 OR { 2543}
   (  segid "    " and resid 12   and name HG2%)
   (( segid "    " and resid 15   and name HA1 ))
 OR { 2543}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 49   and name HB2 ))
 OR { 2543}
   (  segid "    " and resid 12   and name HG2%)
   (( segid "    " and resid 116  and name HB2 ))
 ASSI { 2544}
   (  segid "    " and resid 12   and name HG2%)
   (( segid "    " and resid 13   and name HG2 ))
      4.400     2.400     1.600 peak  2544 weight  0.10000E+01 volume  0.24331E-03 ppm1      0.863 ppm2      2.397 CV     1
 OR { 2544}
   (  segid "    " and resid 12   and name HG2%)
   (( segid "    " and resid 13   and name HG1 ))
 OR { 2544}
   (  segid "    " and resid 12   and name HG2%)
   (( segid "    " and resid 113  and name HB  ))
 OR { 2544}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 96   and name HB1 ))
 ASSI { 2546}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 45   and name HG  ))
      2.900     1.100     1.100 peak  2546 weight  0.10000E+01 volume  0.24066E-02 ppm1      0.860 ppm2      1.271 CV     1
 OR { 2546}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 45   and name HB1 ))
 OR { 2546}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 104  and name HG  ))
 OR { 2546}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 104  and name HB2 ))
 OR { 2546}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 104  and name HB1 ))
 ASSI { 2552}
   (  segid "    " and resid 48   and name HG2%)
   (  segid "    " and resid 94   and name HE% )
      3.300     1.400     1.400 peak  2552 weight  0.10000E+01 volume  0.16028E-02 ppm1      0.871 ppm2      6.795 CV     1
 OR { 2552}
   (  segid "    " and resid 48   and name HG2%)
   (  segid "    " and resid 94   and name HE% )
 OR { 2552}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 47   and name HD1 ))
 OR { 2552}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 47   and name HD1 ))
 OR { 2552}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 36   and name HD1 ))
 OR { 2552}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 36   and name HD1 ))
 ASSI { 2556}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 49   and name HA  ))
      4.600     2.600     1.400 peak  2556 weight  0.10000E+01 volume  0.20096E-03 ppm1      0.871 ppm2      4.890 CV     1
 OR { 2556}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 49   and name HA  ))
 OR { 2556}
   (  segid "    " and resid 48   and name HG2%)
   (( segid "    " and resid 94   and name HA  ))
 ASSI { 2567}
   (  segid "    " and resid 48   and name HG2%)
   (  segid "    " and resid 64   and name HG1%)
      3.700     1.700     1.700 peak  2567 weight  0.10000E+01 volume  0.85482E-03 ppm1      0.870 ppm2      0.163 CV     1
 OR { 2567}
   (  segid "    " and resid 48   and name HG2%)
   (  segid "    " and resid 64   and name HG1%)
 OR { 2567}
   (  segid "    " and resid 48   and name HG2%)
   (  segid "    " and resid 81   and name HD2%)
 OR { 2567}
   (  segid "    " and resid 48   and name HG2%)
   (  segid "    " and resid 81   and name HD2%)
 ASSI { 2568}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 60   and name HN  ))
      5.000     3.100     1.000 peak  2568 weight  0.10000E+01 volume  0.87529E-04 ppm1      0.854 ppm2      8.876 CV     1
 OR { 2568}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 69   and name HN  ))
 OR { 2568}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 50   and name HN  ))
 OR { 2568}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 83   and name HN  ))
 ASSI { 2569}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 61   and name HN  ))
      3.400     1.400     1.400 peak  2569 weight  0.10000E+01 volume  0.94322E-03 ppm1      0.851 ppm2      7.622 CV     1
 OR { 2569}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 67   and name HN  ))
 ASSI { 2573}
   (  segid "    " and resid 64   and name HG2%)
   (  segid "    " and resid 60   and name HE% )
      5.500     3.800     0.500 peak  2573 weight  0.10000E+01 volume  0.70747E-04 ppm1      0.852 ppm2      6.728 CV     1
 OR { 2573}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 67   and name HE  ))
 OR { 2573}
   (  segid "    " and resid 64   and name HG2%)
   (  segid "    " and resid 94   and name HE% )
 ASSI { 2575}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 49   and name HA  ))
      3.500     1.600     1.600 peak  2575 weight  0.10000E+01 volume  0.23257E-03 ppm1      0.856 ppm2      4.894 CV     1
 OR { 2575}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 59   and name HA  ))
 ASSI { 2577}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 48   and name HA  ))
      3.300     1.400     1.400 peak  2577 weight  0.10000E+01 volume  0.78883E-03 ppm1      0.853 ppm2      3.881 CV     1
 OR { 2577}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 49   and name HB1 ))
 OR { 2577}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 63   and name HB2 ))
 OR { 2577}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 83   and name HA  ))
 ASSI { 2578}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 65   and name HA  ))
      4.100     2.100     1.900 peak  2578 weight  0.10000E+01 volume  0.41415E-03 ppm1      0.849 ppm2      3.608 CV     1
 OR { 2578}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 49   and name HB2 ))
 ASSI { 2579}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 68   and name HB2 ))
      3.100     1.200     1.200 peak  2579 weight  0.10000E+01 volume  0.17175E-02 ppm1      0.852 ppm2      2.919 CV     1
 OR { 2579}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 68   and name HB1 ))
 OR { 2579}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 60   and name HB2 ))
 ASSI { 2580}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 60   and name HB1 ))
      3.700     1.700     1.700 peak  2580 weight  0.10000E+01 volume  0.95402E-03 ppm1      0.852 ppm2      2.495 CV     1
 OR { 2580}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 38   and name HD1 ))
 OR { 2580}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 38   and name HD2 ))
 ASSI { 2582}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 65   and name HB2 ))
      4.200     2.200     1.800 peak  2582 weight  0.10000E+01 volume  0.40099E-03 ppm1      0.850 ppm2      1.807 CV     1
 OR { 2582}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 65   and name HB1 ))
 OR { 2582}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 65   and name HD1 ))
 OR { 2582}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 65   and name HD2 ))
 OR { 2582}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 83   and name HB2 ))
 ASSI { 2583}
   (  segid "    " and resid 64   and name HG2%)
   (  segid "    " and resid 61   and name HB% )
      2.900     1.100     1.100 peak  2583 weight  0.10000E+01 volume  0.16270E-02 ppm1      0.850 ppm2      1.415 CV     1
 OR { 2583}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 65   and name HG2 ))
 OR { 2583}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 65   and name HG1 ))
 OR { 2583}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 67   and name HG2 ))
 OR { 2583}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 67   and name HG1 ))
 OR { 2583}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 83   and name HG1 ))
 ASSI { 2589}
   (  segid "    " and resid 124  and name HD1%)
   (( segid "    " and resid 126  and name HG1 ))
      4.000     2.000     2.000 peak  2589 weight  0.10000E+01 volume  0.36420E-03 ppm1      0.834 ppm2      2.283 CV     1
 OR { 2589}
   (  segid "    " and resid 124  and name HD1%)
   (( segid "    " and resid 126  and name HG2 ))
 OR { 2589}
   (  segid "    " and resid 124  and name HD1%)
   (( segid "    " and resid 127  and name HG1 ))
 OR { 2589}
   (  segid "    " and resid 124  and name HD1%)
   (( segid "    " and resid 127  and name HG2 ))
 ASSI { 2600}
   (( segid "    " and resid 81   and name HB1 ))
   (  segid "    " and resid 20   and name HG2%)
      3.600     1.600     1.600 peak  2600 weight  0.10000E+01 volume  0.14896E-02 ppm1      0.676 ppm2     -0.097 CV     1
 OR { 2600}
   (( segid "    " and resid 81   and name HB1 ))
   (( segid "    " and resid 83   and name HG2 ))
 ASSI { 2605}
   (( segid "    " and resid 38   and name HB1 ))
   (( segid "    " and resid 94   and name HA  ))
      4.200     2.200     1.800 peak  2605 weight  0.10000E+01 volume  0.19658E-03 ppm1      0.688 ppm2      4.887 CV     1
 OR { 2605}
   (( segid "    " and resid 38   and name HB1 ))
   (( segid "    " and resid 39   and name HA  ))
 ASSI { 2612}
   (( segid "    " and resid 38   and name HB2 ))
   (( segid "    " and resid 39   and name HA  ))
      4.100     2.100     1.900 peak  2612 weight  0.10000E+01 volume  0.32344E-03 ppm1      0.731 ppm2      4.875 CV     1
 OR { 2612}
   (( segid "    " and resid 38   and name HB2 ))
   (( segid "    " and resid 94   and name HA  ))
 ASSI { 2617}
   (( segid "    " and resid 98   and name HD2 ))
   (( segid "    " and resid 34   and name HG2 ))
      4.400     2.400     1.600 peak  2617 weight  0.10000E+01 volume  0.22465E-03 ppm1      0.675 ppm2      2.398 CV     1
 OR { 2617}
   (( segid "    " and resid 98   and name HD2 ))
   (( segid "    " and resid 105  and name HB1 ))
 ASSI { 2623}
   (( segid "    " and resid 98   and name HD2 ))
   (( segid "    " and resid 77   and name HD22))
      5.900     4.300     0.100 peak  2623 weight  0.10000E+01 volume  0.15042E-04 ppm1      0.674 ppm2      6.898 CV     1
 OR { 2623}
   (( segid "    " and resid 98   and name HD2 ))
   (( segid "    " and resid 107  and name HD1 ))
 OR { 2623}
   (( segid "    " and resid 98   and name HD2 ))
   (  segid "    " and resid 95   and name HD% )
 ASSI { 2631}
   (  segid "    " and resid 2    and name HG2%)
   (( segid "    " and resid 77   and name HD22))
      3.500     1.600     1.600 peak  2631 weight  0.10000E+01 volume  0.64589E-03 ppm1      0.818 ppm2      6.879 CV     1
 OR { 2631}
   (  segid "    " and resid 12   and name HG1%)
   (( segid "    " and resid 82   and name HE22))
 OR { 2631}
   (  segid "    " and resid 12   and name HG1%)
   (( segid "    " and resid 82   and name HE21))
 OR { 2631}
   (  segid "    " and resid 2    and name HG2%)
   (( segid "    " and resid 107  and name HD1 ))
 ASSI { 2632}
   (  segid "    " and resid 12   and name HG1%)
   (( segid "    " and resid 13   and name HA  ))
      3.300     1.400     1.400 peak  2632 weight  0.10000E+01 volume  0.12044E-02 ppm1      0.809 ppm2      4.684 CV     1
 OR { 2632}
   (  segid "    " and resid 2    and name HG2%)
   (( segid "    " and resid 4    and name HA  ))
 ASSI { 2634}
   (  segid "    " and resid 12   and name HG1%)
   (( segid "    " and resid 17   and name HB2 ))
      4.000     2.000     2.000 peak  2634 weight  0.10000E+01 volume  0.55588E-03 ppm1      0.810 ppm2      3.769 CV     1
 OR { 2634}
   (  segid "    " and resid 12   and name HG1%)
   (( segid "    " and resid 116  and name HB1 ))
 ASSI { 2637}
   (  segid "    " and resid 2    and name HG2%)
   (( segid "    " and resid 1    and name HB1 ))
      3.500     1.600     1.600 peak  2637 weight  0.10000E+01 volume  0.30572E-03 ppm1      0.815 ppm2      2.590 CV     1
 OR { 2637}
   (  segid "    " and resid 2    and name HG2%)
   (( segid "    " and resid 77   and name HB1 ))
 ASSI { 2639}
   (  segid "    " and resid 12   and name HG1%)
   (( segid "    " and resid 113  and name HB  ))
      4.200     2.200     1.800 peak  2639 weight  0.10000E+01 volume  0.40463E-03 ppm1      0.814 ppm2      2.307 CV     1
 OR { 2639}
   (  segid "    " and resid 2    and name HG2%)
   (( segid "    " and resid 3    and name HG1 ))
 OR { 2639}
   (  segid "    " and resid 2    and name HG2%)
   (( segid "    " and resid 3    and name HG2 ))
 ASSI { 2641}
   (  segid "    " and resid 12   and name HG1%)
   (( segid "    " and resid 18   and name HB2 ))
      3.400     1.500     1.500 peak  2641 weight  0.10000E+01 volume  0.80580E-03 ppm1      0.818 ppm2      1.414 CV     1
 OR { 2641}
   (  segid "    " and resid 12   and name HG1%)
   (( segid "    " and resid 18   and name HG  ))
 OR { 2641}
   (  segid "    " and resid 12   and name HG1%)
   (( segid "    " and resid 18   and name HB1 ))
 OR { 2641}
   (  segid "    " and resid 12   and name HG1%)
   (( segid "    " and resid 86   and name HB1 ))
 OR { 2641}
   (  segid "    " and resid 2    and name HG2%)
   (( segid "    " and resid 4    and name HG  ))
 OR { 2641}
   (  segid "    " and resid 2    and name HG2%)
   (( segid "    " and resid 4    and name HB2 ))
 ASSI { 2651}
   (  segid "    " and resid 2    and name HG2%)
   (( segid "    " and resid 26   and name HA1 ))
      3.500     1.600     1.600 peak  2651 weight  0.10000E+01 volume  0.64980E-03 ppm1      0.786 ppm2      3.902 CV     1
 OR { 2651}
   (  segid "    " and resid 12   and name HG1%)
   (( segid "    " and resid 10   and name HA1 ))
 OR { 2651}
   (  segid "    " and resid 12   and name HG1%)
   (( segid "    " and resid 14   and name HA  ))
 OR { 2651}
   (  segid "    " and resid 2    and name HG2%)
   (( segid "    " and resid 25   and name HB2 ))
 OR { 2651}
   (  segid "    " and resid 2    and name HG2%)
   (( segid "    " and resid 25   and name HB1 ))
 OR { 2651}
   (  segid "    " and resid 12   and name HG1%)
   (( segid "    " and resid 86   and name HA  ))
 ASSI { 2653}
   (  segid "    " and resid 12   and name HG1%)
   (( segid "    " and resid 14   and name HD1 ))
      4.200     2.200     1.800 peak  2653 weight  0.10000E+01 volume  0.30901E-03 ppm1      0.785 ppm2      3.518 CV     1
 OR { 2653}
   (  segid "    " and resid 12   and name HG1%)
   (( segid "    " and resid 14   and name HD2 ))
 OR { 2653}
   (  segid "    " and resid 12   and name HG1%)
   (( segid "    " and resid 15   and name HA1 ))
 ASSI { 2655}
   (  segid "    " and resid 2    and name HG2%)
   (( segid "    " and resid 3    and name HB2 ))
      3.900     1.900     1.900 peak  2655 weight  0.10000E+01 volume  0.75231E-03 ppm1      0.786 ppm2      2.054 CV     1
 OR { 2655}
   (  segid "    " and resid 2    and name HG2%)
   (( segid "    " and resid 3    and name HB1 ))
 OR { 2655}
   (  segid "    " and resid 12   and name HG1%)
   (( segid "    " and resid 13   and name HB2 ))
 OR { 2655}
   (  segid "    " and resid 12   and name HG1%)
   (( segid "    " and resid 14   and name HG2 ))
 ASSI { 2657}
   (  segid "    " and resid 12   and name HG1%)
   (( segid "    " and resid 86   and name HB1 ))
      3.100     1.200     1.200 peak  2657 weight  0.10000E+01 volume  0.11006E-02 ppm1      0.788 ppm2      1.459 CV     1
 OR { 2657}
   (  segid "    " and resid 12   and name HG1%)
   (( segid "    " and resid 11   and name HG  ))
 ASSI { 2658}
   (  segid "    " and resid 12   and name HG1%)
   (( segid "    " and resid 18   and name HB2 ))
      2.800     0.900     0.900 peak  2658 weight  0.10000E+01 volume  0.35329E-02 ppm1      0.785 ppm2      1.276 CV     1
 OR { 2658}
   (  segid "    " and resid 12   and name HG1%)
   (( segid "    " and resid 86   and name HB2 ))
 OR { 2658}
   (  segid "    " and resid 12   and name HG1%)
   (( segid "    " and resid 18   and name HG  ))
 OR { 2658}
   (  segid "    " and resid 12   and name HG1%)
   (( segid "    " and resid 18   and name HB1 ))
 OR { 2658}
   (  segid "    " and resid 12   and name HG1%)
   (( segid "    " and resid 86   and name HG  ))
 OR { 2658}
   (  segid "    " and resid 2    and name HG2%)
   (( segid "    " and resid 4    and name HG  ))
 ASSI { 2659}
   (  segid "    " and resid 12   and name HG1%)
   (  segid "    " and resid 86   and name HD1%)
      2.100     0.600     0.600 peak  2659 weight  0.10000E+01 volume  0.16390E-01 ppm1      0.785 ppm2      0.555 CV     1
 OR { 2659}
   (  segid "    " and resid 12   and name HG1%)
   (  segid "    " and resid 113  and name HG2%)
 ASSI { 2666}
   (  segid "    " and resid 18   and name HD2%)
   (( segid "    " and resid 12   and name HB  ))
      3.300     1.400     1.400 peak  2666 weight  0.10000E+01 volume  0.91902E-03 ppm1      0.772 ppm2      1.841 CV     1
 OR { 2666}
   (  segid "    " and resid 18   and name HD2%)
   (( segid "    " and resid 83   and name HB2 ))
 OR { 2666}
   (  segid "    " and resid 18   and name HD2%)
   (( segid "    " and resid 19   and name HB1 ))
 ASSI { 2669}
   (  segid "    " and resid 18   and name HD2%)
   (( segid "    " and resid 19   and name HN  ))
      3.400     1.500     1.500 peak  2669 weight  0.10000E+01 volume  0.94391E-03 ppm1      0.772 ppm2      8.141 CV     1
 OR { 2669}
   (  segid "    " and resid 18   and name HD2%)
   (( segid "    " and resid 9    and name HN  ))
 ASSI { 2671}
   (  segid "    " and resid 18   and name HD2%)
   (  segid "    " and resid 20   and name HG2%)
      4.500     2.600     1.500 peak  2671 weight  0.10000E+01 volume  0.16849E-03 ppm1      0.775 ppm2     -0.085 CV     1
 OR { 2671}
   (  segid "    " and resid 18   and name HD2%)
   (( segid "    " and resid 83   and name HG2 ))
 ASSI { 2676}
   (  segid "    " and resid 11   and name HD1%)
   (( segid "    " and resid 12   and name HA  ))
      4.200     2.200     1.800 peak  2676 weight  0.10000E+01 volume  0.35172E-03 ppm1      0.823 ppm2      4.479 CV     1
 OR { 2676}
   (  segid "    " and resid 11   and name HD2%)
   (( segid "    " and resid 12   and name HA  ))
 OR { 2676}
   (  segid "    " and resid 11   and name HD1%)
   (( segid "    " and resid 112  and name HA  ))
 ASSI { 2683}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 5    and name HN  ))
      3.800     1.800     1.800 peak  2683 weight  0.10000E+01 volume  0.73401E-03 ppm1      0.679 ppm2      8.263 CV     1
 OR { 2683}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 23   and name HN  ))
 OR { 2683}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 24   and name HN  ))
 ASSI { 2686}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 107  and name HA  ))
      3.400     1.400     1.400 peak  2686 weight  0.10000E+01 volume  0.71952E-03 ppm1      0.682 ppm2      5.082 CV     1
 OR { 2686}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 24   and name HA  ))
 ASSI { 2688}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 106  and name HA  ))
      4.100     2.100     1.900 peak  2688 weight  0.10000E+01 volume  0.42515E-03 ppm1      0.682 ppm2      4.243 CV     1
 OR { 2688}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 108  and name HA1 ))
 OR { 2688}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 108  and name HA2 ))
 ASSI { 2690}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 96   and name HB1 ))
      4.200     2.200     1.800 peak  2690 weight  0.10000E+01 volume  0.34914E-03 ppm1      0.685 ppm2      2.365 CV     1
 OR { 2690}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 3    and name HG2 ))
 OR { 2690}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 3    and name HG1 ))
 OR { 2690}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 34   and name HG2 ))
 OR { 2690}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 5    and name HG1 ))
 OR { 2690}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 109  and name HB1 ))
 ASSI { 2691}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 98   and name HE1 ))
      3.000     1.100     1.100 peak  2691 weight  0.10000E+01 volume  0.13810E-02 ppm1      0.683 ppm2      1.757 CV     1
 OR { 2691}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 96   and name HB2 ))
 OR { 2691}
   (  segid "    " and resid 4    and name HD2%)
   (  segid "    " and resid 34   and name HE% )
 ASSI { 2693}
   (  segid "    " and resid 4    and name HD2%)
   (  segid "    " and resid 24   and name HB% )
      2.700     0.900     0.900 peak  2693 weight  0.10000E+01 volume  0.36355E-02 ppm1      0.682 ppm2      1.039 CV     1
 OR { 2693}
   (  segid "    " and resid 4    and name HD2%)
   (  segid "    " and resid 97   and name HB% )
 OR { 2693}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 98   and name HG2 ))
 OR { 2693}
   (  segid "    " and resid 4    and name HD2%)
   (( segid "    " and resid 98   and name HG1 ))
 ASSI { 2697}
   (  segid "    " and resid 2    and name HG1%)
   (( segid "    " and resid 107  and name HE3 ))
      3.500     1.500     1.500 peak  2697 weight  0.10000E+01 volume  0.87175E-03 ppm1      0.728 ppm2      7.068 CV     1
 OR { 2697}
   (  segid "    " and resid 2    and name HG1%)
   (  segid "    " and resid 32   and name HE% )
 ASSI { 2699}
   (  segid "    " and resid 2    and name HG1%)
   (( segid "    " and resid 27   and name HA  ))
      5.300     3.600     0.700 peak  2699 weight  0.10000E+01 volume  0.86246E-04 ppm1      0.729 ppm2      4.863 CV     1
 OR { 2699}
   (  segid "    " and resid 2    and name HG1%)
   (( segid "    " and resid 97   and name HA  ))
 ASSI { 2704}
   (  segid "    " and resid 2    and name HG1%)
   (( segid "    " and resid 1    and name HB1 ))
      3.600     1.700     1.700 peak  2704 weight  0.10000E+01 volume  0.24708E-03 ppm1      0.733 ppm2      2.614 CV     1
 OR { 2704}
   (  segid "    " and resid 2    and name HG1%)
   (( segid "    " and resid 77   and name HB1 ))
 OR { 2704}
   (  segid "    " and resid 2    and name HG1%)
   (( segid "    " and resid 109  and name HG2 ))
 ASSI { 2707}
   (  segid "    " and resid 2    and name HG1%)
   (( segid "    " and resid 4    and name HG  ))
      3.000     1.200     1.200 peak  2707 weight  0.10000E+01 volume  0.19834E-02 ppm1      0.728 ppm2      1.394 CV     1
 OR { 2707}
   (  segid "    " and resid 2    and name HG1%)
   (( segid "    " and resid 4    and name HB2 ))
 OR { 2707}
   (  segid "    " and resid 2    and name HG1%)
   (( segid "    " and resid 4    and name HB1 ))
 OR { 2707}
   (  segid "    " and resid 2    and name HG1%)
   (( segid "    " and resid 98   and name HB2 ))
 ASSI { 2709}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 22   and name HN  ))
      3.600     1.700     1.700 peak  2709 weight  0.10000E+01 volume  0.50999E-03 ppm1      0.662 ppm2      9.159 CV     1
 OR { 2709}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 80   and name HN  ))
 ASSI { 2711}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 24   and name HN  ))
      4.600     2.600     1.400 peak  2711 weight  0.10000E+01 volume  0.31467E-03 ppm1      0.662 ppm2      8.258 CV     1
 OR { 2711}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 23   and name HN  ))
 ASSI { 2721}
   (  segid "    " and resid 81   and name HD1%)
   (( segid "    " and resid 70   and name HN  ))
      4.200     2.200     1.800 peak  2721 weight  0.10000E+01 volume  0.21921E-03 ppm1      0.660 ppm2      9.226 CV     1
 OR { 2721}
   (  segid "    " and resid 81   and name HD1%)
   (( segid "    " and resid 80   and name HN  ))
 ASSI { 2722}
   (  segid "    " and resid 81   and name HD1%)
   (( segid "    " and resid 82   and name HN  ))
      3.200     1.200     1.200 peak  2722 weight  0.10000E+01 volume  0.12027E-02 ppm1      0.664 ppm2      8.869 CV     1
 OR { 2722}
   (  segid "    " and resid 81   and name HD1%)
   (( segid "    " and resid 69   and name HN  ))
 OR { 2722}
   (  segid "    " and resid 81   and name HD1%)
   (( segid "    " and resid 83   and name HN  ))
 ASSI { 2726}
   (  segid "    " and resid 81   and name HD1%)
   (  segid "    " and resid 94   and name HD% )
      2.800     1.000     1.000 peak  2726 weight  0.10000E+01 volume  0.22289E-02 ppm1      0.665 ppm2      6.966 CV     1
 OR { 2726}
   (  segid "    " and resid 81   and name HD1%)
   (  segid "    " and resid 68   and name HE% )
 OR { 2726}
   (  segid "    " and resid 81   and name HD1%)
   (  segid "    " and resid 68   and name HD% )
 OR { 2726}
   (  segid "    " and resid 81   and name HD1%)
   (( segid "    " and resid 68   and name HZ  ))
 ASSI { 2729}
   (  segid "    " and resid 81   and name HD1%)
   (( segid "    " and resid 19   and name HA  ))
      4.000     2.000     2.000 peak  2729 weight  0.10000E+01 volume  0.31751E-03 ppm1      0.663 ppm2      5.131 CV     1
 OR { 2729}
   (  segid "    " and resid 81   and name HD1%)
   (( segid "    " and resid 69   and name HA  ))
 ASSI { 2731}
   (  segid "    " and resid 81   and name HD1%)
   (( segid "    " and resid 49   and name HB1 ))
      3.300     1.400     1.400 peak  2731 weight  0.10000E+01 volume  0.51997E-03 ppm1      0.665 ppm2      3.817 CV     1
 OR { 2731}
   (  segid "    " and resid 81   and name HD1%)
   (( segid "    " and resid 69   and name HB  ))
 ASSI { 2733}
   (  segid "    " and resid 81   and name HD1%)
   (( segid "    " and resid 94   and name HB1 ))
      2.800     1.000     1.000 peak  2733 weight  0.10000E+01 volume  0.18133E-02 ppm1      0.664 ppm2      2.904 CV     1
 OR { 2733}
   (  segid "    " and resid 81   and name HD1%)
   (( segid "    " and resid 68   and name HB1 ))
 OR { 2733}
   (  segid "    " and resid 81   and name HD1%)
   (( segid "    " and resid 94   and name HB2 ))
 OR { 2733}
   (  segid "    " and resid 81   and name HD1%)
   (( segid "    " and resid 68   and name HB2 ))
 OR { 2733}
   (  segid "    " and resid 81   and name HD1%)
   (( segid "    " and resid 80   and name HB2 ))
 ASSI { 2735}
   (  segid "    " and resid 81   and name HD1%)
   (( segid "    " and resid 70   and name HB  ))
      3.100     1.200     1.200 peak  2735 weight  0.10000E+01 volume  0.15900E-02 ppm1      0.664 ppm2      1.960 CV     1
 OR { 2735}
   (  segid "    " and resid 81   and name HD1%)
   (( segid "    " and resid 20   and name HB  ))
 OR { 2735}
   (  segid "    " and resid 81   and name HD1%)
   (( segid "    " and resid 82   and name HB1 ))
 OR { 2735}
   (  segid "    " and resid 81   and name HD1%)
   (( segid "    " and resid 82   and name HB2 ))
 ASSI { 2737}
   (  segid "    " and resid 81   and name HD1%)
   (  segid "    " and resid 70   and name HD1%)
      2.500     0.800     0.800 peak  2737 weight  0.10000E+01 volume  0.56876E-02 ppm1      0.664 ppm2      1.011 CV     1
 OR { 2737}
   (  segid "    " and resid 81   and name HD1%)
   (  segid "    " and resid 83   and name HE% )
 OR { 2737}
   (  segid "    " and resid 81   and name HD1%)
   (( segid "    " and resid 83   and name HB1 ))
 ASSI { 2746}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 88   and name HB1 ))
      2.900     1.100     1.100 peak  2746 weight  0.10000E+01 volume  0.96023E-03 ppm1      0.656 ppm2      3.909 CV     1
 OR { 2746}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 88   and name HB2 ))
 OR { 2746}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 86   and name HA  ))
 OR { 2746}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 117  and name HB2 ))
 OR { 2746}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 117  and name HB1 ))
 ASSI { 2750}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 12   and name HA  ))
      3.000     1.200     1.200 peak  2750 weight  0.10000E+01 volume  0.16857E-02 ppm1      0.653 ppm2      4.473 CV     1
 OR { 2750}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 91   and name HA  ))
 ASSI { 2751}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 13   and name HN  ))
      4.100     2.100     1.900 peak  2751 weight  0.10000E+01 volume  0.21050E-03 ppm1      0.653 ppm2      8.174 CV     1
 OR { 2751}
   (  segid "    " and resid 115  and name HG1%)
   (( segid "    " and resid 86   and name HN  ))
 ASSI { 2754}
   (  segid "    " and resid 37   and name HG2%)
   (  segid "    " and resid 95   and name HD% )
      3.100     1.200     1.200 peak  2754 weight  0.10000E+01 volume  0.13214E-02 ppm1      0.642 ppm2      6.946 CV     1
 OR { 2754}
   (  segid "    " and resid 37   and name HG2%)
   (( segid "    " and resid 107  and name HD1 ))
 ASSI { 2769}
   (  segid "    " and resid 113  and name HG2%)
   (  segid "    " and resid 94   and name HE% )
      3.600     1.600     1.600 peak  2769 weight  0.10000E+01 volume  0.91792E-03 ppm1      0.622 ppm2      6.744 CV     1
 OR { 2769}
   (  segid "    " and resid 37   and name HG2%)
   (( segid "    " and resid 36   and name HZ3 ))
 ASSI { 2770}
   (  segid "    " and resid 113  and name HG2%)
   (( segid "    " and resid 114  and name HA  ))
      3.700     1.700     1.700 peak  2770 weight  0.10000E+01 volume  0.56366E-03 ppm1      0.624 ppm2      4.556 CV     1
 OR { 2770}
   (  segid "    " and resid 113  and name HG2%)
   (( segid "    " and resid 8    and name HA1 ))
 ASSI { 2773}
   (  segid "    " and resid 113  and name HG2%)
   (( segid "    " and resid 10   and name HA2 ))
      4.000     2.000     2.000 peak  2773 weight  0.10000E+01 volume  0.11996E-03 ppm1      0.621 ppm2      4.105 CV     1
 OR { 2773}
   (  segid "    " and resid 113  and name HG2%)
   (( segid "    " and resid 88   and name HA  ))
 ASSI { 2777}
   (  segid "    " and resid 113  and name HG2%)
   (( segid "    " and resid 90   and name HB1 ))
      4.900     3.000     1.100 peak  2777 weight  0.10000E+01 volume  0.11366E-03 ppm1      0.623 ppm2      3.057 CV     1
 OR { 2777}
   (  segid "    " and resid 37   and name HG2%)
   (( segid "    " and resid 107  and name HB1 ))
 ASSI { 2778}
   (  segid "    " and resid 37   and name HG2%)
   (( segid "    " and resid 96   and name HB2 ))
      4.300     2.300     1.700 peak  2778 weight  0.10000E+01 volume  0.29650E-03 ppm1      0.624 ppm2      1.842 CV     1
 OR { 2778}
   (  segid "    " and resid 37   and name HG2%)
   (( segid "    " and resid 46   and name HB1 ))
 OR { 2778}
   (  segid "    " and resid 113  and name HG2%)
   (( segid "    " and resid 115  and name HB  ))
 OR { 2778}
   (  segid "    " and resid 37   and name HG2%)
   (  segid "    " and resid 6    and name HB% )
 OR { 2778}
   (  segid "    " and resid 113  and name HG2%)
   (  segid "    " and resid 6    and name HB% )
 ASSI { 2779}
   (  segid "    " and resid 113  and name HG2%)
   (( segid "    " and resid 18   and name HB1 ))
      3.000     1.100     1.100 peak  2779 weight  0.10000E+01 volume  0.68438E-03 ppm1      0.619 ppm2      1.283 CV     1
 OR { 2779}
   (  segid "    " and resid 113  and name HG2%)
   (( segid "    " and resid 18   and name HB2 ))
 OR { 2779}
   (  segid "    " and resid 113  and name HG2%)
   (( segid "    " and resid 18   and name HG  ))
 OR { 2779}
   (  segid "    " and resid 113  and name HG2%)
   (( segid "    " and resid 86   and name HG  ))
 ASSI { 2780}
   (  segid "    " and resid 113  and name HG2%)
   (( segid "    " and resid 86   and name HB1 ))
      3.900     1.900     1.900 peak  2780 weight  0.10000E+01 volume  0.52590E-03 ppm1      0.624 ppm2      1.479 CV     1
 OR { 2780}
   (  segid "    " and resid 113  and name HG2%)
   (( segid "    " and resid 11   and name HG  ))
 OR { 2780}
   (  segid "    " and resid 113  and name HG2%)
   (( segid "    " and resid 11   and name HB1 ))
 ASSI { 2783}
   (  segid "    " and resid 18   and name HD1%)
   (( segid "    " and resid 114  and name HN  ))
      4.700     2.800     1.300 peak  2783 weight  0.10000E+01 volume  0.15603E-03 ppm1      0.652 ppm2      8.433 CV     1
 OR { 2783}
   (  segid "    " and resid 18   and name HD1%)
   (( segid "    " and resid 115  and name HN  ))
 ASSI { 2784}
   (  segid "    " and resid 18   and name HD1%)
   (( segid "    " and resid 11   and name HN  ))
      3.700     1.700     1.700 peak  2784 weight  0.10000E+01 volume  0.73562E-03 ppm1      0.650 ppm2      8.139 CV     1
 OR { 2784}
   (  segid "    " and resid 18   and name HD1%)
   (( segid "    " and resid 9    and name HN  ))
 OR { 2784}
   (  segid "    " and resid 18   and name HD1%)
   (( segid "    " and resid 20   and name HN  ))
 ASSI { 2788}
   (  segid "    " and resid 18   and name HD1%)
   (( segid "    " and resid 10   and name HA1 ))
      3.300     1.300     1.300 peak  2788 weight  0.10000E+01 volume  0.71952E-03 ppm1      0.651 ppm2      3.912 CV     1
 OR { 2788}
   (  segid "    " and resid 18   and name HD1%)
   (( segid "    " and resid 9    and name HA1 ))
 ASSI { 2790}
   (  segid "    " and resid 18   and name HD1%)
   (( segid "    " and resid 83   and name HB2 ))
      4.200     2.200     1.800 peak  2790 weight  0.10000E+01 volume  0.57952E-03 ppm1      0.652 ppm2      1.836 CV     1
 OR { 2790}
   (  segid "    " and resid 18   and name HD1%)
   (( segid "    " and resid 115  and name HB  ))
 OR { 2790}
   (  segid "    " and resid 18   and name HD1%)
   (( segid "    " and resid 82   and name HG2 ))
 ASSI { 2792}
   (  segid "    " and resid 18   and name HD1%)
   (( segid "    " and resid 11   and name HB1 ))
      4.000     2.000     2.000 peak  2792 weight  0.10000E+01 volume  0.44491E-03 ppm1      0.652 ppm2      1.479 CV     1
 OR { 2792}
   (  segid "    " and resid 18   and name HD1%)
   (( segid "    " and resid 11   and name HG  ))
 OR { 2792}
   (  segid "    " and resid 18   and name HD1%)
   (( segid "    " and resid 86   and name HB1 ))
 ASSI { 2794}
   (  segid "    " and resid 18   and name HD1%)
   (  segid "    " and resid 20   and name HG2%)
      4.100     2.100     1.900 peak  2794 weight  0.10000E+01 volume  0.27190E-03 ppm1      0.654 ppm2     -0.097 CV     1
 OR { 2794}
   (  segid "    " and resid 18   and name HD1%)
   (( segid "    " and resid 83   and name HG2 ))
 ASSI { 2795}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 3    and name HN  ))
      4.800     2.900     1.200 peak  2795 weight  0.10000E+01 volume  0.12208E-03 ppm1      0.589 ppm2      8.496 CV     1
 OR { 2795}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 105  and name HN  ))
 ASSI { 2796}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 5    and name HN  ))
      5.000     3.100     1.000 peak  2796 weight  0.10000E+01 volume  0.19443E-03 ppm1      0.588 ppm2      8.286 CV     1
 OR { 2796}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 23   and name HN  ))
 ASSI { 2798}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 107  and name HN  ))
      3.900     1.900     1.900 peak  2798 weight  0.10000E+01 volume  0.31119E-03 ppm1      0.589 ppm2      7.918 CV     1
 OR { 2798}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 108  and name HN  ))
 ASSI { 2799}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 107  and name HE3 ))
      3.200     1.200     1.200 peak  2799 weight  0.10000E+01 volume  0.13666E-02 ppm1      0.589 ppm2      6.984 CV     1
 OR { 2799}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 107  and name HD1 ))
 OR { 2799}
   (  segid "    " and resid 4    and name HD1%)
   (  segid "    " and resid 27   and name HD% )
 OR { 2799}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 107  and name HZ3 ))
 ASSI { 2800}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 107  and name HA  ))
      3.100     1.200     1.200 peak  2800 weight  0.10000E+01 volume  0.13170E-02 ppm1      0.589 ppm2      5.038 CV     1
 OR { 2800}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 24   and name HA  ))
 ASSI { 2801}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 5    and name HA  ))
      3.400     1.500     1.500 peak  2801 weight  0.10000E+01 volume  0.12629E-02 ppm1      0.589 ppm2      4.841 CV     1
 OR { 2801}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 23   and name HA  ))
 OR { 2801}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 95   and name HA  ))
 ASSI { 2802}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 106  and name HA  ))
      3.900     1.900     1.900 peak  2802 weight  0.10000E+01 volume  0.48271E-03 ppm1      0.589 ppm2      4.196 CV     1
 OR { 2802}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 108  and name HA1 ))
 OR { 2802}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 108  and name HA2 ))
 ASSI { 2805}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 3    and name HG2 ))
      3.800     1.800     1.800 peak  2805 weight  0.10000E+01 volume  0.61636E-03 ppm1      0.589 ppm2      2.382 CV     1
 OR { 2805}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 3    and name HG1 ))
 OR { 2805}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 96   and name HB1 ))
 OR { 2805}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 5    and name HG1 ))
 OR { 2805}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 34   and name HG2 ))
 OR { 2805}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 109  and name HB1 ))
 ASSI { 2806}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 3    and name HB1 ))
      4.600     2.600     1.400 peak  2806 weight  0.10000E+01 volume  0.21319E-03 ppm1      0.593 ppm2      2.120 CV     1
 OR { 2806}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 5    and name HB2 ))
 OR { 2806}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 5    and name HB1 ))
 ASSI { 2807}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 98   and name HE1 ))
      3.200     1.300     1.300 peak  2807 weight  0.10000E+01 volume  0.11692E-02 ppm1      0.590 ppm2      1.760 CV     1
 OR { 2807}
   (  segid "    " and resid 4    and name HD1%)
   (( segid "    " and resid 96   and name HB2 ))
 OR { 2807}
   (  segid "    " and resid 4    and name HD1%)
   (  segid "    " and resid 34   and name HE% )
 ASSI { 2809}
   (  segid "    " and resid 4    and name HD1%)
   (  segid "    " and resid 106  and name HB% )
      2.800     1.000     1.000 peak  2809 weight  0.10000E+01 volume  0.21346E-02 ppm1      0.589 ppm2      0.995 CV     1
 OR { 2809}
   (  segid "    " and resid 4    and name HD1%)
   (  segid "    " and resid 24   and name HB% )
 ASSI { 2813}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 16   and name HN  ))
      3.400     1.500     1.500 peak  2813 weight  0.10000E+01 volume  0.49789E-03 ppm1      0.520 ppm2      8.451 CV     1
 OR { 2813}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 85   and name HN  ))
 OR { 2813}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 90   and name HN  ))
 OR { 2813}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 115  and name HN  ))
 OR { 2813}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 114  and name HN  ))
 OR { 2813}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 116  and name HN  ))
 ASSI { 2815}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 84   and name HN  ))
      3.800     1.800     1.800 peak  2815 weight  0.10000E+01 volume  0.17442E-03 ppm1      0.519 ppm2      7.808 CV     1
 OR { 2815}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 17   and name HN  ))
 OR { 2815}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 91   and name HN  ))
 ASSI { 2818}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 18   and name HA  ))
      3.400     1.400     1.400 peak  2818 weight  0.10000E+01 volume  0.33325E-03 ppm1      0.522 ppm2      4.318 CV     1
 OR { 2818}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 15   and name HA2 ))
 OR { 2818}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 16   and name HA2 ))
 OR { 2818}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 91   and name HB  ))
 ASSI { 2820}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 85   and name HA  ))
      3.000     1.100     1.100 peak  2820 weight  0.10000E+01 volume  0.65026E-03 ppm1      0.520 ppm2      3.714 CV     1
 OR { 2820}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 16   and name HA1 ))
 OR { 2820}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 17   and name HB1 ))
 OR { 2820}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 17   and name HB2 ))
 OR { 2820}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 85   and name HB2 ))
 ASSI { 2826}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 84   and name HA  ))
      3.400     1.500     1.500 peak  2826 weight  0.10000E+01 volume  0.27598E-03 ppm1      0.522 ppm2      5.128 CV     1
 OR { 2826}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 19   and name HA  ))
 ASSI { 2829}
   (  segid "    " and resid 113  and name HG1%)
   (( segid "    " and resid 94   and name HN  ))
      4.000     2.000     2.000 peak  2829 weight  0.10000E+01 volume  0.31202E-03 ppm1      0.521 ppm2      9.114 CV     1
 OR { 2829}
   (  segid "    " and resid 113  and name HG1%)
   (( segid "    " and resid 92   and name HN  ))
 ASSI { 2831}
   (  segid "    " and resid 113  and name HG1%)
   (( segid "    " and resid 111  and name HN  ))
      3.800     1.800     1.800 peak  2831 weight  0.10000E+01 volume  0.15188E-03 ppm1      0.519 ppm2      8.777 CV     1
 OR { 2831}
   (  segid "    " and resid 113  and name HG1%)
   (( segid "    " and resid 21   and name HN  ))
 ASSI { 2833}
   (  segid "    " and resid 113  and name HG1%)
   (( segid "    " and resid 9    and name HN  ))
      4.000     2.000     2.000 peak  2833 weight  0.10000E+01 volume  0.11049E-03 ppm1      0.524 ppm2      8.124 CV     1
 OR { 2833}
   (  segid "    " and resid 113  and name HG1%)
   (( segid "    " and resid 20   and name HN  ))
 OR { 2833}
   (  segid "    " and resid 113  and name HG1%)
   (( segid "    " and resid 19   and name HN  ))
 ASSI { 2839}
   (  segid "    " and resid 113  and name HG1%)
   (( segid "    " and resid 10   and name HA2 ))
      4.300     2.300     1.700 peak  2839 weight  0.10000E+01 volume  0.10747E-03 ppm1      0.524 ppm2      4.100 CV     1
 OR { 2839}
   (  segid "    " and resid 113  and name HG1%)
   (( segid "    " and resid 88   and name HA  ))
 ASSI { 2840}
   (  segid "    " and resid 113  and name HG1%)
   (( segid "    " and resid 9    and name HA1 ))
      3.200     1.300     1.300 peak  2840 weight  0.10000E+01 volume  0.94850E-03 ppm1      0.521 ppm2      3.902 CV     1
 OR { 2840}
   (  segid "    " and resid 113  and name HG1%)
   (( segid "    " and resid 10   and name HA1 ))
 OR { 2840}
   (  segid "    " and resid 113  and name HG1%)
   (( segid "    " and resid 114  and name HB  ))
 ASSI { 2844}
   (  segid "    " and resid 113  and name HG1%)
   (( segid "    " and resid 112  and name HG1 ))
      4.100     2.100     1.900 peak  2844 weight  0.10000E+01 volume  0.27759E-03 ppm1      0.530 ppm2      2.000 CV     1
 OR { 2844}
   (  segid "    " and resid 113  and name HG1%)
   (( segid "    " and resid 112  and name HB1 ))
 OR { 2844}
   (  segid "    " and resid 113  and name HG1%)
   (( segid "    " and resid 93   and name HB  ))
 ASSI { 2846}
   (  segid "    " and resid 113  and name HG1%)
   (( segid "    " and resid 18   and name HB1 ))
      3.300     1.300     1.300 peak  2846 weight  0.10000E+01 volume  0.49306E-03 ppm1      0.524 ppm2      1.279 CV     1
 OR { 2846}
   (  segid "    " and resid 113  and name HG1%)
   (( segid "    " and resid 18   and name HG  ))
 OR { 2846}
   (  segid "    " and resid 113  and name HG1%)
   (( segid "    " and resid 18   and name HB2 ))
 OR { 2846}
   (  segid "    " and resid 113  and name HG1%)
   (( segid "    " and resid 86   and name HG  ))
 OR { 2846}
   (  segid "    " and resid 113  and name HG1%)
   (( segid "    " and resid 86   and name HB2 ))
 ASSI { 2847}
   (  segid "    " and resid 113  and name HG1%)
   (( segid "    " and resid 11   and name HG  ))
      4.600     2.700     1.400 peak  2847 weight  0.10000E+01 volume  0.15131E-03 ppm1      0.528 ppm2      1.460 CV     1
 OR { 2847}
   (  segid "    " and resid 113  and name HG1%)
   (( segid "    " and resid 38   and name HG2 ))
 OR { 2847}
   (  segid "    " and resid 113  and name HG1%)
   (  segid "    " and resid 91   and name HG2%)
 OR { 2847}
   (  segid "    " and resid 113  and name HG1%)
   (( segid "    " and resid 86   and name HB1 ))
 ASSI { 2848}
   (  segid "    " and resid 113  and name HG1%)
   (  segid "    " and resid 83   and name HE% )
      2.600     0.800     0.800 peak  2848 weight  0.10000E+01 volume  0.39514E-02 ppm1      0.522 ppm2      0.934 CV     1
 OR { 2848}
   (  segid "    " and resid 113  and name HG1%)
   (  segid "    " and resid 86   and name HD2%)
 ASSI { 2849}
   (  segid "    " and resid 113  and name HG1%)
   (  segid "    " and resid 20   and name HG2%)
      3.200     1.300     1.300 peak  2849 weight  0.10000E+01 volume  0.44192E-03 ppm1      0.525 ppm2     -0.102 CV     1
 OR { 2849}
   (  segid "    " and resid 113  and name HG1%)
   (( segid "    " and resid 83   and name HG2 ))
 ASSI { 2850}
   (  segid "    " and resid 113  and name HG1%)
   (  segid "    " and resid 20   and name HG1%)
      2.300     0.600     0.600 peak  2850 weight  0.10000E+01 volume  0.33106E-02 ppm1      0.521 ppm2      0.310 CV     1
 OR { 2850}
   (  segid "    " and resid 113  and name HG1%)
   (  segid "    " and resid 93   and name HG2%)
 ASSI { 2855}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 86   and name HN  ))
      4.600     2.600     1.400 peak  2855 weight  0.10000E+01 volume  0.11818E-03 ppm1      0.409 ppm2      8.159 CV     1
 OR { 2855}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 13   and name HN  ))
 ASSI { 2867}
   (  segid "    " and resid 115  and name HG2%)
   (  segid "    " and resid 86   and name HD2%)
      2.500     0.800     0.800 peak  2867 weight  0.10000E+01 volume  0.41040E-02 ppm1      0.408 ppm2      0.844 CV     1
 OR { 2867}
   (  segid "    " and resid 115  and name HG2%)
   (  segid "    " and resid 12   and name HG2%)
 ASSI { 2870}
   (  segid "    " and resid 93   and name HG2%)
   (( segid "    " and resid 113  and name HN  ))
      3.800     1.800     1.800 peak  2870 weight  0.10000E+01 volume  0.13087E-02 ppm1      0.378 ppm2      8.949 CV     1
 OR { 2870}
   (  segid "    " and resid 93   and name HG2%)
   (( segid "    " and resid 110  and name HN  ))
 ASSI { 2871}
   (  segid "    " and resid 93   and name HG2%)
   (( segid "    " and resid 111  and name HN  ))
      3.200     1.300     1.300 peak  2871 weight  0.10000E+01 volume  0.12140E-02 ppm1      0.378 ppm2      8.789 CV     1
 OR { 2871}
   (  segid "    " and resid 93   and name HG2%)
   (( segid "    " and resid 112  and name HN  ))
 ASSI { 2874}
   (  segid "    " and resid 93   and name HG2%)
   (  segid "    " and resid 95   and name HD% )
      3.900     1.900     1.900 peak  2874 weight  0.10000E+01 volume  0.42036E-03 ppm1      0.379 ppm2      6.909 CV     1
 OR { 2874}
   (  segid "    " and resid 93   and name HG2%)
   (  segid "    " and resid 94   and name HD% )
 OR { 2874}
   (  segid "    " and resid 93   and name HG2%)
   (( segid "    " and resid 112  and name HE22))
 ASSI { 2875}
   (  segid "    " and resid 93   and name HG2%)
   (  segid "    " and resid 95   and name HE% )
      3.300     1.400     1.400 peak  2875 weight  0.10000E+01 volume  0.14945E-02 ppm1      0.379 ppm2      6.712 CV     1
 OR { 2875}
   (  segid "    " and resid 93   and name HG2%)
   (( segid "    " and resid 112  and name HE21))
 OR { 2875}
   (  segid "    " and resid 93   and name HG2%)
   (  segid "    " and resid 94   and name HE% )
 OR { 2875}
   (  segid "    " and resid 93   and name HG2%)
   (( segid "    " and resid 36   and name HZ3 ))
 ASSI { 2876}
   (  segid "    " and resid 93   and name HG2%)
   (( segid "    " and resid 94   and name HA  ))
      3.700     1.700     1.700 peak  2876 weight  0.10000E+01 volume  0.43427E-03 ppm1      0.375 ppm2      4.881 CV     1
 OR { 2876}
   (  segid "    " and resid 93   and name HG2%)
   (( segid "    " and resid 111  and name HA  ))
 OR { 2876}
   (  segid "    " and resid 93   and name HG2%)
   (( segid "    " and resid 95   and name HA  ))
 ASSI { 2882}
   (  segid "    " and resid 93   and name HG2%)
   (( segid "    " and resid 39   and name HB1 ))
      3.700     1.700     1.700 peak  2882 weight  0.10000E+01 volume  0.45894E-03 ppm1      0.379 ppm2      2.290 CV     1
 OR { 2882}
   (  segid "    " and resid 93   and name HG2%)
   (( segid "    " and resid 112  and name HG2 ))
 ASSI { 2891}
   (  segid "    " and resid 20   and name HG1%)
   (  segid "    " and resid 94   and name HD% )
      3.900     1.900     1.900 peak  2891 weight  0.10000E+01 volume  0.29125E-03 ppm1      0.307 ppm2      6.924 CV     1
 OR { 2891}
   (  segid "    " and resid 20   and name HG1%)
   (( segid "    " and resid 36   and name HZ2 ))
 ASSI { 2892}
   (  segid "    " and resid 20   and name HG1%)
   (( segid "    " and resid 21   and name HA  ))
      4.700     2.800     1.300 peak  2892 weight  0.10000E+01 volume  0.11370E-03 ppm1      0.307 ppm2      5.762 CV     1
 OR { 2892}
   (  segid "    " and resid 20   and name HG1%)
   (( segid "    " and resid 6    and name HA  ))
 ASSI { 2895}
   (  segid "    " and resid 20   and name HG1%)
   (( segid "    " and resid 8    and name HA1 ))
      4.500     2.500     1.500 peak  2895 weight  0.10000E+01 volume  0.30090E-03 ppm1      0.306 ppm2      4.573 CV     1
 OR { 2895}
   (  segid "    " and resid 20   and name HG1%)
   (( segid "    " and resid 81   and name HA  ))
 ASSI { 2896}
   (  segid "    " and resid 20   and name HG1%)
   (( segid "    " and resid 113  and name HA  ))
      4.600     2.700     1.400 peak  2896 weight  0.10000E+01 volume  0.24786E-03 ppm1      0.311 ppm2      4.369 CV     1
 OR { 2896}
   (  segid "    " and resid 20   and name HG1%)
   (( segid "    " and resid 18   and name HA  ))
 ASSI { 2897}
   (  segid "    " and resid 20   and name HG1%)
   (( segid "    " and resid 9    and name HA1 ))
      3.600     1.600     1.600 peak  2897 weight  0.10000E+01 volume  0.11405E-02 ppm1      0.307 ppm2      3.901 CV     1
 OR { 2897}
   (  segid "    " and resid 20   and name HG1%)
   (( segid "    " and resid 7    and name HB1 ))
 OR { 2897}
   (  segid "    " and resid 20   and name HG1%)
   (( segid "    " and resid 83   and name HA  ))
 ASSI { 2898}
   (  segid "    " and resid 20   and name HG1%)
   (( segid "    " and resid 8    and name HA2 ))
      4.000     2.000     2.000 peak  2898 weight  0.10000E+01 volume  0.46423E-03 ppm1      0.306 ppm2      3.759 CV     1
 OR { 2898}
   (  segid "    " and resid 20   and name HG1%)
   (( segid "    " and resid 111  and name HB  ))
 OR { 2898}
   (  segid "    " and resid 20   and name HG1%)
   (( segid "    " and resid 21   and name HB1 ))
 ASSI { 2899}
   (  segid "    " and resid 20   and name HG1%)
   (( segid "    " and resid 9    and name HA2 ))
      3.800     1.800     1.800 peak  2899 weight  0.10000E+01 volume  0.59824E-03 ppm1      0.307 ppm2      3.532 CV     1
 OR { 2899}
   (  segid "    " and resid 20   and name HG1%)
   (( segid "    " and resid 21   and name HB2 ))
 ASSI { 2902}
   (  segid "    " and resid 20   and name HG1%)
   (  segid "    " and resid 6    and name HB% )
      4.200     2.200     1.800 peak  2902 weight  0.10000E+01 volume  0.45620E-03 ppm1      0.308 ppm2      1.758 CV     1
 OR { 2902}
   (  segid "    " and resid 20   and name HG1%)
   (( segid "    " and resid 19   and name HB1 ))
 OR { 2902}
   (  segid "    " and resid 20   and name HG1%)
   (( segid "    " and resid 83   and name HB2 ))
 ASSI { 2903}
   (  segid "    " and resid 20   and name HG1%)
   (( segid "    " and resid 18   and name HB1 ))
      3.500     1.500     1.500 peak  2903 weight  0.10000E+01 volume  0.11657E-02 ppm1      0.307 ppm2      1.275 CV     1
 OR { 2903}
   (  segid "    " and resid 20   and name HG1%)
   (( segid "    " and resid 18   and name HG  ))
 OR { 2903}
   (  segid "    " and resid 20   and name HG1%)
   (( segid "    " and resid 19   and name HG2 ))
 OR { 2903}
   (  segid "    " and resid 20   and name HG1%)
   (( segid "    " and resid 83   and name HG1 ))
 OR { 2903}
   (  segid "    " and resid 20   and name HG1%)
   (( segid "    " and resid 18   and name HB2 ))
 OR { 2903}
   (  segid "    " and resid 20   and name HG1%)
   (( segid "    " and resid 19   and name HG1 ))
 ASSI { 2904}
   (  segid "    " and resid 20   and name HG1%)
   (  segid "    " and resid 83   and name HE% )
      2.400     0.700     0.700 peak  2904 weight  0.10000E+01 volume  0.52383E-02 ppm1      0.307 ppm2      1.039 CV     1
 OR { 2904}
   (  segid "    " and resid 20   and name HG1%)
   (  segid "    " and resid 111  and name HG2%)
 ASSI { 2905}
   (  segid "    " and resid 20   and name HG1%)
   (  segid "    " and resid 113  and name HG1%)
      2.800     1.000     1.000 peak  2905 weight  0.10000E+01 volume  0.29154E-02 ppm1      0.307 ppm2      0.610 CV     1
 OR { 2905}
   (  segid "    " and resid 20   and name HG1%)
   (  segid "    " and resid 113  and name HG2%)
 OR { 2905}
   (  segid "    " and resid 20   and name HG1%)
   (  segid "    " and resid 18   and name HD1%)
 OR { 2905}
   (  segid "    " and resid 20   and name HG1%)
   (( segid "    " and resid 81   and name HB1 ))
 ASSI { 2907}
   (  segid "    " and resid 45   and name HD2%)
   (( segid "    " and resid 107  and name HE1 ))
      3.900     1.900     1.900 peak  2907 weight  0.10000E+01 volume  0.55248E-03 ppm1      0.325 ppm2      9.605 CV     1
 OR { 2907}
   (  segid "    " and resid 45   and name HD1%)
   (( segid "    " and resid 107  and name HE1 ))
 OR { 2907}
   (  segid "    " and resid 45   and name HD1%)
   (( segid "    " and resid 37   and name HN  ))
 ASSI { 2908}
   (  segid "    " and resid 45   and name HD1%)
   (( segid "    " and resid 46   and name HN  ))
      3.800     1.800     1.800 peak  2908 weight  0.10000E+01 volume  0.10083E-02 ppm1      0.329 ppm2      9.380 CV     1
 OR { 2908}
   (  segid "    " and resid 45   and name HD1%)
   (( segid "    " and resid 38   and name HN  ))
 OR { 2908}
   (  segid "    " and resid 45   and name HD1%)
   (( segid "    " and resid 95   and name HN  ))
 ASSI { 2911}
   (  segid "    " and resid 45   and name HD1%)
   (( segid "    " and resid 93   and name HN  ))
      4.000     2.000     2.000 peak  2911 weight  0.10000E+01 volume  0.29360E-03 ppm1      0.330 ppm2      7.764 CV     1
 OR { 2911}
   (  segid "    " and resid 45   and name HD2%)
   (( segid "    " and resid 106  and name HN  ))
 OR { 2911}
   (  segid "    " and resid 45   and name HD1%)
   (( segid "    " and resid 106  and name HN  ))
 ASSI { 2912}
   (  segid "    " and resid 45   and name HD2%)
   (( segid "    " and resid 107  and name HZ2 ))
      3.500     1.600     1.600 peak  2912 weight  0.10000E+01 volume  0.51302E-03 ppm1      0.330 ppm2      7.174 CV     1
 OR { 2912}
   (  segid "    " and resid 45   and name HD1%)
   (( segid "    " and resid 107  and name HZ2 ))
 OR { 2912}
   (  segid "    " and resid 45   and name HD1%)
   (( segid "    " and resid 38   and name HE  ))
 OR { 2912}
   (  segid "    " and resid 45   and name HD1%)
   (( segid "    " and resid 107  and name HH2 ))
 ASSI { 2914}
   (  segid "    " and resid 45   and name HD1%)
   (  segid "    " and resid 95   and name HE% )
      3.100     1.200     1.200 peak  2914 weight  0.10000E+01 volume  0.14992E-02 ppm1      0.332 ppm2      6.719 CV     1
 OR { 2914}
   (  segid "    " and resid 45   and name HD1%)
   (( segid "    " and resid 39   and name HE22))
 ASSI { 2916}
   (  segid "    " and resid 45   and name HD1%)
   (( segid "    " and resid 37   and name HA  ))
      4.300     2.300     1.700 peak  2916 weight  0.10000E+01 volume  0.46041E-03 ppm1      0.330 ppm2      5.058 CV     1
 OR { 2916}
   (  segid "    " and resid 45   and name HD1%)
   (( segid "    " and resid 107  and name HA  ))
 ASSI { 2917}
   (  segid "    " and resid 45   and name HD1%)
   (( segid "    " and resid 39   and name HA  ))
      4.200     2.200     1.800 peak  2917 weight  0.10000E+01 volume  0.59144E-03 ppm1      0.331 ppm2      4.872 CV     1
 OR { 2917}
   (  segid "    " and resid 45   and name HD1%)
   (( segid "    " and resid 95   and name HA  ))
 ASSI { 2919}
   (  segid "    " and resid 45   and name HD2%)
   (( segid "    " and resid 47   and name HA  ))
      4.500     2.500     1.500 peak  2919 weight  0.10000E+01 volume  0.19960E-03 ppm1      0.328 ppm2      4.430 CV     1
 OR { 2919}
   (  segid "    " and resid 45   and name HD1%)
   (( segid "    " and resid 47   and name HA  ))
 OR { 2919}
   (  segid "    " and resid 45   and name HD1%)
   (( segid "    " and resid 93   and name HA  ))
 ASSI { 2931}
   (  segid "    " and resid 104  and name HD2%)
   (( segid "    " and resid 105  and name HN  ))
      4.100     2.100     1.900 peak  2931 weight  0.10000E+01 volume  0.30100E-03 ppm1      0.398 ppm2      8.483 CV     1
 OR { 2931}
   (  segid "    " and resid 104  and name HD2%)
   (( segid "    " and resid 99   and name HN  ))
 ASSI { 2933}
   (  segid "    " and resid 104  and name HD2%)
   (( segid "    " and resid 107  and name HE3 ))
      4.000     2.000     2.000 peak  2933 weight  0.10000E+01 volume  0.18839E-03 ppm1      0.404 ppm2      7.030 CV     1
 OR { 2933}
   (  segid "    " and resid 104  and name HD2%)
   (( segid "    " and resid 47   and name HZ2 ))
 OR { 2933}
   (  segid "    " and resid 104  and name HD2%)
   (( segid "    " and resid 49   and name HG  ))
 OR { 2933}
   (  segid "    " and resid 104  and name HD2%)
   (  segid "    " and resid 27   and name HE% )
 OR { 2933}
   (  segid "    " and resid 104  and name HD2%)
   (  segid "    " and resid 94   and name HD% )
 OR { 2933}
   (  segid "    " and resid 104  and name HD2%)
   (  segid "    " and resid 27   and name HD% )
 OR { 2933}
   (  segid "    " and resid 104  and name HD2%)
   (  segid "    " and resid 59   and name HD% )
 OR { 2933}
   (  segid "    " and resid 104  and name HD2%)
   (( segid "    " and resid 27   and name HZ  ))
 ASSI { 2937}
   (  segid "    " and resid 104  and name HD2%)
   (( segid "    " and resid 47   and name HA  ))
      3.600     1.600     1.600 peak  2937 weight  0.10000E+01 volume  0.20671E-03 ppm1      0.404 ppm2      4.450 CV     1
 OR { 2937}
   (  segid "    " and resid 104  and name HD2%)
   (( segid "    " and resid 103  and name HA  ))
 ASSI { 2938}
   (  segid "    " and resid 104  and name HD2%)
   (( segid "    " and resid 106  and name HA  ))
      4.900     3.000     1.100 peak  2938 weight  0.10000E+01 volume  0.12639E-03 ppm1      0.404 ppm2      4.153 CV     1
 OR { 2938}
   (  segid "    " and resid 104  and name HD2%)
   (( segid "    " and resid 45   and name HA  ))
 ASSI { 2940}
   (  segid "    " and resid 104  and name HD2%)
   (( segid "    " and resid 47   and name HB2 ))
      3.600     1.700     1.700 peak  2940 weight  0.10000E+01 volume  0.37992E-03 ppm1      0.403 ppm2      3.204 CV     1
 OR { 2940}
   (  segid "    " and resid 104  and name HD2%)
   (( segid "    " and resid 47   and name HB1 ))
 OR { 2940}
   (  segid "    " and resid 104  and name HD2%)
   (( segid "    " and resid 107  and name HB2 ))
 ASSI { 2952}
   (  segid "    " and resid 79   and name HD1%)
   (( segid "    " and resid 35   and name HA  ))
      3.500     1.500     1.500 peak  2952 weight  0.10000E+01 volume  0.67886E-03 ppm1      0.404 ppm2      5.689 CV     1
 OR { 2952}
   (  segid "    " and resid 79   and name HD1%)
   (( segid "    " and resid 80   and name HA  ))
 OR { 2952}
   (  segid "    " and resid 79   and name HD1%)
   (( segid "    " and resid 34   and name HA  ))
 ASSI { 2953}
   (  segid "    " and resid 79   and name HD1%)
   (( segid "    " and resid 72   and name HA  ))
      4.300     2.300     1.700 peak  2953 weight  0.10000E+01 volume  0.21548E-03 ppm1      0.406 ppm2      5.387 CV     1
 OR { 2953}
   (  segid "    " and resid 79   and name HD1%)
   (( segid "    " and resid 70   and name HA  ))
 ASSI { 2956}
   (  segid "    " and resid 79   and name HD1%)
   (( segid "    " and resid 22   and name HB1 ))
      2.800     1.000     1.000 peak  2956 weight  0.10000E+01 volume  0.16577E-02 ppm1      0.405 ppm2      3.005 CV     1
 OR { 2956}
   (  segid "    " and resid 79   and name HD1%)
   (( segid "    " and resid 22   and name HB2 ))
 OR { 2956}
   (  segid "    " and resid 79   and name HD1%)
   (( segid "    " and resid 72   and name HD1 ))
 OR { 2956}
   (  segid "    " and resid 79   and name HD1%)
   (( segid "    " and resid 80   and name HB2 ))
 ASSI { 2957}
   (  segid "    " and resid 79   and name HD1%)
   (( segid "    " and resid 36   and name HB2 ))
      4.600     2.600     1.400 peak  2957 weight  0.10000E+01 volume  0.26325E-03 ppm1      0.406 ppm2      2.726 CV     1
 OR { 2957}
   (  segid "    " and resid 79   and name HD1%)
   (( segid "    " and resid 80   and name HB1 ))
 OR { 2957}
   (  segid "    " and resid 79   and name HD1%)
   (( segid "    " and resid 73   and name HB2 ))
 ASSI { 2960}
   (  segid "    " and resid 79   and name HD1%)
   (( segid "    " and resid 34   and name HB1 ))
      3.000     1.100     1.100 peak  2960 weight  0.10000E+01 volume  0.16300E-02 ppm1      0.408 ppm2      1.943 CV     1
 OR { 2960}
   (  segid "    " and resid 79   and name HD1%)
   (( segid "    " and resid 72   and name HB1 ))
 OR { 2960}
   (  segid "    " and resid 79   and name HD1%)
   (( segid "    " and resid 70   and name HB  ))
 ASSI { 2962}
   (  segid "    " and resid 79   and name HD1%)
   (  segid "    " and resid 35   and name HB% )
      3.000     1.100     1.100 peak  2962 weight  0.10000E+01 volume  0.63048E-03 ppm1      0.407 ppm2      1.447 CV     1
 OR { 2962}
   (  segid "    " and resid 79   and name HD1%)
   (( segid "    " and resid 98   and name HB1 ))
 OR { 2962}
   (  segid "    " and resid 79   and name HD1%)
   (( segid "    " and resid 98   and name HB2 ))
 OR { 2962}
   (  segid "    " and resid 79   and name HD1%)
   (( segid "    " and resid 4    and name HG  ))
 OR { 2962}
   (  segid "    " and resid 79   and name HD1%)
   (( segid "    " and resid 4    and name HB1 ))
 ASSI { 2965}
   (  segid "    " and resid 79   and name HD1%)
   (  segid "    " and resid 81   and name HD1%)
      3.800     1.800     1.800 peak  2965 weight  0.10000E+01 volume  0.59217E-03 ppm1      0.402 ppm2      0.670 CV     1
 OR { 2965}
   (  segid "    " and resid 79   and name HD1%)
   (( segid "    " and resid 81   and name HB1 ))
 OR { 2965}
   (  segid "    " and resid 79   and name HD1%)
   (  segid "    " and resid 78   and name HG2%)
 ASSI { 2968}
   (  segid "    " and resid 64   and name HG1%)
   (( segid "    " and resid 61   and name HN  ))
      3.800     1.800     1.800 peak  2968 weight  0.10000E+01 volume  0.40653E-03 ppm1      0.191 ppm2      7.658 CV     1
 OR { 2968}
   (  segid "    " and resid 64   and name HG1%)
   (( segid "    " and resid 67   and name HN  ))
 ASSI { 2971}
   (  segid "    " and resid 64   and name HG1%)
   (  segid "    " and resid 60   and name HE% )
      3.500     1.500     1.500 peak  2971 weight  0.10000E+01 volume  0.11267E-02 ppm1      0.193 ppm2      6.786 CV     1
 OR { 2971}
   (  segid "    " and resid 64   and name HG1%)
   (( segid "    " and resid 67   and name HE  ))
 ASSI { 2975}
   (  segid "    " and resid 64   and name HG1%)
   (( segid "    " and resid 63   and name HB2 ))
      3.000     1.100     1.100 peak  2975 weight  0.10000E+01 volume  0.92887E-03 ppm1      0.192 ppm2      3.857 CV     1
 OR { 2975}
   (  segid "    " and resid 64   and name HG1%)
   (( segid "    " and resid 63   and name HB1 ))
 OR { 2975}
   (  segid "    " and resid 64   and name HG1%)
   (( segid "    " and resid 48   and name HA  ))
 OR { 2975}
   (  segid "    " and resid 64   and name HG1%)
   (( segid "    " and resid 49   and name HB1 ))
 ASSI { 2977}
   (  segid "    " and resid 64   and name HG1%)
   (( segid "    " and resid 68   and name HB2 ))
      3.500     1.500     1.500 peak  2977 weight  0.10000E+01 volume  0.46965E-03 ppm1      0.191 ppm2      2.898 CV     1
 OR { 2977}
   (  segid "    " and resid 64   and name HG1%)
   (( segid "    " and resid 68   and name HB1 ))
 OR { 2977}
   (  segid "    " and resid 64   and name HG1%)
   (( segid "    " and resid 60   and name HB2 ))
 ASSI { 2979}
   (  segid "    " and resid 64   and name HG1%)
   (( segid "    " and resid 67   and name HB2 ))
      4.800     2.800     1.200 peak  2979 weight  0.10000E+01 volume  0.13639E-03 ppm1      0.194 ppm2      2.166 CV     1
 OR { 2979}
   (  segid "    " and resid 64   and name HG1%)
   (( segid "    " and resid 70   and name HG11))
 ASSI { 2980}
   (  segid "    " and resid 64   and name HG1%)
   (( segid "    " and resid 48   and name HB  ))
      3.400     1.400     1.400 peak  2980 weight  0.10000E+01 volume  0.35718E-03 ppm1      0.188 ppm2      1.949 CV     1
 OR { 2980}
   (  segid "    " and resid 64   and name HG1%)
   (( segid "    " and resid 70   and name HB  ))
 ASSI { 2981}
   (  segid "    " and resid 64   and name HG1%)
   (( segid "    " and resid 87   and name HD1 ))
      4.000     2.000     2.000 peak  2981 weight  0.10000E+01 volume  0.29061E-03 ppm1      0.192 ppm2      1.624 CV     1
 OR { 2981}
   (  segid "    " and resid 64   and name HG1%)
   (( segid "    " and resid 67   and name HB1 ))
 ASSI { 2982}
   (  segid "    " and resid 64   and name HG1%)
   (( segid "    " and resid 65   and name HG2 ))
      3.400     1.400     1.400 peak  2982 weight  0.10000E+01 volume  0.13225E-02 ppm1      0.192 ppm2      1.400 CV     1
 OR { 2982}
   (  segid "    " and resid 64   and name HG1%)
   (( segid "    " and resid 67   and name HG2 ))
 OR { 2982}
   (  segid "    " and resid 64   and name HG1%)
   (( segid "    " and resid 65   and name HG1 ))
 OR { 2982}
   (  segid "    " and resid 64   and name HG1%)
   (( segid "    " and resid 67   and name HG1 ))
 ASSI { 2985}
   (  segid "    " and resid 64   and name HG1%)
   (  segid "    " and resid 81   and name HD1%)
      4.100     2.100     1.900 peak  2985 weight  0.10000E+01 volume  0.32578E-03 ppm1      0.190 ppm2      0.634 CV     1
 OR { 2985}
   (  segid "    " and resid 64   and name HG1%)
   (( segid "    " and resid 38   and name HB1 ))
 OR { 2985}
   (  segid "    " and resid 64   and name HG1%)
   (( segid "    " and resid 81   and name HB1 ))
 ASSI { 2987}
   (  segid "    " and resid 81   and name HD2%)
   (( segid "    " and resid 82   and name HN  ))
      4.300     2.300     1.700 peak  2987 weight  0.10000E+01 volume  0.33250E-03 ppm1      0.151 ppm2      8.861 CV     1
 OR { 2987}
   (  segid "    " and resid 81   and name HD2%)
   (( segid "    " and resid 69   and name HN  ))
 OR { 2987}
   (  segid "    " and resid 81   and name HD2%)
   (( segid "    " and resid 83   and name HN  ))
 ASSI { 2990}
   (  segid "    " and resid 81   and name HD2%)
   (( segid "    " and resid 36   and name HE3 ))
      4.200     2.200     1.800 peak  2990 weight  0.10000E+01 volume  0.21926E-03 ppm1      0.152 ppm2      7.679 CV     1
 OR { 2990}
   (  segid "    " and resid 81   and name HD2%)
   (( segid "    " and resid 84   and name HN  ))
 ASSI { 2998}
   (  segid "    " and resid 81   and name HD2%)
   (( segid "    " and resid 83   and name HG2 ))
      3.000     1.100     1.100 peak  2998 weight  0.10000E+01 volume  0.20505E-02 ppm1      0.151 ppm2     -0.096 CV     1
 OR { 2998}
   (  segid "    " and resid 81   and name HD2%)
   (  segid "    " and resid 20   and name HG2%)
 ASSI { 2999}
   (  segid "    " and resid 81   and name HD2%)
   (( segid "    " and resid 70   and name HB  ))
      3.600     1.600     1.600 peak  2999 weight  0.10000E+01 volume  0.55690E-03 ppm1      0.152 ppm2      1.968 CV     1
 OR { 2999}
   (  segid "    " and resid 81   and name HD2%)
   (( segid "    " and resid 82   and name HB1 ))
 OR { 2999}
   (  segid "    " and resid 81   and name HD2%)
   (( segid "    " and resid 82   and name HB2 ))
 OR { 2999}
   (  segid "    " and resid 81   and name HD2%)
   (( segid "    " and resid 20   and name HB  ))
 ASSI { 3000}
   (  segid "    " and resid 81   and name HD2%)
   (( segid "    " and resid 83   and name HB2 ))
      4.400     2.400     1.600 peak  3000 weight  0.10000E+01 volume  0.36812E-03 ppm1      0.151 ppm2      1.806 CV     1
 OR { 3000}
   (  segid "    " and resid 81   and name HD2%)
   (( segid "    " and resid 82   and name HG2 ))
 ASSI { 3004}
   (  segid "    " and resid 20   and name HG2%)
   (  segid "    " and resid 113  and name HG1%)
      3.600     1.600     1.600 peak  3004 weight  0.10000E+01 volume  0.85036E-03 ppm1     -0.093 ppm2      0.500 CV     1
 OR { 3004}
   (  segid "    " and resid 20   and name HG2%)
   (( segid "    " and resid 81   and name HG  ))
 ASSI { 3005}
   (  segid "    " and resid 20   and name HG2%)
   (( segid "    " and resid 81   and name HB1 ))
      2.700     0.900     0.900 peak  3005 weight  0.10000E+01 volume  0.31027E-02 ppm1     -0.093 ppm2      0.668 CV     1
 OR { 3005}
   (  segid "    " and resid 20   and name HG2%)
   (  segid "    " and resid 113  and name HG2%)
 OR { 3005}
   (  segid "    " and resid 20   and name HG2%)
   (  segid "    " and resid 18   and name HD1%)
 ASSI { 3007}
   (  segid "    " and resid 20   and name HG2%)
   (( segid "    " and resid 83   and name HG1 ))
      3.600     1.600     1.600 peak  3007 weight  0.10000E+01 volume  0.75700E-03 ppm1     -0.092 ppm2      1.310 CV     1
 OR { 3007}
   (  segid "    " and resid 20   and name HG2%)
   (( segid "    " and resid 19   and name HG2 ))
 OR { 3007}
   (  segid "    " and resid 20   and name HG2%)
   (( segid "    " and resid 18   and name HB1 ))
 OR { 3007}
   (  segid "    " and resid 20   and name HG2%)
   (( segid "    " and resid 19   and name HG1 ))
 OR { 3007}
   (  segid "    " and resid 20   and name HG2%)
   (( segid "    " and resid 18   and name HG  ))
 OR { 3007}
   (  segid "    " and resid 20   and name HG2%)
   (( segid "    " and resid 18   and name HB2 ))
 ASSI { 3008}
   (  segid "    " and resid 20   and name HG2%)
   (( segid "    " and resid 19   and name HB1 ))
      4.000     2.000     2.000 peak  3008 weight  0.10000E+01 volume  0.46262E-03 ppm1     -0.093 ppm2      1.773 CV     1
 OR { 3008}
   (  segid "    " and resid 20   and name HG2%)
   (( segid "    " and resid 83   and name HB2 ))
 OR { 3008}
   (  segid "    " and resid 20   and name HG2%)
   (( segid "    " and resid 96   and name HB2 ))
 OR { 3008}
   (  segid "    " and resid 20   and name HG2%)
   (( segid "    " and resid 82   and name HG2 ))
 ASSI { 3014}
   (  segid "    " and resid 20   and name HG2%)
   (  segid "    " and resid 94   and name HD% )
      3.200     1.300     1.300 peak  3014 weight  0.10000E+01 volume  0.14898E-02 ppm1     -0.094 ppm2      6.942 CV     1
 OR { 3014}
   (  segid "    " and resid 20   and name HG2%)
   (( segid "    " and resid 36   and name HZ2 ))
 ASSI { 3015}
   (  segid "    " and resid 20   and name HG2%)
   (( segid "    " and resid 36   and name HH2 ))
      3.800     1.800     1.800 peak  3015 weight  0.10000E+01 volume  0.59686E-03 ppm1     -0.095 ppm2      6.749 CV     1
 OR { 3015}
   (  segid "    " and resid 20   and name HG2%)
   (( segid "    " and resid 36   and name HZ3 ))
 OR { 3015}
   (  segid "    " and resid 20   and name HG2%)
   (  segid "    " and resid 94   and name HE% )
 ASSI { 3019}
   (  segid "    " and resid 20   and name HG2%)
   (( segid "    " and resid 22   and name HN  ))
      5.400     3.600     0.600 peak  3019 weight  0.10000E+01 volume  0.97660E-04 ppm1     -0.093 ppm2      9.164 CV     1
 OR { 3019}
   (  segid "    " and resid 20   and name HG2%)
   (( segid "    " and resid 94   and name HN  ))
 ASSI { 3025}
   (( segid "    " and resid 83   and name HG2 ))
   (( segid "    " and resid 68   and name HB1 ))
      5.400     3.700     0.600 peak  3025 weight  0.10000E+01 volume  0.32986E-04 ppm1     -0.022 ppm2      2.884 CV     1
 OR { 3025}
   (( segid "    " and resid 83   and name HG2 ))
   (( segid "    " and resid 68   and name HB2 ))
 OR { 3025}
   (( segid "    " and resid 83   and name HG2 ))
   (( segid "    " and resid 94   and name HB1 ))
 OR { 3025}
   (( segid "    " and resid 83   and name HG2 ))
   (( segid "    " and resid 94   and name HB2 ))
 ASSI { 3030}
   (( segid "    " and resid 83   and name HG2 ))
   (  segid "    " and resid 86   and name HD1%)
      3.700     1.700     1.700 peak  3030 weight  0.10000E+01 volume  0.73350E-03 ppm1     -0.032 ppm2      0.477 CV     1
 OR { 3030}
   (( segid "    " and resid 83   and name HG2 ))
   (( segid "    " and resid 81   and name HG  ))
 ASSI { 3032}
   (( segid "    " and resid 79   and name HB2 ))
   (( segid "    " and resid 80   and name HN  ))
      4.500     2.600     1.500 peak  3032 weight  0.10000E+01 volume  0.13773E-03 ppm1      1.091 ppm2      9.199 CV     1
 OR { 3032}
   (( segid "    " and resid 79   and name HB2 ))
   (( segid "    " and resid 22   and name HN  ))
 ASSI { 3034}
   (( segid "    " and resid 79   and name HB2 ))
   (( segid "    " and resid 36   and name HZ2 ))
      4.000     2.000     2.000 peak  3034 weight  0.10000E+01 volume  0.22531E-03 ppm1      1.090 ppm2      6.983 CV     1
 OR { 3034}
   (( segid "    " and resid 79   and name HB2 ))
   (  segid "    " and resid 80   and name HD% )
 OR { 3034}
   (( segid "    " and resid 79   and name HB2 ))
   (( segid "    " and resid 36   and name HD1 ))
 ASSI { 3039}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 46   and name HN  ))
      4.500     2.500     1.500 peak  3039 weight  0.10000E+01 volume  0.38590E-03 ppm1      1.221 ppm2      9.380 CV     1
 OR { 3039}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 38   and name HN  ))
 ASSI { 3042}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 37   and name HB  ))
      4.100     2.200     1.900 peak  3042 weight  0.10000E+01 volume  0.39950E-03 ppm1      1.224 ppm2      1.944 CV     1
 OR { 3042}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 46   and name HB1 ))
 OR { 3042}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 115  and name HB  ))
 OR { 3042}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 14   and name HB2 ))
 ASSI { 3044}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 16   and name HN  ))
      4.500     2.500     1.500 peak  3044 weight  0.10000E+01 volume  0.30201E-03 ppm1      1.235 ppm2      8.476 CV     1
 OR { 3044}
   (( segid "    " and resid 104  and name HB2 ))
   (( segid "    " and resid 105  and name HN  ))
 OR { 3044}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 85   and name HN  ))
 ASSI { 3053}
   (  segid "    " and resid 104  and name HD1%)
   (( segid "    " and resid 48   and name HN  ))
      5.000     3.100     1.000 peak  3053 weight  0.10000E+01 volume  0.83610E-04 ppm1      0.534 ppm2      7.926 CV     1
 OR { 3053}
   (  segid "    " and resid 104  and name HD1%)
   (( segid "    " and resid 107  and name HN  ))
 OR { 3053}
   (  segid "    " and resid 104  and name HD1%)
   (( segid "    " and resid 108  and name HN  ))
 ASSI { 3055}
   (  segid "    " and resid 104  and name HD1%)
   (( segid "    " and resid 107  and name HD1 ))
      4.100     2.100     1.900 peak  3055 weight  0.10000E+01 volume  0.51325E-03 ppm1      0.531 ppm2      6.974 CV     1
 OR { 3055}
   (  segid "    " and resid 104  and name HD1%)
   (  segid "    " and resid 95   and name HD% )
 ASSI { 3059}
   (  segid "    " and resid 104  and name HD1%)
   (( segid "    " and resid 103  and name HA  ))
      3.600     1.600     1.600 peak  3059 weight  0.10000E+01 volume  0.22318E-03 ppm1      0.533 ppm2      4.442 CV     1
 OR { 3059}
   (  segid "    " and resid 104  and name HD1%)
   (( segid "    " and resid 47   and name HA  ))
 ASSI { 3061}
   (  segid "    " and resid 104  and name HD1%)
   (( segid "    " and resid 47   and name HB2 ))
      3.000     1.200     1.200 peak  3061 weight  0.10000E+01 volume  0.56619E-03 ppm1      0.532 ppm2      3.189 CV     1
 OR { 3061}
   (  segid "    " and resid 104  and name HD1%)
   (( segid "    " and resid 47   and name HB1 ))
 OR { 3061}
   (  segid "    " and resid 104  and name HD1%)
   (( segid "    " and resid 95   and name HB2 ))
 ASSI { 3063}
   (  segid "    " and resid 104  and name HD1%)
   (( segid "    " and resid 37   and name HB  ))
      3.900     1.900     1.900 peak  3063 weight  0.10000E+01 volume  0.16871E-03 ppm1      0.532 ppm2      1.910 CV     1
 OR { 3063}
   (  segid "    " and resid 104  and name HD1%)
   (( segid "    " and resid 98   and name HE2 ))
 ASSI { 3064}
   (  segid "    " and resid 104  and name HD1%)
   (( segid "    " and resid 98   and name HE1 ))
      4.400     2.400     1.600 peak  3064 weight  0.10000E+01 volume  0.11478E-03 ppm1      0.533 ppm2      1.704 CV     1
 OR { 3064}
   (  segid "    " and resid 104  and name HD1%)
   (( segid "    " and resid 34   and name HB2 ))
 OR { 3064}
   (  segid "    " and resid 104  and name HD1%)
   (( segid "    " and resid 39   and name HB2 ))
 ASSI { 3067}
   (( segid "    " and resid 79   and name HB1 ))
   (( segid "    " and resid 80   and name HN  ))
      4.800     2.900     1.200 peak  3067 weight  0.10000E+01 volume  0.23309E-03 ppm1      1.802 ppm2      9.185 CV     1
 OR { 3067}
   (( segid "    " and resid 79   and name HB1 ))
   (( segid "    " and resid 22   and name HN  ))
 ASSI { 3069}
   (( segid "    " and resid 79   and name HB1 ))
   (( segid "    " and resid 36   and name HZ2 ))
      5.000     3.100     1.000 peak  3069 weight  0.10000E+01 volume  0.23250E-03 ppm1      1.804 ppm2      6.876 CV     1
 OR { 3069}
   (( segid "    " and resid 79   and name HB1 ))
   (( segid "    " and resid 36   and name HD1 ))
 OR { 3069}
   (( segid "    " and resid 79   and name HB1 ))
   (  segid "    " and resid 80   and name HD% )
 ASSI { 3076}
   (( segid "    " and resid 33   and name HB1 ))
   (( segid "    " and resid 99   and name HN  ))
      4.700     2.800     1.300 peak  3076 weight  0.10000E+01 volume  0.20449E-03 ppm1      3.273 ppm2      8.487 CV     1
 OR { 3076}
   (( segid "    " and resid 33   and name HB1 ))
   (( segid "    " and resid 52   and name HN  ))
 ASSI { 3079}
   (( segid "    " and resid 35   and name HA  ))
   (  segid "    " and resid 70   and name HD1%)
      3.400     1.500     1.500 peak  3079 weight  0.10000E+01 volume  0.76592E-03 ppm1      5.736 ppm2      1.077 CV     1
 OR { 3079}
   (( segid "    " and resid 35   and name HA  ))
   (  segid "    " and resid 97   and name HB% )
 OR { 3079}
   (( segid "    " and resid 35   and name HA  ))
   (  segid "    " and resid 70   and name HG2%)
 ASSI { 3082}
   (( segid "    " and resid 95   and name HB2 ))
   (  segid "    " and resid 97   and name HB% )
      4.400     2.400     1.600 peak  3082 weight  0.10000E+01 volume  0.37292E-03 ppm1      3.158 ppm2      1.100 CV     1
 OR { 3082}
   (( segid "    " and resid 95   and name HB2 ))
   (  segid "    " and resid 111  and name HG2%)
 ASSI { 3083}
   (( segid "    " and resid 36   and name HB2 ))
   (  segid "    " and resid 48   and name HG1%)
      3.700     1.700     1.700 peak  3083 weight  0.10000E+01 volume  0.97035E-03 ppm1      2.774 ppm2      1.013 CV     1
 OR { 3083}
   (( segid "    " and resid 36   and name HB2 ))
   (  segid "    " and resid 48   and name HG1%)
 OR { 3083}
   (( segid "    " and resid 36   and name HB2 ))
   (  segid "    " and resid 70   and name HG2%)
 OR { 3083}
   (( segid "    " and resid 36   and name HB2 ))
   (  segid "    " and resid 51   and name HG2%)
 ASSI { 3086}
   (( segid "    " and resid 72   and name HG2 ))
   (  segid "    " and resid 51   and name HG2%)
      4.200     2.200     1.800 peak  3086 weight  0.10000E+01 volume  0.42828E-03 ppm1      1.679 ppm2      0.961 CV     1
 OR { 3086}
   (( segid "    " and resid 72   and name HG2 ))
   (  segid "    " and resid 79   and name HD2%)
 ASSI { 3087}
   (( segid "    " and resid 45   and name HG  ))
   (  segid "    " and resid 37   and name HG1%)
      3.000     1.200     1.200 peak  3087 weight  0.10000E+01 volume  0.17801E-02 ppm1      1.272 ppm2      0.800 CV     1
 OR { 3087}
   (( segid "    " and resid 104  and name HG  ))
   (  segid "    " and resid 37   and name HG1%)
 ASSI { 3091}
   (  segid "    " and resid 113  and name HG1%)
   (( segid "    " and resid 20   and name HB  ))
      3.600     1.600     1.600 peak  3091 weight  0.10000E+01 volume  0.24359E-03 ppm1      0.528 ppm2      2.105 CV     1
 OR { 3091}
   (  segid "    " and resid 113  and name HG1%)
   (( segid "    " and resid 14   and name HG2 ))
 ASSI { 3092}
   (  segid "    " and resid 113  and name HG1%)
   (  segid "    " and resid 111  and name HG2%)
      2.600     0.800     0.800 peak  3092 weight  0.10000E+01 volume  0.27014E-02 ppm1      0.524 ppm2      1.068 CV     1
 OR { 3092}
   (  segid "    " and resid 113  and name HG1%)
   (  segid "    " and resid 92   and name HB% )
 OR { 3092}
   (  segid "    " and resid 113  and name HG1%)
   (  segid "    " and resid 114  and name HG2%)
 ASSI { 3093}
   (  segid "    " and resid 81   and name HD2%)
   (( segid "    " and resid 68   and name HB1 ))
      3.400     1.400     1.400 peak  3093 weight  0.10000E+01 volume  0.78418E-03 ppm1      0.155 ppm2      2.885 CV     1
 OR { 3093}
   (  segid "    " and resid 81   and name HD2%)
   (( segid "    " and resid 94   and name HB1 ))
 OR { 3093}
   (  segid "    " and resid 81   and name HD2%)
   (( segid "    " and resid 94   and name HB2 ))
 ASSI { 3095}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 23   and name HA  ))
      3.400     1.500     1.500 peak  3095 weight  0.10000E+01 volume  0.13680E-02 ppm1      5.405 ppm2      4.899 CV     1
 OR { 3095}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 5    and name HA  ))
 ASSI { 3101}
   (( segid "    " and resid 34   and name HB1 ))
   (  segid "    " and resid 51   and name HG2%)
      3.100     1.200     1.200 peak  3101 weight  0.10000E+01 volume  0.77195E-03 ppm1      1.933 ppm2      0.958 CV     1
 OR { 3101}
   (( segid "    " and resid 34   and name HB1 ))
   (  segid "    " and resid 79   and name HD2%)
 ASSI { 3109}
   (( segid "    " and resid 89   and name HG2 ))
   (( segid "    " and resid 87   and name HB1 ))
      2.800     1.000     1.000 peak  3109 weight  0.10000E+01 volume  0.20726E-02 ppm1      2.245 ppm2      1.577 CV     1
 OR { 3109}
   (( segid "    " and resid 89   and name HG2 ))
   (( segid "    " and resid 87   and name HG2 ))
 OR { 3109}
   (( segid "    " and resid 89   and name HG2 ))
   (( segid "    " and resid 87   and name HG1 ))
 OR { 3109}
   (( segid "    " and resid 89   and name HG2 ))
   (( segid "    " and resid 87   and name HD1 ))
 OR { 3109}
   (( segid "    " and resid 89   and name HG2 ))
   (( segid "    " and resid 87   and name HD2 ))
 OR { 3109}
   (( segid "    " and resid 127  and name HG2 ))
   (( segid "    " and resid 129  and name HB2 ))
 OR { 3109}
   (( segid "    " and resid 127  and name HG1 ))
   (( segid "    " and resid 129  and name HB2 ))
 OR { 3109}
   (( segid "    " and resid 127  and name HG2 ))
   (( segid "    " and resid 129  and name HG  ))
 OR { 3109}
   (( segid "    " and resid 127  and name HG1 ))
   (( segid "    " and resid 129  and name HG  ))
 OR { 3109}
   (( segid "    " and resid 127  and name HG2 ))
   (( segid "    " and resid 129  and name HB1 ))
 OR { 3109}
   (( segid "    " and resid 127  and name HG1 ))
   (( segid "    " and resid 129  and name HB1 ))
 OR { 3109}
   (( segid "    " and resid 46   and name HG1 ))
   (  segid "    " and resid 35   and name HB% )
 OR { 3109}
   (( segid "    " and resid 89   and name HG2 ))
   (  segid "    " and resid 91   and name HG2%)
 ASSI { 3122}
   (( segid "    " and resid 8    and name HA2 ))
   (( segid "    " and resid 21   and name HN  ))
      4.700     2.800     1.300 peak  3122 weight  0.10000E+01 volume  0.12324E-03 ppm1      3.780 ppm2      8.830 CV     1
 OR { 3122}
   (( segid "    " and resid 8    and name HA2 ))
   (( segid "    " and resid 111  and name HN  ))
 ASSI { 3127}
   (( segid "    " and resid 81   and name HG  ))
   (  segid "    " and resid 20   and name HG2%)
      3.400     1.400     1.400 peak  3127 weight  0.10000E+01 volume  0.12130E-02 ppm1      0.478 ppm2     -0.061 CV     1
 OR { 3127}
   (( segid "    " and resid 81   and name HG  ))
   (( segid "    " and resid 83   and name HG2 ))
 ASSI { 3131}
   (( segid "    " and resid 81   and name HG  ))
   (( segid "    " and resid 83   and name HG1 ))
      3.500     1.600     1.600 peak  3131 weight  0.10000E+01 volume  0.69901E-03 ppm1      0.478 ppm2      1.338 CV     1
 OR { 3131}
   (( segid "    " and resid 81   and name HG  ))
   (( segid "    " and resid 19   and name HG2 ))
 OR { 3131}
   (( segid "    " and resid 81   and name HG  ))
   (( segid "    " and resid 19   and name HG1 ))
 ASSI { 3132}
   (( segid "    " and resid 81   and name HG  ))
   (( segid "    " and resid 68   and name HB1 ))
      4.200     2.200     1.800 peak  3132 weight  0.10000E+01 volume  0.20552E-03 ppm1      0.470 ppm2      2.888 CV     1
 OR { 3132}
   (( segid "    " and resid 81   and name HG  ))
   (( segid "    " and resid 94   and name HB1 ))
 OR { 3132}
   (( segid "    " and resid 81   and name HG  ))
   (( segid "    " and resid 68   and name HB2 ))
 OR { 3132}
   (( segid "    " and resid 81   and name HG  ))
   (( segid "    " and resid 94   and name HB2 ))
 ASSI { 3133}
   (( segid "    " and resid 81   and name HG  ))
   (  segid "    " and resid 94   and name HD% )
      4.700     2.800     1.300 peak  3133 weight  0.10000E+01 volume  0.15293E-03 ppm1      0.472 ppm2      7.005 CV     1
 OR { 3133}
   (( segid "    " and resid 81   and name HG  ))
   (  segid "    " and resid 68   and name HE% )
 OR { 3133}
   (( segid "    " and resid 81   and name HG  ))
   (  segid "    " and resid 68   and name HD% )
 OR { 3133}
   (( segid "    " and resid 81   and name HG  ))
   (( segid "    " and resid 68   and name HZ  ))
 ASSI { 3146}
   (( segid "    " and resid 98   and name HG2 ))
   (( segid "    " and resid 34   and name HG2 ))
      3.500     1.600     1.600 peak  3146 weight  0.10000E+01 volume  0.62915E-03 ppm1      1.019 ppm2      2.401 CV     1
 OR { 3146}
   (( segid "    " and resid 98   and name HG1 ))
   (( segid "    " and resid 34   and name HG2 ))
 OR { 3146}
   (( segid "    " and resid 98   and name HG1 ))
   (( segid "    " and resid 105  and name HB1 ))
 OR { 3146}
   (( segid "    " and resid 98   and name HG1 ))
   (( segid "    " and resid 105  and name HB2 ))
 ASSI { 3147}
   (( segid "    " and resid 98   and name HG1 ))
   (( segid "    " and resid 32   and name HB1 ))
      4.300     2.300     1.700 peak  3147 weight  0.10000E+01 volume  0.69390E-04 ppm1      1.019 ppm2      3.274 CV     1
 OR { 3147}
   (( segid "    " and resid 98   and name HG2 ))
   (( segid "    " and resid 32   and name HB1 ))
 OR { 3147}
   (( segid "    " and resid 98   and name HG1 ))
   (( segid "    " and resid 33   and name HB1 ))
 ASSI { 3149}
   (( segid "    " and resid 98   and name HG1 ))
   (  segid "    " and resid 27   and name HD% )
      3.600     1.600     1.600 peak  3149 weight  0.10000E+01 volume  0.37445E-03 ppm1      1.022 ppm2      7.061 CV     1
 OR { 3149}
   (( segid "    " and resid 98   and name HG1 ))
   (  segid "    " and resid 27   and name HE% )
 OR { 3149}
   (( segid "    " and resid 98   and name HG2 ))
   (  segid "    " and resid 27   and name HD% )
 OR { 3149}
   (( segid "    " and resid 98   and name HG2 ))
   (  segid "    " and resid 27   and name HE% )
 OR { 3149}
   (( segid "    " and resid 98   and name HG1 ))
   (( segid "    " and resid 27   and name HZ  ))
 OR { 3149}
   (( segid "    " and resid 98   and name HG1 ))
   (  segid "    " and resid 32   and name HE% )
 ASSI { 3151}
   (( segid "    " and resid 98   and name HG1 ))
   (( segid "    " and resid 99   and name HN  ))
      4.000     2.000     2.000 peak  3151 weight  0.10000E+01 volume  0.50714E-03 ppm1      1.012 ppm2      8.507 CV     1
 OR { 3151}
   (( segid "    " and resid 98   and name HG2 ))
   (( segid "    " and resid 99   and name HN  ))
 OR { 3151}
   (( segid "    " and resid 98   and name HG1 ))
   (( segid "    " and resid 105  and name HN  ))
 OR { 3151}
   (( segid "    " and resid 98   and name HG2 ))
   (( segid "    " and resid 105  and name HN  ))
 ASSI { 3155}
   (  segid "    " and resid 37   and name HG2%)
   (  segid "    " and resid 95   and name HE% )
      3.500     1.500     1.500 peak  3155 weight  0.10000E+01 volume  0.14739E-02 ppm1      0.643 ppm2      6.741 CV     1
 OR { 3155}
   (  segid "    " and resid 37   and name HG2%)
   (( segid "    " and resid 36   and name HZ3 ))
 ASSI { 3174}
   (  segid "    " and resid 12   and name HG2%)
   (( segid "    " and resid 85   and name HN  ))
      4.000     2.000     2.000 peak  3174 weight  0.10000E+01 volume  0.50649E-03 ppm1      0.858 ppm2      8.502 CV     1
 OR { 3174}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 105  and name HN  ))
 OR { 3174}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 99   and name HN  ))
 ASSI { 3182}
   (  segid "    " and resid 81   and name HD1%)
   (  segid "    " and resid 94   and name HE% )
      3.400     1.500     1.500 peak  3182 weight  0.10000E+01 volume  0.72954E-03 ppm1      0.662 ppm2      6.756 CV     1
 OR { 3182}
   (  segid "    " and resid 81   and name HD1%)
   (( segid "    " and resid 36   and name HZ3 ))
 ASSI { 3183}
   (( segid "    " and resid 49   and name HB2 ))
   (  segid "    " and resid 81   and name HD2%)
      3.400     1.400     1.400 peak  3183 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.539 ppm2      0.154 CV     1
 OR { 3183}
   (( segid "    " and resid 49   and name HB2 ))
   (  segid "    " and resid 64   and name HG1%)
 ASSI { 3184}
   (( segid "    " and resid 49   and name HB1 ))
   (  segid "    " and resid 81   and name HD2%)
      3.400     1.400     1.400 peak  3184 weight  0.10000E+01 volume  0.00000E+00 ppm1      3.823 ppm2      0.145 CV     1
 OR { 3184}
   (( segid "    " and resid 49   and name HB1 ))
   (  segid "    " and resid 64   and name HG1%)

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    ASP   1          1HT       ASP   1  -9.660 -10.701   9.293
    2   2H    ASP   1          2HT       ASP   1 -10.955 -10.120  10.213
    3   3H    ASP   1          3HT       ASP   1  -9.817  -9.042   9.579
    4    HA   ASP   1           HA       ASP   1 -11.893 -10.575   8.149
    5   1HB   ASP   1          2HB       ASP   1 -11.430  -7.790   7.437
    6   2HB   ASP   1          1HB       ASP   1 -12.914  -8.578   7.965
    7    H    VAL   2           H        VAL   2  -9.331  -8.207   7.401
    8    HA   VAL   2           HA       VAL   2  -8.721  -9.778   4.981
    9    HB   VAL   2           HB       VAL   2  -8.057  -6.879   5.058
   10   1HG1  VAL   2          1HG1      VAL   2  -7.777  -7.169   2.868
   11   2HG1  VAL   2          2HG1      VAL   2  -9.340  -7.967   2.695
   12   3HG1  VAL   2          3HG1      VAL   2  -7.924  -8.899   3.182
   13   1HG2  VAL   2          1HG2      VAL   2 -10.196  -6.097   4.604
   14   2HG2  VAL   2          2HG2      VAL   2 -10.474  -7.263   5.896
   15   3HG2  VAL   2          3HG2      VAL   2 -10.812  -7.705   4.224
   16    H    GLN   3           H        GLN   3  -6.801 -10.714   5.096
   17    HA   GLN   3           HA       GLN   3  -4.632  -9.307   6.508
   18   1HB   GLN   3          2HB       GLN   3  -5.507 -11.446   7.590
   19   2HB   GLN   3          1HB       GLN   3  -4.815 -12.302   6.217
   20   1HG   GLN   3          2HG       GLN   3  -2.847 -10.540   7.268
   21   2HG   GLN   3          1HG       GLN   3  -3.543 -11.470   8.596
   22   1HE2  GLN   3          1HE2      GLN   3  -0.927 -11.489   6.993
   23   2HE2  GLN   3          2HE2      GLN   3  -0.689 -13.163   6.638
   24    H    LEU   4           H        LEU   4  -2.688  -9.119   5.487
   25    HA   LEU   4           HA       LEU   4  -2.448 -10.384   2.839
   26   1HB   LEU   4          2HB       LEU   4  -1.084  -7.821   3.051
   27   2HB   LEU   4          1HB       LEU   4  -2.148  -8.425   1.796
   28    HG   LEU   4           HG       LEU   4  -3.187  -7.318   4.401
   29   1HD1  LEU   4          1HD1      LEU   4  -2.151  -5.920   2.040
   30   2HD1  LEU   4          2HD1      LEU   4  -2.381  -5.350   3.693
   31   3HD1  LEU   4          3HD1      LEU   4  -3.749  -5.403   2.578
   32   1HD2  LEU   4          1HD2      LEU   4  -5.276  -7.170   3.290
   33   2HD2  LEU   4          2HD2      LEU   4  -4.649  -8.791   2.981
   34   3HD2  LEU   4          3HD2      LEU   4  -4.547  -7.553   1.729
   35    H    GLN   5           H        GLN   5  -0.147 -10.373   2.029
   36    HA   GLN   5           HA       GLN   5   1.798 -10.554   4.225
   37   1HB   GLN   5          2HB       GLN   5   1.225 -12.820   3.930
   38   2HB   GLN   5          1HB       GLN   5   1.131 -12.659   2.182
   39   1HG   GLN   5          2HG       GLN   5   3.773 -12.004   3.037
   40   2HG   GLN   5          1HG       GLN   5   3.298 -13.549   3.741
   41   1HE2  GLN   5          1HE2      GLN   5   4.565 -14.848   2.511
   42   2HE2  GLN   5          2HE2      GLN   5   4.378 -15.041   0.804
   43    H    ALA   6           H        ALA   6   3.761  -9.710   3.774
   44    HA   ALA   6           HA       ALA   6   4.293  -8.964   0.976
   45   1HB   ALA   6          1HB       ALA   6   5.684  -7.083   2.208
   46   2HB   ALA   6          2HB       ALA   6   4.487  -7.375   3.470
   47   3HB   ALA   6          3HB       ALA   6   3.967  -6.893   1.854
   48    H    SER   7           H        SER   7   6.439  -8.967   0.259
   49    HA   SER   7           HA       SER   7   8.651  -9.686   1.863
   50   1HB   SER   7          2HB       SER   7   7.045 -11.876   0.755
   51   2HB   SER   7          1HB       SER   7   8.752 -11.965   0.320
   52    HG   SER   7           HG       SER   7   8.303 -11.341   2.954
   53    H    GLY   8           H        GLY   8  10.448 -10.680   0.240
   54   1HA   GLY   8          2HA       GLY   8  11.294 -10.593  -2.020
   55   2HA   GLY   8          1HA       GLY   8  10.233  -9.225  -2.314
   56    H    GLY   9           H        GLY   9  11.690  -8.998   0.715
   57   1HA   GLY   9          2HA       GLY   9  13.144  -6.677   0.031
   58   2HA   GLY   9          1HA       GLY   9  13.264  -7.549   1.552
   59    H    GLY  10           H        GLY  10  15.282  -6.282  -0.308
   60   1HA   GLY  10          2HA       GLY  10  17.121  -8.574  -0.300
   61   2HA   GLY  10          1HA       GLY  10  16.938  -7.644  -1.778
   62    H    LEU  11           H        LEU  11  19.363  -7.601  -1.232
   63    HA   LEU  11           HA       LEU  11  19.950  -5.302   0.511
   64   1HB   LEU  11          2HB       LEU  11  21.281  -7.854   0.032
   65   2HB   LEU  11          1HB       LEU  11  22.370  -6.489  -0.124
   66    HG   LEU  11           HG       LEU  11  22.439  -7.393   2.131
   67   1HD1  LEU  11          1HD1      LEU  11  21.008  -4.745   2.159
   68   2HD1  LEU  11          2HD1      LEU  11  22.704  -4.947   1.725
   69   3HD1  LEU  11          3HD1      LEU  11  22.155  -5.360   3.349
   70   1HD2  LEU  11          1HD2      LEU  11  19.585  -6.565   2.529
   71   2HD2  LEU  11          2HD2      LEU  11  20.593  -7.600   3.541
   72   3HD2  LEU  11          3HD2      LEU  11  20.003  -8.189   1.988
   73    H    VAL  12           H        VAL  12  20.151  -3.466  -0.613
   74    HA   VAL  12           HA       VAL  12  21.470  -3.597  -3.250
   75    HB   VAL  12           HB       VAL  12  20.208  -1.703  -3.983
   76   1HG1  VAL  12          1HG1      VAL  12  17.811  -2.816  -3.034
   77   2HG1  VAL  12          2HG1      VAL  12  18.969  -4.142  -3.146
   78   3HG1  VAL  12          3HG1      VAL  12  18.629  -3.144  -4.561
   79   1HG2  VAL  12          1HG2      VAL  12  18.746  -1.599  -1.360
   80   2HG2  VAL  12          2HG2      VAL  12  18.759  -0.411  -2.664
   81   3HG2  VAL  12          3HG2      VAL  12  20.195  -0.638  -1.663
   82    H    GLN  13           H        GLN  13  22.154  -1.172  -3.828
   83    HA   GLN  13           HA       GLN  13  23.824  -0.235  -1.588
   84   1HB   GLN  13          2HB       GLN  13  24.372  -0.525  -4.520
   85   2HB   GLN  13          1HB       GLN  13  25.211   0.721  -3.608
   86   1HG   GLN  13          2HG       GLN  13  26.564  -0.748  -2.614
   87   2HG   GLN  13          1HG       GLN  13  25.262  -1.904  -2.335
   88   1HE2  GLN  13          1HE2      GLN  13  24.592  -3.215  -4.172
   89   2HE2  GLN  13          2HE2      GLN  13  25.772  -3.676  -5.347
   90    HA   PRO  14           HA       PRO  14  21.936   3.751  -1.625
   91   1HB   PRO  14          2HB       PRO  14  24.669   4.885  -2.016
   92   2HB   PRO  14          1HB       PRO  14  23.447   5.286  -0.804
   93   1HG   PRO  14          2HG       PRO  14  25.556   3.809  -0.149
   94   2HG   PRO  14          1HG       PRO  14  23.950   3.437   0.507
   95   1HD   PRO  14          2HD       PRO  14  25.484   2.055  -1.648
   96   2HD   PRO  14          1HD       PRO  14  24.404   1.374  -0.415
   97    H    GLY  15           H        GLY  15  20.906   3.495  -3.676
   98   1HA   GLY  15          2HA       GLY  15  20.597   5.116  -5.533
   99   2HA   GLY  15          1HA       GLY  15  22.306   4.894  -5.873
  100    H    GLY  16           H        GLY  16  20.671   2.045  -4.931
  101   1HA   GLY  16          2HA       GLY  16  20.898   1.030  -7.659
  102   2HA   GLY  16          1HA       GLY  16  20.670   0.066  -6.208
  103    H    SER  17           H        SER  17  18.895  -1.099  -6.718
  104    HA   SER  17           HA       SER  17  16.362   0.243  -6.710
  105   1HB   SER  17          2HB       SER  17  15.561  -0.442  -8.868
  106   2HB   SER  17          1HB       SER  17  17.087   0.404  -9.118
  107    HG   SER  17           HG       SER  17  17.981  -1.391  -9.792
  108    H    LEU  18           H        LEU  18  14.884  -1.012  -5.754
  109    HA   LEU  18           HA       LEU  18  15.317  -3.926  -5.730
  110   1HB   LEU  18          2HB       LEU  18  15.780  -2.382  -3.557
  111   2HB   LEU  18          1HB       LEU  18  14.074  -2.721  -3.334
  112    HG   LEU  18           HG       LEU  18  16.121  -4.895  -3.755
  113   1HD1  LEU  18          1HD1      LEU  18  16.339  -3.308  -1.660
  114   2HD1  LEU  18          2HD1      LEU  18  16.530  -5.055  -1.516
  115   3HD1  LEU  18          3HD1      LEU  18  15.003  -4.296  -1.066
  116   1HD2  LEU  18          1HD2      LEU  18  13.419  -5.048  -2.446
  117   2HD2  LEU  18          2HD2      LEU  18  14.443  -6.371  -3.005
  118   3HD2  LEU  18          3HD2      LEU  18  13.657  -5.310  -4.174
  119    H    ARG  19           H        ARG  19  13.566  -5.129  -6.184
  120    HA   ARG  19           HA       ARG  19  11.003  -3.719  -6.480
  121   1HB   ARG  19          2HB       ARG  19  11.890  -4.769  -8.521
  122   2HB   ARG  19          1HB       ARG  19  11.920  -6.327  -7.707
  123   1HG   ARG  19          2HG       ARG  19   9.511  -6.316  -7.512
  124   2HG   ARG  19          1HG       ARG  19   9.438  -4.701  -8.221
  125   1HD   ARG  19          2HD       ARG  19  10.733  -5.845 -10.190
  126   2HD   ARG  19          1HD       ARG  19  10.048  -7.321  -9.513
  127    HE   ARG  19           HE       ARG  19   7.872  -5.816  -9.715
  128   1HH1  ARG  19          1HH1      ARG  19  10.468  -6.324 -11.985
  129   2HH1  ARG  19          2HH1      ARG  19   9.464  -6.100 -13.379
  130   1HH2  ARG  19          1HH2      ARG  19   6.545  -5.521 -11.544
  131   2HH2  ARG  19          2HH2      ARG  19   7.234  -5.643 -13.129
  132    H    VAL  20           H        VAL  20   9.866  -3.913  -4.652
  133    HA   VAL  20           HA       VAL  20   9.744  -6.554  -3.357
  134    HB   VAL  20           HB       VAL  20   9.364  -5.549  -1.310
  135   1HG1  VAL  20          1HG1      VAL  20  11.484  -4.868  -1.338
  136   2HG1  VAL  20          2HG1      VAL  20  10.836  -3.249  -1.598
  137   3HG1  VAL  20          3HG1      VAL  20  11.347  -4.226  -2.974
  138   1HG2  VAL  20          1HG2      VAL  20   8.605  -3.227  -0.997
  139   2HG2  VAL  20          2HG2      VAL  20   7.454  -4.181  -1.931
  140   3HG2  VAL  20          3HG2      VAL  20   8.516  -3.034  -2.748
  141    H    SER  21           H        SER  21   7.668  -7.350  -2.634
  142    HA   SER  21           HA       SER  21   5.330  -6.033  -3.805
  143   1HB   SER  21          2HB       SER  21   4.569  -8.039  -4.924
  144   2HB   SER  21          1HB       SER  21   6.197  -7.659  -5.484
  145    HG   SER  21           HG       SER  21   6.961  -9.226  -3.963
  146    H    CYS  22           H        CYS  22   3.270  -7.072  -3.142
  147    HA   CYS  22           HA       CYS  22   3.398  -8.602  -0.666
  148   1HB   CYS  22          2HB       CYS  22   3.392  -6.193  -0.018
  149   2HB   CYS  22          1HB       CYS  22   1.855  -6.010  -0.857
  150    H    ALA  23           H        ALA  23   2.188 -10.311  -1.100
  151    HA   ALA  23           HA       ALA  23  -0.041 -10.125  -2.937
  152   1HB   ALA  23          1HB       ALA  23   1.058 -12.092  -3.329
  153   2HB   ALA  23          2HB       ALA  23  -0.189 -12.651  -2.214
  154   3HB   ALA  23          3HB       ALA  23   1.445 -12.344  -1.626
  155    H    ALA  24           H        ALA  24  -1.910  -9.355  -2.192
  156    HA   ALA  24           HA       ALA  24  -2.688  -9.802   0.580
  157   1HB   ALA  24          1HB       ALA  24  -3.858  -8.106  -1.615
  158   2HB   ALA  24          2HB       ALA  24  -3.018  -7.571  -0.159
  159   3HB   ALA  24          3HB       ALA  24  -4.620  -8.302  -0.036
  160    H    SER  25           H        SER  25  -5.083 -10.327   0.931
  161    HA   SER  25           HA       SER  25  -6.313 -12.004  -1.068
  162   1HB   SER  25          2HB       SER  25  -4.636 -13.161   0.989
  163   2HB   SER  25          1HB       SER  25  -6.299 -13.730   1.142
  164    HG   SER  25           HG       SER  25  -5.341 -15.084  -0.293
  165    H    GLY  26           H        GLY  26  -8.292 -11.134  -0.975
  166   1HA   GLY  26          2HA       GLY  26 -10.215 -11.678   0.812
  167   2HA   GLY  26          1HA       GLY  26  -9.427 -10.300   1.563
  168    H    PHE  27           H        PHE  27  -8.822  -9.186  -1.176
  169    HA   PHE  27           HA       PHE  27 -11.452  -8.580  -2.232
  170   1HB   PHE  27          2HB       PHE  27 -11.271  -6.167  -1.913
  171   2HB   PHE  27          1HB       PHE  27 -11.239  -6.996  -0.363
  172    HD1  PHE  27           1HD      PHE  27  -9.669  -6.361   1.186
  173    HD2  PHE  27           2HD      PHE  27  -8.886  -5.666  -2.937
  174    HE1  PHE  27           1HE      PHE  27  -7.605  -5.162   1.781
  175    HE2  PHE  27           2HE      PHE  27  -6.820  -4.476  -2.352
  176    HZ   PHE  27           HZ       PHE  27  -6.177  -4.222   0.003
  177    H    THR  28           H        THR  28 -10.846  -6.360  -3.738
  178    HA   THR  28           HA       THR  28  -8.698  -7.354  -5.490
  179    HB   THR  28           HB       THR  28 -10.813  -5.580  -6.600
  180    HG1  THR  28           1HG      THR  28 -11.716  -7.467  -5.263
  181   1HG2  THR  28          1HG2      THR  28  -8.794  -6.501  -7.847
  182   2HG2  THR  28          2HG2      THR  28 -10.366  -6.742  -8.610
  183   3HG2  THR  28          3HG2      THR  28  -9.585  -8.073  -7.757
  184    H    PHE  29           H        PHE  29  -7.256  -5.904  -6.363
  185    HA   PHE  29           HA       PHE  29  -6.742  -3.567  -4.840
  186   1HB   PHE  29          2HB       PHE  29  -5.493  -4.840  -7.242
  187   2HB   PHE  29          1HB       PHE  29  -5.008  -3.217  -6.762
  188    HD1  PHE  29           1HD      PHE  29  -5.523  -6.595  -5.276
  189    HD2  PHE  29           2HD      PHE  29  -3.260  -2.994  -5.297
  190    HE1  PHE  29           1HE      PHE  29  -3.994  -7.552  -3.603
  191    HE2  PHE  29           2HE      PHE  29  -1.726  -3.943  -3.628
  192    HZ   PHE  29           HZ       PHE  29  -2.092  -6.227  -2.778
  193    H    SER  30           H        SER  30  -8.036  -4.097  -8.093
  194    HA   SER  30           HA       SER  30  -8.162  -1.285  -8.677
  195   1HB   SER  30          2HB       SER  30  -9.760  -2.340 -10.558
  196   2HB   SER  30          1HB       SER  30  -8.002  -2.403 -10.668
  197    HG   SER  30           HG       SER  30  -9.776  -4.426 -10.424
  198    H    SER  31           H        SER  31  -9.532  -2.188  -6.255
  199    HA   SER  31           HA       SER  31 -12.081  -0.897  -6.758
  200   1HB   SER  31          2HB       SER  31 -12.706  -3.202  -7.114
  201   2HB   SER  31          1HB       SER  31 -11.882  -3.701  -5.637
  202    HG   SER  31           HG       SER  31 -13.996  -1.825  -5.618
  203    H    TYR  32           H        TYR  32  -9.757  -2.280  -4.509
  204    HA   TYR  32           HA       TYR  32 -10.822  -0.538  -2.389
  205   1HB   TYR  32          2HB       TYR  32  -9.323  -3.143  -2.302
  206   2HB   TYR  32          1HB       TYR  32  -9.340  -2.066  -0.910
  207    HD1  TYR  32           1HD      TYR  32 -11.569  -3.929  -3.227
  208    HD2  TYR  32           2HD      TYR  32 -11.146  -2.097   0.588
  209    HE1  TYR  32           1HE      TYR  32 -13.730  -4.877  -2.540
  210    HE2  TYR  32           2HE      TYR  32 -13.305  -3.042   1.289
  211    HH   TYR  32           HH       TYR  32 -15.088  -5.278  -0.771
  212    H    HIS  33           H        HIS  33  -9.306   0.576  -1.037
  213    HA   HIS  33           HA       HIS  33  -7.041   1.572  -2.554
  214   1HB   HIS  33          2HB       HIS  33  -7.703   2.492   0.220
  215   2HB   HIS  33          1HB       HIS  33  -7.044   3.410  -1.131
  216    HD1  HIS  33           1HD      HIS  33 -10.324   1.763  -0.136
  217    HD2  HIS  33           2HD      HIS  33  -8.888   4.917  -2.428
  218    HE1  HIS  33           1HE      HIS  33 -12.365   2.987  -0.947
  219    HE2  HIS  33           2HE      HIS  33 -11.473   4.897  -2.329
  220    H    MET  34           H        MET  34  -4.939   1.182  -2.126
  221    HA   MET  34           HA       MET  34  -4.261  -0.257   0.343
  222   1HB   MET  34          2HB       MET  34  -3.866  -1.140  -2.455
  223   2HB   MET  34          1HB       MET  34  -2.510  -1.391  -1.364
  224   1HG   MET  34          2HG       MET  34  -5.221  -2.239  -0.493
  225   2HG   MET  34          1HG       MET  34  -4.362  -3.216  -1.683
  226   1HE   MET  34          1HE       MET  34  -3.032  -5.628   0.199
  227   2HE   MET  34          2HE       MET  34  -1.661  -4.739  -0.466
  228   3HE   MET  34          3HE       MET  34  -3.180  -4.818  -1.361
  229    H    ALA  35           H        ALA  35  -1.845  -0.258   0.729
  230    HA   ALA  35           HA       ALA  35  -0.369   1.869  -0.553
  231   1HB   ALA  35          1HB       ALA  35  -1.438   2.137   2.230
  232   2HB   ALA  35          2HB       ALA  35  -1.497   3.291   0.895
  233   3HB   ALA  35          3HB       ALA  35   0.028   2.976   1.722
  234    H    TRP  36           H        TRP  36   1.803   2.146   0.371
  235    HA   TRP  36           HA       TRP  36   2.852  -0.384   1.450
  236   1HB   TRP  36          2HB       TRP  36   3.748   1.409  -0.718
  237   2HB   TRP  36          1HB       TRP  36   5.024   0.861   0.361
  238    HD1  TRP  36           HD       TRP  36   3.236  -0.140  -2.680
  239    HE1  TRP  36           1HE      TRP  36   3.722  -2.601  -3.258
  240    HE3  TRP  36           3HE      TRP  36   5.326  -1.623   1.746
  241    HZ2  TRP  36           2HZ      TRP  36   4.833  -4.867  -2.007
  242    HZ3  TRP  36           3HZ      TRP  36   6.072  -3.956   1.972
  243    HH2  TRP  36           HH       TRP  36   5.829  -5.545   0.133
  244    H    VAL  37           H        VAL  37   3.400  -0.180   3.528
  245    HA   VAL  37           HA       VAL  37   4.353   2.420   4.514
  246    HB   VAL  37           HB       VAL  37   3.941   1.375   6.802
  247   1HG1  VAL  37          1HG1      VAL  37   1.265   1.425   5.973
  248   2HG1  VAL  37          2HG1      VAL  37   2.131   2.539   4.915
  249   3HG1  VAL  37          3HG1      VAL  37   2.208   2.745   6.664
  250   1HG2  VAL  37          1HG2      VAL  37   2.920  -0.621   7.061
  251   2HG2  VAL  37          2HG2      VAL  37   3.703  -0.953   5.514
  252   3HG2  VAL  37          3HG2      VAL  37   2.006  -0.476   5.559
  253    H    ARG  38           H        ARG  38   6.036   2.288   6.281
  254    HA   ARG  38           HA       ARG  38   7.842   0.007   6.032
  255   1HB   ARG  38          2HB       ARG  38   9.094   1.132   4.536
  256   2HB   ARG  38          1HB       ARG  38   8.311   2.663   4.894
  257   1HG   ARG  38          2HG       ARG  38   9.764   2.581   7.057
  258   2HG   ARG  38          1HG       ARG  38  10.734   1.439   6.124
  259   1HD   ARG  38          2HD       ARG  38  11.761   3.412   5.569
  260   2HD   ARG  38          1HD       ARG  38  10.567   3.293   4.276
  261    HE   ARG  38           HE       ARG  38   9.506   4.715   6.483
  262   1HH1  ARG  38          1HH1      ARG  38  11.724   5.045   3.812
  263   2HH1  ARG  38          2HH1      ARG  38  11.542   6.764   3.710
  264   1HH2  ARG  38          1HH2      ARG  38   9.265   6.974   6.355
  265   2HH2  ARG  38          2HH2      ARG  38  10.146   7.861   5.156
  266    H    GLN  39           H        GLN  39   9.358  -0.188   7.750
  267    HA   GLN  39           HA       GLN  39   9.094   1.694   9.968
  268   1HB   GLN  39          2HB       GLN  39   7.423   0.051  10.500
  269   2HB   GLN  39          1HB       GLN  39   8.539  -1.266  10.158
  270   1HG   GLN  39          2HG       GLN  39   9.676  -1.005  12.131
  271   2HG   GLN  39          1HG       GLN  39   9.241   0.698  12.291
  272   1HE2  GLN  39          1HE2      GLN  39   6.462   0.394  11.856
  273   2HE2  GLN  39          2HE2      GLN  39   5.796  -0.408  13.234
  274    H    ALA  40           H        ALA  40  11.158   2.335  10.137
  275    HA   ALA  40           HA       ALA  40  13.391   0.587   9.688
  276   1HB   ALA  40          1HB       ALA  40  14.137   2.935  11.145
  277   2HB   ALA  40          2HB       ALA  40  12.967   3.377   9.902
  278   3HB   ALA  40          3HB       ALA  40  14.451   2.536   9.456
  279    HA   PRO  41           HA       PRO  41  14.603  -1.256  13.558
  280   1HB   PRO  41          2HB       PRO  41  16.265   1.192  14.074
  281   2HB   PRO  41          1HB       PRO  41  16.660  -0.507  14.362
  282   1HG   PRO  41          2HG       PRO  41  17.531   0.830  12.180
  283   2HG   PRO  41          1HG       PRO  41  17.169  -0.904  12.157
  284   1HD   PRO  41          2HD       PRO  41  15.756   1.290  10.844
  285   2HD   PRO  41          1HD       PRO  41  15.580  -0.459  10.602
  286    H    GLY  42           H        GLY  42  12.517  -1.011  14.442
  287   1HA   GLY  42          2HA       GLY  42  11.359  -0.467  16.429
  288   2HA   GLY  42          1HA       GLY  42  12.367   0.966  16.596
  289    H    LYS  43           H        LYS  43  11.835   2.841  15.491
  290    HA   LYS  43           HA       LYS  43  10.307   4.433  14.881
  291   1HB   LYS  43          2HB       LYS  43  11.125   2.916  12.768
  292   2HB   LYS  43          1HB       LYS  43   9.377   2.818  12.606
  293   1HG   LYS  43          2HG       LYS  43   9.283   4.863  11.760
  294   2HG   LYS  43          1HG       LYS  43  10.175   5.527  13.129
  295   1HD   LYS  43          2HD       LYS  43  12.235   5.243  12.082
  296   2HD   LYS  43          1HD       LYS  43  11.599   4.053  10.945
  297   1HE   LYS  43          2HE       LYS  43  10.367   5.768   9.776
  298   2HE   LYS  43          1HE       LYS  43  10.846   6.973  10.969
  299   1HZ   LYS  43          1HZ       LYS  43  13.222   6.298  10.256
  300   2HZ   LYS  43          2HZ       LYS  43  12.328   7.339   9.268
  301   3HZ   LYS  43          3HZ       LYS  43  12.464   5.703   8.865
  302    H    GLY  44           H        GLY  44   7.949   4.059  13.272
  303   1HA   GLY  44          2HA       GLY  44   6.130   2.482  14.924
  304   2HA   GLY  44          1HA       GLY  44   5.873   4.223  14.901
  305    H    LEU  45           H        LEU  45   7.076   2.476  12.151
  306    HA   LEU  45           HA       LEU  45   6.260   2.039  10.087
  307   1HB   LEU  45          2HB       LEU  45   4.356   1.043  11.642
  308   2HB   LEU  45          1HB       LEU  45   3.431   2.359  10.948
  309    HG   LEU  45           HG       LEU  45   3.501   1.450   8.796
  310   1HD1  LEU  45          1HD1      LEU  45   5.954   1.038   8.802
  311   2HD1  LEU  45          2HD1      LEU  45   5.011  -0.236   8.030
  312   3HD1  LEU  45          3HD1      LEU  45   5.651  -0.475   9.655
  313   1HD2  LEU  45          1HD2      LEU  45   3.342  -0.790  10.798
  314   2HD2  LEU  45          2HD2      LEU  45   2.916  -0.971   9.096
  315   3HD2  LEU  45          3HD2      LEU  45   2.017   0.152  10.117
  316    H    GLU  46           H        GLU  46   5.742   3.165   8.277
  317    HA   GLU  46           HA       GLU  46   4.440   5.767   8.545
  318   1HB   GLU  46          2HB       GLU  46   6.691   6.466   8.721
  319   2HB   GLU  46          1HB       GLU  46   7.232   5.304   7.519
  320   1HG   GLU  46          2HG       GLU  46   7.299   7.202   6.275
  321   2HG   GLU  46          1HG       GLU  46   5.641   6.689   5.942
  322    H    TRP  47           H        TRP  47   3.153   6.236   6.853
  323    HA   TRP  47           HA       TRP  47   2.850   4.254   4.794
  324   1HB   TRP  47          2HB       TRP  47   0.786   5.169   5.403
  325   2HB   TRP  47          1HB       TRP  47   1.428   6.812   5.479
  326    HD1  TRP  47           HD       TRP  47   0.689   4.120   2.794
  327    HE1  TRP  47           1HE      TRP  47   0.022   5.319   0.630
  328    HE3  TRP  47           3HE      TRP  47   1.313   8.948   4.327
  329    HZ2  TRP  47           2HZ      TRP  47  -0.217   7.983  -0.310
  330    HZ3  TRP  47           3HZ      TRP  47   0.856  10.765   2.737
  331    HH2  TRP  47           HH       TRP  47   0.104  10.290   0.464
  332    H    VAL  48           H        VAL  48   4.303   4.183   3.206
  333    HA   VAL  48           HA       VAL  48   5.745   6.527   2.367
  334    HB   VAL  48           HB       VAL  48   5.828   3.639   1.564
  335   1HG1  VAL  48          1HG1      VAL  48   6.853   4.009  -0.379
  336   2HG1  VAL  48          2HG1      VAL  48   7.920   5.216   0.340
  337   3HG1  VAL  48          3HG1      VAL  48   6.325   5.688  -0.245
  338   1HG2  VAL  48          1HG2      VAL  48   7.361   5.437   3.268
  339   2HG2  VAL  48          2HG2      VAL  48   8.364   4.492   2.167
  340   3HG2  VAL  48          3HG2      VAL  48   7.261   3.677   3.276
  341    H    SER  49           H        SER  49   3.551   4.236   0.691
  342    HA   SER  49           HA       SER  49   2.725   6.479  -1.022
  343   1HB   SER  49          2HB       SER  49   3.239   3.863  -2.365
  344   2HB   SER  49          1HB       SER  49   3.277   5.497  -3.032
  345    HG   SER  49           HG       SER  49   5.253   4.057  -1.733
  346    H    THR  50           H        THR  50   0.734   6.233  -2.107
  347    HA   THR  50           HA       THR  50  -0.912   3.927  -1.373
  348    HB   THR  50           HB       THR  50  -1.205   6.397  -0.077
  349    HG1  THR  50           1HG      THR  50  -2.046   4.790   1.032
  350   1HG2  THR  50          1HG2      THR  50  -2.352   7.436  -1.877
  351   2HG2  THR  50          2HG2      THR  50  -3.568   6.979  -0.683
  352   3HG2  THR  50          3HG2      THR  50  -3.356   6.010  -2.144
  353    H    ILE  51           H        ILE  51  -2.226   3.249  -2.979
  354    HA   ILE  51           HA       ILE  51  -2.348   4.939  -5.393
  355    HB   ILE  51           HB       ILE  51  -1.063   2.861  -5.696
  356   1HG1  ILE  51          2HG1      ILE  51  -3.309   2.126  -7.371
  357   2HG1  ILE  51          1HG1      ILE  51  -3.108   3.876  -7.317
  358   1HG2  ILE  51          1HG2      ILE  51  -1.994   1.318  -4.213
  359   2HG2  ILE  51          2HG2      ILE  51  -2.467   0.720  -5.804
  360   3HG2  ILE  51          3HG2      ILE  51  -3.631   1.595  -4.808
  361   1HD1  ILE  51          1HD1      ILE  51  -0.557   3.119  -7.699
  362   2HD1  ILE  51          2HD1      ILE  51  -1.685   3.488  -9.003
  363   3HD1  ILE  51          3HD1      ILE  51  -1.406   1.813  -8.526
  364    H    ASN  52           H        ASN  52  -4.271   5.226  -6.450
  365    HA   ASN  52           HA       ASN  52  -6.668   4.329  -5.000
  366   1HB   ASN  52          2HB       ASN  52  -6.735   6.664  -5.009
  367   2HB   ASN  52          1HB       ASN  52  -6.061   6.776  -6.631
  368   1HD2  ASN  52          1HD2      ASN  52  -8.921   6.192  -4.746
  369   2HD2  ASN  52          2HD2      ASN  52 -10.054   6.370  -6.039
  370    HA   PRO  53           HA       PRO  53  -7.589   1.849  -8.579
  371   1HB   PRO  53          2HB       PRO  53 -10.036   1.000  -7.866
  372   2HB   PRO  53          1HB       PRO  53  -8.579   0.434  -7.042
  373   1HG   PRO  53          2HG       PRO  53 -10.539   2.529  -6.195
  374   2HG   PRO  53          1HG       PRO  53  -9.771   1.260  -5.226
  375   1HD   PRO  53          2HD       PRO  53  -8.921   3.863  -5.274
  376   2HD   PRO  53          1HD       PRO  53  -7.862   2.486  -4.913
  377    H    GLY  54           H        GLY  54  -8.455   2.246 -10.539
  378   1HA   GLY  54          2HA       GLY  54 -10.324   2.924 -11.914
  379   2HA   GLY  54          1HA       GLY  54 -10.709   4.139 -10.705
  380    H    ASP  55           H        ASP  55  -9.822   6.133 -10.851
  381    HA   ASP  55           HA       ASP  55  -8.815   7.026 -13.295
  382   1HB   ASP  55          2HB       ASP  55  -9.430   8.168 -10.712
  383   2HB   ASP  55          1HB       ASP  55  -7.959   8.879 -11.371
  384    H    GLY  56           H        GLY  56  -7.024   6.920 -10.201
  385   1HA   GLY  56          2HA       GLY  56  -4.855   5.602 -10.428
  386   2HA   GLY  56          1HA       GLY  56  -4.548   6.679 -11.782
  387    H    SER  57           H        SER  57  -6.206   8.323  -9.375
  388    HA   SER  57           HA       SER  57  -4.226  10.169  -8.844
  389   1HB   SER  57          2HB       SER  57  -6.654   9.325  -7.273
  390   2HB   SER  57          1HB       SER  57  -5.585  10.600  -6.690
  391    HG   SER  57           HG       SER  57  -7.275  11.477  -7.915
  392    H    THR  58           H        THR  58  -2.286   9.851  -7.989
  393    HA   THR  58           HA       THR  58  -1.989   7.805  -5.900
  394    HB   THR  58           HB       THR  58   0.566   8.606  -6.716
  395    HG1  THR  58           1HG      THR  58   0.389   8.271  -9.011
  396   1HG2  THR  58          1HG2      THR  58  -1.070   6.206  -7.545
  397   2HG2  THR  58          2HG2      THR  58  -0.114   6.350  -6.068
  398   3HG2  THR  58          3HG2      THR  58   0.688   6.340  -7.638
  399    H    TYR  59           H        TYR  59  -0.928   8.221  -4.011
  400    HA   TYR  59           HA       TYR  59  -0.091  10.981  -3.470
  401   1HB   TYR  59          2HB       TYR  59  -1.664   9.378  -1.455
  402   2HB   TYR  59          1HB       TYR  59  -1.288  11.097  -1.425
  403    HD1  TYR  59           1HD      TYR  59  -3.451   8.515  -2.872
  404    HD2  TYR  59           2HD      TYR  59  -2.594  12.678  -2.709
  405    HE1  TYR  59           1HE      TYR  59  -5.615   8.996  -3.939
  406    HE2  TYR  59           2HE      TYR  59  -4.755  13.174  -3.773
  407    HH   TYR  59           HH       TYR  59  -7.070  10.595  -4.515
  408    H    TYR  60           H        TYR  60   1.676  11.161  -2.122
  409    HA   TYR  60           HA       TYR  60   2.760   8.649  -1.035
  410   1HB   TYR  60          2HB       TYR  60   4.227  10.786  -2.583
  411   2HB   TYR  60          1HB       TYR  60   5.050   9.575  -1.609
  412    HD1  TYR  60           1HD      TYR  60   2.463   9.750  -4.312
  413    HD2  TYR  60           2HD      TYR  60   5.800   7.678  -2.678
  414    HE1  TYR  60           1HE      TYR  60   2.430   8.203  -6.223
  415    HE2  TYR  60           2HE      TYR  60   5.773   6.126  -4.583
  416    HH   TYR  60           HH       TYR  60   3.364   6.434  -7.177
  417    H    ALA  61           H        ALA  61   4.642   9.159   0.514
  418    HA   ALA  61           HA       ALA  61   3.606  10.855   2.577
  419   1HB   ALA  61          1HB       ALA  61   5.270   8.623   2.482
  420   2HB   ALA  61          2HB       ALA  61   4.805   9.540   3.915
  421   3HB   ALA  61          3HB       ALA  61   6.299   9.932   3.066
  422    H    ASP  62           H        ASP  62   4.778  11.909  -0.072
  423    HA   ASP  62           HA       ASP  62   5.667  13.893  -0.724
  424   1HB   ASP  62          2HB       ASP  62   4.966  14.457   1.849
  425   2HB   ASP  62          1HB       ASP  62   6.702  14.754   1.895
  426    H    SER  63           H        SER  63   7.660  12.575   1.932
  427    HA   SER  63           HA       SER  63  10.092  13.256   0.557
  428   1HB   SER  63          2HB       SER  63   9.619  13.086   3.135
  429   2HB   SER  63          1HB       SER  63  10.022  11.386   2.895
  430    HG   SER  63           HG       SER  63  11.967  12.206   3.227
  431    H    VAL  64           H        VAL  64   8.051  11.179  -0.476
  432    HA   VAL  64           HA       VAL  64  10.088   9.271  -1.329
  433    HB   VAL  64           HB       VAL  64   8.392   7.391  -1.023
  434   1HG1  VAL  64          1HG1      VAL  64   8.928   7.364   1.555
  435   2HG1  VAL  64          2HG1      VAL  64   9.965   8.723   1.121
  436   3HG1  VAL  64          3HG1      VAL  64  10.204   7.152   0.355
  437   1HG2  VAL  64          1HG2      VAL  64   7.152   8.403   1.299
  438   2HG2  VAL  64          2HG2      VAL  64   6.394   7.891  -0.209
  439   3HG2  VAL  64          3HG2      VAL  64   6.876   9.574   0.010
  440    H    LYS  65           H        LYS  65   7.741  11.381  -2.140
  441    HA   LYS  65           HA       LYS  65   6.169  10.106  -4.055
  442   1HB   LYS  65          2HB       LYS  65   5.855  12.447  -3.230
  443   2HB   LYS  65          1HB       LYS  65   7.220  12.936  -4.225
  444   1HG   LYS  65          2HG       LYS  65   5.546  13.452  -5.657
  445   2HG   LYS  65          1HG       LYS  65   5.767  11.762  -6.112
  446   1HD   LYS  65          2HD       LYS  65   3.716  11.220  -5.418
  447   2HD   LYS  65          1HD       LYS  65   3.954  12.039  -3.872
  448   1HE   LYS  65          2HE       LYS  65   2.288  13.347  -4.690
  449   2HE   LYS  65          1HE       LYS  65   3.658  14.186  -5.418
  450   1HZ   LYS  65          1HZ       LYS  65   1.554  12.672  -6.673
  451   2HZ   LYS  65          2HZ       LYS  65   3.097  12.274  -7.239
  452   3HZ   LYS  65          3HZ       LYS  65   2.555  13.875  -7.319
  453    H    GLY  66           H        GLY  66   9.386  11.536  -4.329
  454   1HA   GLY  66          2HA       GLY  66   9.594  10.460  -7.068
  455   2HA   GLY  66          1HA       GLY  66  10.583  11.760  -6.416
  456    H    ARG  67           H        ARG  67   9.942   9.085  -4.377
  457    HA   ARG  67           HA       ARG  67  12.707   8.147  -4.751
  458   1HB   ARG  67          2HB       ARG  67  12.166   9.182  -2.550
  459   2HB   ARG  67          1HB       ARG  67  10.969   7.920  -2.290
  460   1HG   ARG  67          2HG       ARG  67  12.576   6.753  -1.310
  461   2HG   ARG  67          1HG       ARG  67  13.287   6.539  -2.912
  462   1HD   ARG  67          2HD       ARG  67  14.981   7.394  -1.464
  463   2HD   ARG  67          1HD       ARG  67  14.512   8.681  -2.576
  464    HE   ARG  67           HE       ARG  67  13.810   9.905  -0.783
  465   1HH1  ARG  67          1HH1      ARG  67  14.016   6.562   0.166
  466   2HH1  ARG  67          2HH1      ARG  67  13.664   6.879   1.832
  467   1HH2  ARG  67          1HH2      ARG  67  13.344  10.335   1.406
  468   2HH2  ARG  67          2HH2      ARG  67  13.282   9.025   2.538
  469    H    PHE  68           H        PHE  68   9.622   6.883  -3.486
  470    HA   PHE  68           HA       PHE  68  10.289   4.279  -4.669
  471   1HB   PHE  68          2HB       PHE  68   8.352   5.037  -2.476
  472   2HB   PHE  68          1HB       PHE  68   8.503   3.411  -3.132
  473    HD1  PHE  68           1HD      PHE  68   9.609   5.657  -0.653
  474    HD2  PHE  68           2HD      PHE  68  10.887   2.365  -3.030
  475    HE1  PHE  68           1HE      PHE  68  11.398   5.183   0.970
  476    HE2  PHE  68           2HE      PHE  68  12.678   1.891  -1.410
  477    HZ   PHE  68           HZ       PHE  68  12.932   3.299   0.591
  478    H    THR  69           H        THR  69   8.617   3.061  -5.722
  479    HA   THR  69           HA       THR  69   6.500   4.745  -6.905
  480    HB   THR  69           HB       THR  69   8.148   2.585  -8.234
  481    HG1  THR  69           1HG      THR  69   7.802   5.375  -8.686
  482   1HG2  THR  69          1HG2      THR  69   5.616   3.939  -9.150
  483   2HG2  THR  69          2HG2      THR  69   5.942   2.211  -9.021
  484   3HG2  THR  69          3HG2      THR  69   6.743   3.169 -10.266
  485    H    ILE  70           H        ILE  70   4.560   4.110  -6.310
  486    HA   ILE  70           HA       ILE  70   4.149   1.346  -5.442
  487    HB   ILE  70           HB       ILE  70   3.525   3.134  -3.875
  488   1HG1  ILE  70          2HG1      ILE  70   1.489   1.236  -4.959
  489   2HG1  ILE  70          1HG1      ILE  70   2.279   1.262  -3.387
  490   1HG2  ILE  70          1HG2      ILE  70   2.904   4.762  -5.692
  491   2HG2  ILE  70          2HG2      ILE  70   1.820   4.715  -4.302
  492   3HG2  ILE  70          3HG2      ILE  70   1.358   3.920  -5.806
  493   1HD1  ILE  70          1HD1      ILE  70   0.205   3.267  -4.204
  494   2HD1  ILE  70          2HD1      ILE  70   0.846   2.958  -2.590
  495   3HD1  ILE  70          3HD1      ILE  70  -0.172   1.754  -3.381
  496    H    SER  71           H        SER  71   3.282  -0.025  -6.801
  497    HA   SER  71           HA       SER  71   1.121   0.812  -8.575
  498   1HB   SER  71          2HB       SER  71   3.772  -0.283  -9.444
  499   2HB   SER  71          1HB       SER  71   2.325  -0.700 -10.364
  500    HG   SER  71           HG       SER  71   1.980   1.467 -10.763
  501    H    ARG  72           H        ARG  72   0.053  -1.114  -9.595
  502    HA   ARG  72           HA       ARG  72   0.488  -3.689  -8.395
  503   1HB   ARG  72          2HB       ARG  72  -2.033  -3.598  -7.565
  504   2HB   ARG  72          1HB       ARG  72  -0.698  -3.109  -6.531
  505   1HG   ARG  72          2HG       ARG  72  -1.664  -1.138  -6.273
  506   2HG   ARG  72          1HG       ARG  72  -1.449  -0.829  -7.997
  507   1HD   ARG  72          2HD       ARG  72  -3.703  -2.583  -7.395
  508   2HD   ARG  72          1HD       ARG  72  -3.852  -0.979  -6.681
  509    HE   ARG  72           HE       ARG  72  -3.398  -1.431  -9.560
  510   1HH1  ARG  72          1HH1      ARG  72  -4.943   0.249  -6.928
  511   2HH1  ARG  72          2HH1      ARG  72  -5.820   1.327  -7.961
  512   1HH2  ARG  72          1HH2      ARG  72  -4.547  -0.019 -10.928
  513   2HH2  ARG  72          2HH2      ARG  72  -5.595   1.174 -10.236
  514    H    ASP  73           H        ASP  73  -1.334  -5.235  -9.037
  515    HA   ASP  73           HA       ASP  73  -2.046  -4.659 -11.824
  516   1HB   ASP  73          2HB       ASP  73  -0.722  -6.769 -10.990
  517   2HB   ASP  73          1HB       ASP  73  -2.325  -7.368 -10.577
  518    H    ASN  74           H        ASN  74  -4.123  -4.728 -12.563
  519    HA   ASN  74           HA       ASN  74  -6.208  -4.410 -10.614
  520   1HB   ASN  74          2HB       ASN  74  -6.303  -4.474 -13.638
  521   2HB   ASN  74          1HB       ASN  74  -7.667  -4.066 -12.602
  522   1HD2  ASN  74          1HD2      ASN  74  -7.729  -2.042 -13.697
  523   2HD2  ASN  74          2HD2      ASN  74  -6.638  -0.776 -13.260
  524    H    ALA  75           H        ALA  75  -4.758  -7.098 -11.689
  525    HA   ALA  75           HA       ALA  75  -6.937  -8.789 -10.910
  526   1HB   ALA  75          1HB       ALA  75  -7.029  -8.123 -13.530
  527   2HB   ALA  75          2HB       ALA  75  -7.635  -9.643 -12.872
  528   3HB   ALA  75          3HB       ALA  75  -6.029  -9.574 -13.594
  529    H    LYS  76           H        LYS  76  -5.001  -8.985  -9.425
  530    HA   LYS  76           HA       LYS  76  -3.703 -11.463  -9.937
  531   1HB   LYS  76          2HB       LYS  76  -2.340  -9.652 -11.220
  532   2HB   LYS  76          1HB       LYS  76  -1.768  -9.192  -9.623
  533   1HG   LYS  76          2HG       LYS  76  -1.218 -11.732  -9.400
  534   2HG   LYS  76          1HG       LYS  76  -1.275 -11.695 -11.163
  535   1HD   LYS  76          2HD       LYS  76   0.531 -10.246 -11.318
  536   2HD   LYS  76          1HD       LYS  76   0.333  -9.664  -9.663
  537   1HE   LYS  76          2HE       LYS  76   1.305 -12.397 -10.492
  538   2HE   LYS  76          1HE       LYS  76   2.298 -11.090  -9.850
  539   1HZ   LYS  76          1HZ       LYS  76   0.332 -11.398  -7.990
  540   2HZ   LYS  76          2HZ       LYS  76   1.909 -11.995  -7.872
  541   3HZ   LYS  76          3HZ       LYS  76   0.673 -12.989  -8.458
  542    H    ASN  77           H        ASN  77  -4.525  -8.804  -7.995
  543    HA   ASN  77           HA       ASN  77  -4.553  -8.431  -5.756
  544   1HB   ASN  77          2HB       ASN  77  -4.948 -11.263  -6.118
  545   2HB   ASN  77          1HB       ASN  77  -4.072 -10.964  -4.619
  546   1HD2  ASN  77          1HD2      ASN  77  -5.051  -8.830  -3.532
  547   2HD2  ASN  77          2HD2      ASN  77  -6.757  -8.926  -3.279
  548    H    THR  78           H        THR  78  -2.369  -7.440  -6.372
  549    HA   THR  78           HA       THR  78  -0.473  -8.237  -4.358
  550    HB   THR  78           HB       THR  78   1.177  -8.005  -6.638
  551    HG1  THR  78           1HG      THR  78  -0.378  -8.699  -8.029
  552   1HG2  THR  78          1HG2      THR  78   0.948 -10.718  -5.781
  553   2HG2  THR  78          2HG2      THR  78   0.834  -9.664  -4.372
  554   3HG2  THR  78          3HG2      THR  78   2.231  -9.557  -5.442
  555    H    LEU  79           H        LEU  79   1.044  -6.648  -3.870
  556    HA   LEU  79           HA       LEU  79   0.689  -4.069  -5.256
  557   1HB   LEU  79          2HB       LEU  79  -0.306  -4.267  -2.916
  558   2HB   LEU  79          1HB       LEU  79   1.340  -4.386  -2.331
  559    HG   LEU  79           HG       LEU  79   1.843  -2.156  -3.101
  560   1HD1  LEU  79          1HD1      LEU  79  -0.988  -1.880  -4.064
  561   2HD1  LEU  79          2HD1      LEU  79   0.347  -2.312  -5.132
  562   3HD1  LEU  79          3HD1      LEU  79   0.360  -0.763  -4.285
  563   1HD2  LEU  79          1HD2      LEU  79   1.022  -1.439  -1.173
  564   2HD2  LEU  79          2HD2      LEU  79  -0.130  -2.774  -1.151
  565   3HD2  LEU  79          3HD2      LEU  79  -0.563  -1.248  -1.923
  566    H    TYR  80           H        TYR  80   2.487  -3.571  -6.324
  567    HA   TYR  80           HA       TYR  80   5.068  -4.491  -5.265
  568   1HB   TYR  80          2HB       TYR  80   4.315  -3.561  -8.041
  569   2HB   TYR  80          1HB       TYR  80   5.925  -4.075  -7.551
  570    HD1  TYR  80           1HD      TYR  80   6.538  -6.307  -7.770
  571    HD2  TYR  80           2HD      TYR  80   2.408  -5.290  -7.734
  572    HE1  TYR  80           1HE      TYR  80   5.968  -8.631  -8.326
  573    HE2  TYR  80           2HE      TYR  80   1.824  -7.610  -8.286
  574    HH   TYR  80           HH       TYR  80   3.444 -10.072  -7.844
  575    H    LEU  81           H        LEU  81   6.903  -3.079  -5.382
  576    HA   LEU  81           HA       LEU  81   6.409  -0.242  -5.717
  577   1HB   LEU  81          2HB       LEU  81   5.862  -0.641  -3.353
  578   2HB   LEU  81          1HB       LEU  81   7.441  -1.362  -3.108
  579    HG   LEU  81           HG       LEU  81   8.301   0.981  -3.967
  580   1HD1  LEU  81          1HD1      LEU  81   5.478   1.407  -3.731
  581   2HD1  LEU  81          2HD1      LEU  81   6.736   2.515  -4.281
  582   3HD1  LEU  81          3HD1      LEU  81   6.338   2.414  -2.565
  583   1HD2  LEU  81          1HD2      LEU  81   7.364   0.147  -1.269
  584   2HD2  LEU  81          2HD2      LEU  81   7.967   1.787  -1.509
  585   3HD2  LEU  81          3HD2      LEU  81   9.004   0.405  -1.865
  586    H    GLN  82           H        GLN  82   8.200   0.873  -6.355
  587    HA   GLN  82           HA       GLN  82  10.619  -0.737  -6.772
  588   1HB   GLN  82          2HB       GLN  82   9.163   0.818  -8.541
  589   2HB   GLN  82          1HB       GLN  82  10.528   1.846  -8.128
  590   1HG   GLN  82          2HG       GLN  82  10.988   0.522 -10.110
  591   2HG   GLN  82          1HG       GLN  82  12.073   0.088  -8.790
  592   1HE2  GLN  82          1HE2      GLN  82  12.510  -1.930  -9.661
  593   2HE2  GLN  82          2HE2      GLN  82  11.354  -3.213  -9.650
  594    H    MET  83           H        MET  83  12.243  -0.396  -5.463
  595    HA   MET  83           HA       MET  83  12.393   2.078  -3.928
  596   1HB   MET  83          2HB       MET  83  14.173  -0.324  -3.595
  597   2HB   MET  83          1HB       MET  83  13.781   0.916  -2.413
  598   1HG   MET  83          2HG       MET  83  11.390   0.063  -2.549
  599   2HG   MET  83          1HG       MET  83  12.056  -1.329  -3.403
  600   1HE   MET  83          1HE       MET  83  10.357  -1.621  -0.694
  601   2HE   MET  83          2HE       MET  83  10.911  -0.027  -0.181
  602   3HE   MET  83          3HE       MET  83  11.269  -1.444   0.804
  603    H    ASN  84           H        ASN  84  13.220   3.543  -5.392
  604    HA   ASN  84           HA       ASN  84  15.954   2.996  -6.351
  605   1HB   ASN  84          2HB       ASN  84  14.910   5.179  -7.794
  606   2HB   ASN  84          1HB       ASN  84  15.231   3.556  -8.393
  607   1HD2  ASN  84          1HD2      ASN  84  13.495   1.967  -8.106
  608   2HD2  ASN  84          2HD2      ASN  84  11.859   2.506  -8.239
  609    H    SER  85           H        SER  85  17.337   4.944  -6.557
  610    HA   SER  85           HA       SER  85  18.447   6.663  -5.559
  611   1HB   SER  85          2HB       SER  85  15.717   7.542  -5.960
  612   2HB   SER  85          1HB       SER  85  16.430   8.329  -4.552
  613    HG   SER  85           HG       SER  85  18.270   8.764  -6.012
  614    H    LEU  86           H        LEU  86  18.518   4.612  -3.942
  615    HA   LEU  86           HA       LEU  86  17.314   4.926  -1.405
  616   1HB   LEU  86          2HB       LEU  86  19.831   3.442  -2.164
  617   2HB   LEU  86          1HB       LEU  86  18.979   3.272  -0.642
  618    HG   LEU  86           HG       LEU  86  18.278   1.410  -1.827
  619   1HD1  LEU  86          1HD1      LEU  86  16.047   2.891  -2.963
  620   2HD1  LEU  86          2HD1      LEU  86  16.404   3.348  -1.298
  621   3HD1  LEU  86          3HD1      LEU  86  16.069   1.663  -1.697
  622   1HD2  LEU  86          1HD2      LEU  86  19.038   1.458  -3.952
  623   2HD2  LEU  86          2HD2      LEU  86  18.614   3.155  -4.184
  624   3HD2  LEU  86          3HD2      LEU  86  17.368   1.912  -4.294
  625    H    LYS  87           H        LYS  87  18.460   5.350   0.629
  626    HA   LYS  87           HA       LYS  87  20.915   6.831   0.594
  627   1HB   LYS  87          2HB       LYS  87  19.943   8.932   1.505
  628   2HB   LYS  87          1HB       LYS  87  19.479   8.618  -0.162
  629   1HG   LYS  87          2HG       LYS  87  17.459   7.433   1.280
  630   2HG   LYS  87          1HG       LYS  87  17.833   8.882   2.216
  631   1HD   LYS  87          2HD       LYS  87  17.784   9.493  -0.594
  632   2HD   LYS  87          1HD       LYS  87  16.281   8.701  -0.114
  633   1HE   LYS  87          2HE       LYS  87  15.642  10.754   0.521
  634   2HE   LYS  87          1HE       LYS  87  16.656  10.459   1.933
  635   1HZ   LYS  87          1HZ       LYS  87  18.275  11.837   1.175
  636   2HZ   LYS  87          2HZ       LYS  87  16.949  12.590   0.441
  637   3HZ   LYS  87          3HZ       LYS  87  17.936  11.552  -0.460
  638    H    SER  88           H        SER  88  20.263   4.530   1.900
  639    HA   SER  88           HA       SER  88  20.358   3.513   3.929
  640   1HB   SER  88          2HB       SER  88  21.051   6.246   5.027
  641   2HB   SER  88          1HB       SER  88  21.395   4.684   5.771
  642    HG   SER  88           HG       SER  88  23.235   4.962   4.762
  643    H    GLU  89           H        GLU  89  17.992   5.379   3.011
  644    HA   GLU  89           HA       GLU  89  16.585   5.528   5.577
  645   1HB   GLU  89          2HB       GLU  89  16.421   7.570   4.381
  646   2HB   GLU  89          1HB       GLU  89  16.063   6.745   2.870
  647   1HG   GLU  89          2HG       GLU  89  14.012   7.594   3.490
  648   2HG   GLU  89          1HG       GLU  89  13.937   5.931   4.074
  649    H    ASP  90           H        ASP  90  16.344   4.149   2.340
  650    HA   ASP  90           HA       ASP  90  13.856   2.901   2.580
  651   1HB   ASP  90          2HB       ASP  90  14.896   3.060   0.424
  652   2HB   ASP  90          1HB       ASP  90  16.310   2.168   0.975
  653    H    THR  91           H        THR  91  16.925   2.130   3.951
  654    HA   THR  91           HA       THR  91  16.660  -0.622   4.390
  655    HB   THR  91           HB       THR  91  18.078   1.392   6.148
  656    HG1  THR  91           1HG      THR  91  19.517   1.453   4.603
  657   1HG2  THR  91          1HG2      THR  91  19.532  -0.655   6.614
  658   2HG2  THR  91          2HG2      THR  91  18.211  -1.607   5.937
  659   3HG2  THR  91          3HG2      THR  91  17.941  -0.618   7.373
  660    H    ALA  92           H        ALA  92  14.667  -1.252   5.101
  661    HA   ALA  92           HA       ALA  92  14.162  -1.231   7.873
  662   1HB   ALA  92          1HB       ALA  92  13.363   0.930   7.864
  663   2HB   ALA  92          2HB       ALA  92  11.882   0.015   7.579
  664   3HB   ALA  92          3HB       ALA  92  12.710   0.796   6.231
  665    H    VAL  93           H        VAL  93  11.393  -1.586   7.887
  666    HA   VAL  93           HA       VAL  93  11.109  -3.955   6.152
  667    HB   VAL  93           HB       VAL  93   9.609  -3.513   8.732
  668   1HG1  VAL  93          1HG1      VAL  93   8.494  -5.134   7.500
  669   2HG1  VAL  93          2HG1      VAL  93   9.578  -6.097   8.505
  670   3HG1  VAL  93          3HG1      VAL  93   9.985  -5.784   6.816
  671   1HG2  VAL  93          1HG2      VAL  93  11.822  -3.593   9.490
  672   2HG2  VAL  93          2HG2      VAL  93  12.297  -4.767   8.262
  673   3HG2  VAL  93          3HG2      VAL  93  11.273  -5.265   9.608
  674    H    TYR  94           H        TYR  94   9.540  -3.906   4.673
  675    HA   TYR  94           HA       TYR  94   7.549  -1.756   4.901
  676   1HB   TYR  94          2HB       TYR  94   8.675  -3.188   2.499
  677   2HB   TYR  94          1HB       TYR  94   7.277  -2.121   2.407
  678    HD1  TYR  94           1HD      TYR  94  10.752  -2.082   3.794
  679    HD2  TYR  94           2HD      TYR  94   7.676   0.067   1.789
  680    HE1  TYR  94           1HE      TYR  94  12.253  -0.147   3.578
  681    HE2  TYR  94           2HE      TYR  94   9.171   2.010   1.567
  682    HH   TYR  94           HH       TYR  94  12.159   2.224   3.245
  683    H    TYR  95           H        TYR  95   5.397  -2.096   4.501
  684    HA   TYR  95           HA       TYR  95   4.453  -4.847   4.163
  685   1HB   TYR  95          2HB       TYR  95   3.047  -3.123   6.164
  686   2HB   TYR  95          1HB       TYR  95   3.107  -4.876   6.050
  687    HD1  TYR  95           1HD      TYR  95   4.997  -1.880   7.112
  688    HD2  TYR  95           2HD      TYR  95   4.737  -6.125   7.236
  689    HE1  TYR  95           1HE      TYR  95   6.705  -1.928   8.879
  690    HE2  TYR  95           2HE      TYR  95   6.443  -6.183   9.004
  691    HH   TYR  95           HH       TYR  95   7.802  -4.995  10.293
  692    H    CYS  96           H        CYS  96   2.075  -4.875   3.683
  693    HA   CYS  96           HA       CYS  96   1.257  -2.412   2.302
  694   1HB   CYS  96          2HB       CYS  96   0.400  -3.635   0.487
  695   2HB   CYS  96          1HB       CYS  96   1.940  -4.414   0.829
  696    H    ALA  97           H        ALA  97  -0.810  -1.730   2.632
  697    HA   ALA  97           HA       ALA  97  -2.705  -3.461   4.005
  698   1HB   ALA  97          1HB       ALA  97  -2.250  -2.674   6.025
  699   2HB   ALA  97          2HB       ALA  97  -2.875  -1.116   5.487
  700   3HB   ALA  97          3HB       ALA  97  -1.147  -1.460   5.375
  701    H    LYS  98           H        LYS  98  -4.819  -2.402   4.323
  702    HA   LYS  98           HA       LYS  98  -5.507  -0.891   1.936
  703   1HB   LYS  98          2HB       LYS  98  -6.932  -2.739   2.388
  704   2HB   LYS  98          1HB       LYS  98  -7.129  -2.267   4.069
  705   1HG   LYS  98          2HG       LYS  98  -8.203  -0.124   3.053
  706   2HG   LYS  98          1HG       LYS  98  -8.404  -1.138   1.623
  707   1HD   LYS  98          2HD       LYS  98  -9.417  -1.749   4.400
  708   2HD   LYS  98          1HD       LYS  98 -10.395  -1.218   3.030
  709   1HE   LYS  98          2HE       LYS  98  -9.881  -3.248   1.827
  710   2HE   LYS  98          1HE       LYS  98  -8.767  -3.756   3.098
  711   1HZ   LYS  98          1HZ       LYS  98 -10.616  -4.913   3.695
  712   2HZ   LYS  98          2HZ       LYS  98 -11.694  -3.768   3.074
  713   3HZ   LYS  98          3HZ       LYS  98 -10.922  -3.487   4.552
  714    H    TYR  99           H        TYR  99  -6.495   1.115   1.913
  715    HA   TYR  99           HA       TYR  99  -5.930   2.797   4.213
  716   1HB   TYR  99          2HB       TYR  99  -5.867   3.184   1.452
  717   2HB   TYR  99          1HB       TYR  99  -7.255   4.122   1.990
  718    HD1  TYR  99           1HD      TYR  99  -6.934   6.261   2.841
  719    HD2  TYR  99           2HD      TYR  99  -3.645   3.565   2.742
  720    HE1  TYR  99           1HE      TYR  99  -5.434   8.075   3.550
  721    HE2  TYR  99           2HE      TYR  99  -2.135   5.371   3.453
  722    HH   TYR  99           HH       TYR  99  -2.070   7.851   3.383
  723    H    SER 100           H        SER 100  -7.405   3.544   5.613
  724    HA   SER 100           HA       SER 100 -10.229   3.564   4.874
  725   1HB   SER 100          2HB       SER 100  -9.034   1.942   7.103
  726   2HB   SER 100          1HB       SER 100 -10.684   2.552   7.231
  727    HG   SER 100           HG       SER 100 -11.286   1.029   5.930
  728    H    GLY 101           H        GLY 101  -9.026   5.849   4.934
  729   1HA   GLY 101          2HA       GLY 101 -10.181   7.682   6.331
  730   2HA   GLY 101          1HA       GLY 101  -9.265   6.967   7.648
  731    H    GLY 102           H        GLY 102  -6.961   7.125   7.623
  732   1HA   GLY 102          2HA       GLY 102  -5.680   8.735   5.594
  733   2HA   GLY 102          1HA       GLY 102  -5.876   9.558   7.135
  734    H    ALA 103           H        ALA 103  -5.537   6.266   7.630
  735    HA   ALA 103           HA       ALA 103  -2.616   6.348   7.738
  736   1HB   ALA 103          1HB       ALA 103  -2.701   5.399  10.069
  737   2HB   ALA 103          2HB       ALA 103  -4.402   5.863  10.111
  738   3HB   ALA 103          3HB       ALA 103  -3.155   7.097   9.924
  739    H    LEU 104           H        LEU 104  -1.637   4.236   8.002
  740    HA   LEU 104           HA       LEU 104  -3.329   2.141   6.858
  741   1HB   LEU 104          2HB       LEU 104  -0.471   2.824   6.730
  742   2HB   LEU 104          1HB       LEU 104  -0.796   1.110   6.879
  743    HG   LEU 104           HG       LEU 104  -1.261   2.935   4.595
  744   1HD1  LEU 104          1HD1      LEU 104   0.016   0.418   5.169
  745   2HD1  LEU 104          2HD1      LEU 104   0.216   1.493   3.786
  746   3HD1  LEU 104          3HD1      LEU 104  -1.064   0.280   3.782
  747   1HD2  LEU 104          1HD2      LEU 104  -3.543   2.403   4.991
  748   2HD2  LEU 104          2HD2      LEU 104  -3.157   0.709   5.302
  749   3HD2  LEU 104          3HD2      LEU 104  -2.985   1.370   3.676
  750    H    ASP 105           H        ASP 105  -3.395   0.044   7.698
  751    HA   ASP 105           HA       ASP 105  -2.939  -0.084  10.586
  752   1HB   ASP 105          2HB       ASP 105  -4.932  -1.137   8.763
  753   2HB   ASP 105          1HB       ASP 105  -4.249  -2.419   9.759
  754    H    ALA 106           H        ALA 106  -2.014  -1.565   7.573
  755    HA   ALA 106           HA       ALA 106  -0.356  -2.998   6.988
  756   1HB   ALA 106          1HB       ALA 106   1.644  -2.874   8.106
  757   2HB   ALA 106          2HB       ALA 106   0.878  -2.822   9.695
  758   3HB   ALA 106          3HB       ALA 106   0.850  -1.398   8.654
  759    H    TRP 107           H        TRP 107  -0.962  -5.023   6.690
  760    HA   TRP 107           HA       TRP 107  -1.261  -6.758   9.047
  761   1HB   TRP 107          2HB       TRP 107  -2.836  -7.159   6.510
  762   2HB   TRP 107          1HB       TRP 107  -3.108  -7.891   8.087
  763    HD1  TRP 107           HD       TRP 107  -3.404  -5.506   9.985
  764    HE1  TRP 107           1HE      TRP 107  -5.307  -3.790   9.715
  765    HE3  TRP 107           3HE      TRP 107  -4.506  -6.305   5.072
  766    HZ2  TRP 107           2HZ      TRP 107  -7.048  -2.895   7.672
  767    HZ3  TRP 107           3HZ      TRP 107  -6.298  -4.983   4.028
  768    HH2  TRP 107           HH       TRP 107  -7.542  -3.317   5.301
  769    H    GLY 108           H        GLY 108   0.639  -6.071   6.573
  770   1HA   GLY 108          2HA       GLY 108   1.034  -8.578   5.292
  771   2HA   GLY 108          1HA       GLY 108   2.145  -7.217   5.264
  772    H    GLN 109           H        GLN 109   3.333  -9.556   5.306
  773    HA   GLN 109           HA       GLN 109   3.766 -10.574   7.955
  774   1HB   GLN 109          2HB       GLN 109   4.860 -11.154   5.239
  775   2HB   GLN 109          1HB       GLN 109   5.764 -11.705   6.643
  776   1HG   GLN 109          2HG       GLN 109   2.849 -12.311   6.367
  777   2HG   GLN 109          1HG       GLN 109   4.062 -13.292   5.546
  778   1HE2  GLN 109          1HE2      GLN 109   4.026 -15.138   6.655
  779   2HE2  GLN 109          2HE2      GLN 109   4.287 -15.283   8.356
  780    H    GLY 110           H        GLY 110   5.849  -8.852   5.616
  781   1HA   GLY 110          2HA       GLY 110   6.991  -6.863   6.716
  782   2HA   GLY 110          1HA       GLY 110   7.530  -8.042   7.902
  783    H    THR 111           H        THR 111   8.026  -6.707   4.756
  784    HA   THR 111           HA       THR 111  10.034  -8.675   4.036
  785    HB   THR 111           HB       THR 111   8.766  -7.843   2.190
  786    HG1  THR 111           1HG      THR 111  11.053  -8.093   1.844
  787   1HG2  THR 111          1HG2      THR 111   8.872  -5.370   3.598
  788   2HG2  THR 111          2HG2      THR 111   7.924  -5.783   2.169
  789   3HG2  THR 111          3HG2      THR 111   9.548  -5.122   1.988
  790    H    GLN 112           H        GLN 112  12.076  -8.561   4.638
  791    HA   GLN 112           HA       GLN 112  13.070  -6.207   5.989
  792   1HB   GLN 112          2HB       GLN 112  13.616  -8.293   7.004
  793   2HB   GLN 112          1HB       GLN 112  14.223  -8.949   5.490
  794   1HG   GLN 112          2HG       GLN 112  16.128  -8.473   6.746
  795   2HG   GLN 112          1HG       GLN 112  16.004  -7.140   5.599
  796   1HE2  GLN 112          1HE2      GLN 112  16.181  -5.173   6.392
  797   2HE2  GLN 112          2HE2      GLN 112  15.958  -4.718   8.043
  798    H    VAL 113           H        VAL 113  13.593  -4.584   4.666
  799    HA   VAL 113           HA       VAL 113  15.317  -5.152   2.346
  800    HB   VAL 113           HB       VAL 113  13.612  -2.720   2.915
  801   1HG1  VAL 113          1HG1      VAL 113  14.709  -3.112   0.223
  802   2HG1  VAL 113          2HG1      VAL 113  15.909  -2.743   1.461
  803   3HG1  VAL 113          3HG1      VAL 113  14.560  -1.642   1.186
  804   1HG2  VAL 113          1HG2      VAL 113  13.217  -4.535   0.585
  805   2HG2  VAL 113          2HG2      VAL 113  12.052  -3.519   1.435
  806   3HG2  VAL 113          3HG2      VAL 113  12.605  -5.025   2.165
  807    H    THR 114           H        THR 114  17.386  -4.471   2.383
  808    HA   THR 114           HA       THR 114  18.126  -2.359   4.292
  809    HB   THR 114           HB       THR 114  19.763  -4.868   3.929
  810    HG1  THR 114           1HG      THR 114  18.450  -5.761   5.313
  811   1HG2  THR 114          1HG2      THR 114  21.206  -4.031   5.495
  812   2HG2  THR 114          2HG2      THR 114  19.959  -3.069   6.289
  813   3HG2  THR 114          3HG2      THR 114  20.666  -2.518   4.770
  814    H    VAL 115           H        VAL 115  19.987  -1.174   3.795
  815    HA   VAL 115           HA       VAL 115  21.027  -1.523   1.059
  816    HB   VAL 115           HB       VAL 115  20.597   1.142   2.418
  817   1HG1  VAL 115          1HG1      VAL 115  21.031   2.067   0.204
  818   2HG1  VAL 115          2HG1      VAL 115  21.277   0.442  -0.436
  819   3HG1  VAL 115          3HG1      VAL 115  22.395   1.096   0.761
  820   1HG2  VAL 115          1HG2      VAL 115  18.746   1.441   0.779
  821   2HG2  VAL 115          2HG2      VAL 115  18.428   0.204   1.995
  822   3HG2  VAL 115          3HG2      VAL 115  18.899  -0.266   0.362
  823    H    SER 116           H        SER 116  23.181  -1.654   0.918
  824    HA   SER 116           HA       SER 116  24.850  -0.429   2.977
  825   1HB   SER 116          2HB       SER 116  24.256  -3.088   3.179
  826   2HB   SER 116          1HB       SER 116  25.739  -3.136   2.227
  827    HG   SER 116           HG       SER 116  26.713  -2.850   4.059
  828    H    SER 117           H        SER 117  27.296  -1.115   2.295
  829    HA   SER 117           HA       SER 117  27.527  -0.657  -0.603
  830   1HB   SER 117          2HB       SER 117  29.530   0.599   1.218
  831   2HB   SER 117          1HB       SER 117  28.943   1.142  -0.354
  832    HG   SER 117           HG       SER 117  27.384   1.164   2.016
  833    H    GLN 118           H        GLN 118  29.253  -1.614  -1.632
  834    HA   GLN 118           HA       GLN 118  30.798  -3.228  -2.037
  835   1HB   GLN 118          2HB       GLN 118  31.712  -2.201   0.642
  836   2HB   GLN 118          1HB       GLN 118  32.597  -3.451  -0.222
  837   1HG   GLN 118          2HG       GLN 118  31.991  -0.699  -1.280
  838   2HG   GLN 118          1HG       GLN 118  33.528  -1.215  -0.586
  839   1HE2  GLN 118          1HE2      GLN 118  31.321  -1.605  -3.270
  840   2HE2  GLN 118          2HE2      GLN 118  32.470  -2.283  -4.369
  841    H    SER 119           H        SER 119  28.551  -4.428  -1.509
  842    HA   SER 119           HA       SER 119  29.283  -6.639   0.290
  843   1HB   SER 119          2HB       SER 119  27.430  -5.034   1.137
  844   2HB   SER 119          1HB       SER 119  26.419  -5.797  -0.090
  845    HG   SER 119           HG       SER 119  27.823  -7.176   1.956
  846    H    GLU 120           H        GLU 120  29.982  -6.848  -2.268
  847    HA   GLU 120           HA       GLU 120  27.860  -8.226  -3.725
  848   1HB   GLU 120          2HB       GLU 120  30.458  -6.995  -4.428
  849   2HB   GLU 120          1HB       GLU 120  30.016  -8.427  -5.347
  850   1HG   GLU 120          2HG       GLU 120  27.773  -7.250  -5.730
  851   2HG   GLU 120          1HG       GLU 120  28.603  -5.795  -5.180
  852    H    GLN 121           H        GLN 121  29.677  -9.133  -1.303
  853    HA   GLN 121           HA       GLN 121  31.082 -11.414  -2.222
  854   1HB   GLN 121          2HB       GLN 121  30.588 -10.109   0.277
  855   2HB   GLN 121          1HB       GLN 121  30.264 -11.827   0.464
  856   1HG   GLN 121          2HG       GLN 121  32.424 -12.264   0.561
  857   2HG   GLN 121          1HG       GLN 121  32.688 -11.490  -1.000
  858   1HE2  GLN 121          1HE2      GLN 121  33.214 -11.328   2.325
  859   2HE2  GLN 121          2HE2      GLN 121  33.901  -9.744   2.394
  860    H    LYS 122           H        LYS 122  30.552 -13.629  -1.995
  861    HA   LYS 122           HA       LYS 122  27.863 -14.411  -1.319
  862   1HB   LYS 122          2HB       LYS 122  27.303 -15.360  -3.496
  863   2HB   LYS 122          1HB       LYS 122  27.558 -13.625  -3.625
  864   1HG   LYS 122          2HG       LYS 122  29.987 -14.321  -4.279
  865   2HG   LYS 122          1HG       LYS 122  29.226 -15.868  -4.656
  866   1HD   LYS 122          2HD       LYS 122  27.635 -13.746  -5.728
  867   2HD   LYS 122          1HD       LYS 122  29.310 -13.537  -6.244
  868   1HE   LYS 122          2HE       LYS 122  28.252 -14.889  -7.880
  869   2HE   LYS 122          1HE       LYS 122  29.290 -15.953  -6.933
  870   1HZ   LYS 122          1HZ       LYS 122  27.522 -17.205  -6.547
  871   2HZ   LYS 122          2HZ       LYS 122  26.507 -16.115  -7.348
  872   3HZ   LYS 122          3HZ       LYS 122  26.806 -15.931  -5.693
  873    H    LEU 123           H        LEU 123  31.132 -15.025  -1.866
  874    HA   LEU 123           HA       LEU 123  32.494 -16.789  -1.436
  875   1HB   LEU 123          2HB       LEU 123  30.199 -17.170   0.270
  876   2HB   LEU 123          1HB       LEU 123  30.848 -18.719  -0.232
  877    HG   LEU 123           HG       LEU 123  31.793 -17.996   1.905
  878   1HD1  LEU 123          1HD1      LEU 123  33.694 -18.080  -0.426
  879   2HD1  LEU 123          2HD1      LEU 123  33.184 -19.416   0.607
  880   3HD1  LEU 123          3HD1      LEU 123  34.212 -18.139   1.259
  881   1HD2  LEU 123          1HD2      LEU 123  33.095 -16.043   2.161
  882   2HD2  LEU 123          2HD2      LEU 123  31.618 -15.535   1.343
  883   3HD2  LEU 123          3HD2      LEU 123  33.111 -15.733   0.426
  884    H    ILE 124           H        ILE 124  33.140 -17.866  -3.170
  885    HA   ILE 124           HA       ILE 124  31.347 -19.906  -4.296
  886    HB   ILE 124           HB       ILE 124  31.183 -18.267  -5.946
  887   1HG1  ILE 124          2HG1      ILE 124  32.700 -19.051  -7.834
  888   2HG1  ILE 124          1HG1      ILE 124  33.452 -20.129  -6.661
  889   1HG2  ILE 124          1HG2      ILE 124  32.768 -16.710  -6.554
  890   2HG2  ILE 124          2HG2      ILE 124  34.117 -17.747  -6.096
  891   3HG2  ILE 124          3HG2      ILE 124  33.147 -16.961  -4.851
  892   1HD1  ILE 124          1HD1      ILE 124  30.905 -20.356  -8.062
  893   2HD1  ILE 124          2HD1      ILE 124  30.806 -20.693  -6.334
  894   3HD1  ILE 124          3HD1      ILE 124  31.929 -21.601  -7.347
  895    H    SER 125           H        SER 125  34.713 -18.729  -4.533
  896    HA   SER 125           HA       SER 125  36.704 -19.826  -4.631
  897   1HB   SER 125          2HB       SER 125  35.644 -22.090  -3.008
  898   2HB   SER 125          1HB       SER 125  37.141 -21.176  -2.823
  899    HG   SER 125           HG       SER 125  34.730 -20.786  -1.650
  900    H    GLU 126           H        GLU 126  35.072 -20.338  -6.819
  901    HA   GLU 126           HA       GLU 126  36.246 -22.751  -7.801
  902   1HB   GLU 126          2HB       GLU 126  33.705 -22.984  -6.572
  903   2HB   GLU 126          1HB       GLU 126  33.447 -23.127  -8.305
  904   1HG   GLU 126          2HG       GLU 126  35.293 -24.852  -8.304
  905   2HG   GLU 126          1HG       GLU 126  35.188 -24.823  -6.544
  906    H    GLU 127           H        GLU 127  35.652 -19.767  -8.302
  907    HA   GLU 127           HA       GLU 127  35.450 -18.385 -10.092
  908   1HB   GLU 127          2HB       GLU 127  37.090 -20.049 -11.041
  909   2HB   GLU 127          1HB       GLU 127  35.726 -20.859 -11.799
  910   1HG   GLU 127          2HG       GLU 127  35.624 -19.373 -13.450
  911   2HG   GLU 127          1HG       GLU 127  35.783 -18.007 -12.348
  912    H    ASP 128           H        ASP 128  33.496 -17.510 -10.260
  913    HA   ASP 128           HA       ASP 128  31.115 -19.003 -10.649
  914   1HB   ASP 128          2HB       ASP 128  30.061 -16.743 -10.938
  915   2HB   ASP 128          1HB       ASP 128  30.991 -16.926  -9.455
  916    H    LEU 129           H        LEU 129  33.348 -17.423 -12.807
  917    HA   LEU 129           HA       LEU 129  33.463 -17.253 -15.074
  918   1HB   LEU 129          2HB       LEU 129  31.676 -19.678 -14.874
  919   2HB   LEU 129          1HB       LEU 129  32.398 -19.115 -16.369
  920    HG   LEU 129           HG       LEU 129  34.136 -19.771 -14.018
  921   1HD1  LEU 129          1HD1      LEU 129  34.328 -22.056 -14.784
  922   2HD1  LEU 129          2HD1      LEU 129  33.148 -21.755 -16.060
  923   3HD1  LEU 129          3HD1      LEU 129  32.651 -21.702 -14.369
  924   1HD2  LEU 129          1HD2      LEU 129  34.773 -20.270 -16.887
  925   2HD2  LEU 129          2HD2      LEU 129  35.845 -19.855 -15.549
  926   3HD2  LEU 129          3HD2      LEU 129  34.818 -18.617 -16.271
  927    H    ASN 130           H        ASN 130  31.211 -18.130 -16.877
  928    HA   ASN 130           HA       ASN 130  29.056 -16.316 -16.207
  929   1HB   ASN 130          2HB       ASN 130  31.058 -15.092 -17.436
  930   2HB   ASN 130          1HB       ASN 130  30.323 -15.813 -18.865
  931   1HD2  ASN 130          1HD2      ASN 130  28.258 -15.172 -19.492
  932   2HD2  ASN 130          2HD2      ASN 130  27.537 -13.716 -18.905
  933    H    HIS 131           H        HIS 131  30.446 -17.980 -19.045
  934    HA   HIS 131           HA       HIS 131  28.250 -19.809 -19.196
  935   1HB   HIS 131          2HB       HIS 131  27.633 -19.013 -21.566
  936   2HB   HIS 131          1HB       HIS 131  27.001 -18.095 -20.204
  937    HD1  HIS 131           1HD      HIS 131  30.548 -17.483 -20.980
  938    HD2  HIS 131           2HD      HIS 131  26.860 -15.883 -22.030
  939    HE1  HIS 131           1HE      HIS 131  31.056 -15.253 -22.026
  940    HE2  HIS 131           2HE      HIS 131  28.803 -14.263 -22.566
  941    H    HIS 132           H        HIS 132  31.181 -19.790 -19.118
  942    HA   HIS 132           HA       HIS 132  31.988 -20.732 -21.744
  943   1HB   HIS 132          2HB       HIS 132  33.322 -19.639 -19.471
  944   2HB   HIS 132          1HB       HIS 132  33.996 -21.235 -19.785
  945    HD1  HIS 132           1HD      HIS 132  35.632 -21.422 -21.669
  946    HD2  HIS 132           2HD      HIS 132  33.523 -17.843 -21.749
  947    HE1  HIS 132           1HE      HIS 132  36.713 -20.045 -23.474
  948    HE2  HIS 132           2HE      HIS 132  35.419 -17.884 -23.508
  949    H    HIS 133           H        HIS 133  30.152 -22.093 -19.560
  950    HA   HIS 133           HA       HIS 133  30.861 -24.768 -20.316
  951   1HB   HIS 133          2HB       HIS 133  31.825 -23.715 -17.807
  952   2HB   HIS 133          1HB       HIS 133  30.707 -25.045 -17.523
  953    HD1  HIS 133           1HD      HIS 133  31.960 -26.115 -20.527
  954    HD2  HIS 133           2HD      HIS 133  33.724 -25.708 -16.787
  955    HE1  HIS 133           1HE      HIS 133  33.955 -27.645 -20.555
  956    HE2  HIS 133           2HE      HIS 133  34.962 -27.441 -18.255
  957    H    HIS 134           H        HIS 134  29.090 -26.028 -20.370
  958    HA   HIS 134           HA       HIS 134  26.734 -25.198 -18.820
  959   1HB   HIS 134          2HB       HIS 134  25.810 -26.313 -21.256
  960   2HB   HIS 134          1HB       HIS 134  25.612 -24.663 -20.677
  961    HD1  HIS 134           1HD      HIS 134  26.926 -22.856 -21.850
  962    HD2  HIS 134           2HD      HIS 134  28.058 -26.684 -23.004
  963    HE1  HIS 134           1HE      HIS 134  28.465 -22.540 -23.814
  964    HE2  HIS 134           2HE      HIS 134  29.224 -24.863 -24.421
  965    H    HIS 135           H        HIS 135  28.810 -27.361 -18.615
  966    HA   HIS 135           HA       HIS 135  28.947 -29.572 -18.094
  967   1HB   HIS 135          2HB       HIS 135  26.900 -28.613 -16.676
  968   2HB   HIS 135          1HB       HIS 135  26.007 -29.766 -17.662
  969    HD1  HIS 135           1HD      HIS 135  28.644 -29.583 -14.999
  970    HD2  HIS 135           2HD      HIS 135  26.421 -32.444 -17.034
  971    HE1  HIS 135           1HE      HIS 135  29.028 -31.738 -13.761
  972    HE2  HIS 135           2HE      HIS 135  27.586 -33.430 -14.945
  Start of MODEL    2
    1   1H    ASP   1          1HT       ASP   1  -9.544 -10.433   9.905
    2   2H    ASP   1          2HT       ASP   1 -10.397  -9.002  10.198
    3   3H    ASP   1          3HT       ASP   1  -8.821  -8.937   9.586
    4    HA   ASP   1           HA       ASP   1 -11.032 -10.249   8.130
    5   1HB   ASP   1          2HB       ASP   1 -10.552  -7.426   8.615
    6   2HB   ASP   1          1HB       ASP   1 -10.473  -7.802   6.893
    7    H    VAL   2           H        VAL   2 -10.068  -8.751   5.768
    8    HA   VAL   2           HA       VAL   2  -8.405 -10.613   4.612
    9    HB   VAL   2           HB       VAL   2  -9.354  -9.228   3.043
   10   1HG1  VAL   2          1HG1      VAL   2  -8.620  -6.936   4.843
   11   2HG1  VAL   2          2HG1      VAL   2 -10.228  -7.505   4.393
   12   3HG1  VAL   2          3HG1      VAL   2  -9.209  -6.701   3.198
   13   1HG2  VAL   2          1HG2      VAL   2  -6.816  -7.669   3.188
   14   2HG2  VAL   2          2HG2      VAL   2  -7.655  -8.322   1.781
   15   3HG2  VAL   2          3HG2      VAL   2  -6.763  -9.400   2.854
   16    H    GLN   3           H        GLN   3  -6.360 -11.152   4.858
   17    HA   GLN   3           HA       GLN   3  -4.508  -9.219   6.092
   18   1HB   GLN   3          2HB       GLN   3  -5.209 -11.795   6.945
   19   2HB   GLN   3          1HB       GLN   3  -3.615 -11.971   6.226
   20   1HG   GLN   3          2HG       GLN   3  -3.652  -9.648   7.887
   21   2HG   GLN   3          1HG       GLN   3  -4.271 -11.031   8.790
   22   1HE2  GLN   3          1HE2      GLN   3  -1.758 -10.642   6.315
   23   2HE2  GLN   3          2HE2      GLN   3  -0.495 -11.379   7.235
   24    H    LEU   4           H        LEU   4  -2.532  -8.872   5.115
   25    HA   LEU   4           HA       LEU   4  -2.109 -10.297   2.568
   26   1HB   LEU   4          2HB       LEU   4  -0.711  -7.780   2.700
   27   2HB   LEU   4          1HB       LEU   4  -1.843  -8.365   1.497
   28    HG   LEU   4           HG       LEU   4  -2.728  -7.127   4.100
   29   1HD1  LEU   4          1HD1      LEU   4  -3.164  -5.098   2.706
   30   2HD1  LEU   4          2HD1      LEU   4  -2.187  -5.839   1.438
   31   3HD1  LEU   4          3HD1      LEU   4  -1.460  -5.447   2.994
   32   1HD2  LEU   4          1HD2      LEU   4  -4.855  -7.025   3.155
   33   2HD2  LEU   4          2HD2      LEU   4  -4.260  -8.609   2.660
   34   3HD2  LEU   4          3HD2      LEU   4  -4.244  -7.266   1.518
   35    H    GLN   5           H        GLN   5   0.117 -10.530   1.874
   36    HA   GLN   5           HA       GLN   5   2.032 -10.576   4.109
   37   1HB   GLN   5          2HB       GLN   5   2.098 -12.646   1.941
   38   2HB   GLN   5          1HB       GLN   5   2.783 -12.717   3.558
   39   1HG   GLN   5          2HG       GLN   5   0.343 -12.664   4.365
   40   2HG   GLN   5          1HG       GLN   5  -0.058 -13.085   2.700
   41   1HE2  GLN   5          1HE2      GLN   5   1.763 -14.850   1.954
   42   2HE2  GLN   5          2HE2      GLN   5   1.753 -16.248   2.968
   43    H    ALA   6           H        ALA   6   3.570  -9.147   3.683
   44    HA   ALA   6           HA       ALA   6   4.293  -8.578   0.908
   45   1HB   ALA   6          1HB       ALA   6   5.594  -6.683   1.975
   46   2HB   ALA   6          2HB       ALA   6   4.811  -7.133   3.491
   47   3HB   ALA   6          3HB       ALA   6   3.836  -6.610   2.117
   48    H    SER   7           H        SER   7   6.263  -8.966   0.047
   49    HA   SER   7           HA       SER   7   8.551  -9.637   1.632
   50   1HB   SER   7          2HB       SER   7   7.000 -11.757   1.443
   51   2HB   SER   7          1HB       SER   7   7.693 -11.866  -0.175
   52    HG   SER   7           HG       SER   7   8.762 -12.742   2.022
   53    H    GLY   8           H        GLY   8  10.230 -10.763  -0.062
   54   1HA   GLY   8          2HA       GLY   8  11.075 -10.700  -2.299
   55   2HA   GLY   8          1HA       GLY   8  10.007  -9.343  -2.627
   56    H    GLY   9           H        GLY   9  11.304  -8.805   0.351
   57   1HA   GLY   9          2HA       GLY   9  12.857  -6.611  -0.471
   58   2HA   GLY   9          1HA       GLY   9  12.883  -7.333   1.132
   59    H    GLY  10           H        GLY  10  15.113  -6.247  -0.367
   60   1HA   GLY  10          2HA       GLY  10  16.859  -8.569  -0.144
   61   2HA   GLY  10          1HA       GLY  10  16.776  -7.831  -1.735
   62    H    LEU  11           H        LEU  11  19.160  -7.773  -1.083
   63    HA   LEU  11           HA       LEU  11  19.789  -5.368   0.484
   64   1HB   LEU  11          2HB       LEU  11  21.034  -7.943   0.157
   65   2HB   LEU  11          1HB       LEU  11  22.155  -6.681  -0.315
   66    HG   LEU  11           HG       LEU  11  22.541  -7.183   1.985
   67   1HD1  LEU  11          1HD1      LEU  11  22.318  -5.051   2.985
   68   2HD1  LEU  11          2HD1      LEU  11  20.918  -4.652   1.988
   69   3HD1  LEU  11          3HD1      LEU  11  22.516  -4.775   1.254
   70   1HD2  LEU  11          1HD2      LEU  11  19.574  -6.799   2.338
   71   2HD2  LEU  11          2HD2      LEU  11  20.722  -6.900   3.673
   72   3HD2  LEU  11          3HD2      LEU  11  20.507  -8.274   2.589
   73    H    VAL  12           H        VAL  12  20.374  -3.552  -0.544
   74    HA   VAL  12           HA       VAL  12  21.363  -3.789  -3.311
   75    HB   VAL  12           HB       VAL  12  20.173  -1.877  -4.010
   76   1HG1  VAL  12          1HG1      VAL  12  18.076  -3.102  -2.289
   77   2HG1  VAL  12          2HG1      VAL  12  18.898  -4.099  -3.491
   78   3HG1  VAL  12          3HG1      VAL  12  18.020  -2.654  -3.994
   79   1HG2  VAL  12          1HG2      VAL  12  19.756  -0.157  -2.671
   80   2HG2  VAL  12          2HG2      VAL  12  20.336  -1.102  -1.299
   81   3HG2  VAL  12          3HG2      VAL  12  18.627  -1.134  -1.730
   82    H    GLN  13           H        GLN  13  22.100  -1.332  -3.909
   83    HA   GLN  13           HA       GLN  13  24.037  -0.561  -1.830
   84   1HB   GLN  13          2HB       GLN  13  24.689   0.053  -4.650
   85   2HB   GLN  13          1HB       GLN  13  25.739  -0.475  -3.344
   86   1HG   GLN  13          2HG       GLN  13  25.814  -2.283  -4.745
   87   2HG   GLN  13          1HG       GLN  13  24.513  -2.752  -3.651
   88   1HE2  GLN  13          1HE2      GLN  13  24.408  -0.420  -6.292
   89   2HE2  GLN  13          2HE2      GLN  13  23.242  -1.271  -7.240
   90    HA   PRO  14           HA       PRO  14  22.334   3.509  -1.730
   91   1HB   PRO  14          2HB       PRO  14  25.154   4.423  -2.129
   92   2HB   PRO  14          1HB       PRO  14  23.965   4.938  -0.926
   93   1HG   PRO  14          2HG       PRO  14  25.922   3.282  -0.241
   94   2HG   PRO  14          1HG       PRO  14  24.281   3.046   0.389
   95   1HD   PRO  14          2HD       PRO  14  25.732   1.536  -1.735
   96   2HD   PRO  14          1HD       PRO  14  24.560   0.955  -0.535
   97    H    GLY  15           H        GLY  15  21.264   3.369  -3.749
   98   1HA   GLY  15          2HA       GLY  15  20.992   4.979  -5.599
   99   2HA   GLY  15          1HA       GLY  15  22.696   4.726  -5.950
  100    H    GLY  16           H        GLY  16  20.788   1.988  -5.031
  101   1HA   GLY  16          2HA       GLY  16  21.121   0.898  -7.723
  102   2HA   GLY  16          1HA       GLY  16  20.738  -0.018  -6.276
  103    H    SER  17           H        SER  17  18.885  -1.032  -6.752
  104    HA   SER  17           HA       SER  17  16.470   0.461  -6.919
  105   1HB   SER  17          2HB       SER  17  16.063  -0.984  -9.233
  106   2HB   SER  17          1HB       SER  17  16.418   0.742  -9.157
  107    HG   SER  17           HG       SER  17  17.890  -0.213 -10.532
  108    H    LEU  18           H        LEU  18  14.885  -0.710  -6.031
  109    HA   LEU  18           HA       LEU  18  15.128  -3.647  -6.055
  110   1HB   LEU  18          2HB       LEU  18  15.268  -1.916  -3.806
  111   2HB   LEU  18          1HB       LEU  18  13.747  -2.780  -3.709
  112    HG   LEU  18           HG       LEU  18  16.521  -3.958  -3.778
  113   1HD1  LEU  18          1HD1      LEU  18  16.328  -4.116  -1.573
  114   2HD1  LEU  18          2HD1      LEU  18  14.736  -4.863  -1.708
  115   3HD1  LEU  18          3HD1      LEU  18  14.886  -3.106  -1.690
  116   1HD2  LEU  18          1HD2      LEU  18  15.456  -6.156  -3.676
  117   2HD2  LEU  18          2HD2      LEU  18  15.071  -5.323  -5.181
  118   3HD2  LEU  18          3HD2      LEU  18  13.876  -5.404  -3.885
  119    H    ARG  19           H        ARG  19  13.105  -4.792  -5.742
  120    HA   ARG  19           HA       ARG  19  10.666  -3.258  -6.167
  121   1HB   ARG  19          2HB       ARG  19  11.649  -3.910  -8.416
  122   2HB   ARG  19          1HB       ARG  19  11.348  -5.583  -7.965
  123   1HG   ARG  19          2HG       ARG  19   8.970  -4.067  -7.541
  124   2HG   ARG  19          1HG       ARG  19   9.579  -3.755  -9.170
  125   1HD   ARG  19          2HD       ARG  19   9.838  -6.526  -8.705
  126   2HD   ARG  19          1HD       ARG  19   8.228  -6.064  -8.158
  127    HE   ARG  19           HE       ARG  19   7.630  -5.698 -10.337
  128   1HH1  ARG  19          1HH1      ARG  19  11.105  -5.872 -10.127
  129   2HH1  ARG  19          2HH1      ARG  19  11.337  -5.864 -11.843
  130   1HH2  ARG  19          1HH2      ARG  19   7.926  -5.686 -12.596
  131   2HH2  ARG  19          2HH2      ARG  19   9.530  -5.758 -13.248
  132    H    VAL  20           H        VAL  20   9.615  -3.887  -4.379
  133    HA   VAL  20           HA       VAL  20   9.536  -6.761  -3.757
  134    HB   VAL  20           HB       VAL  20   9.099  -6.230  -1.485
  135   1HG1  VAL  20          1HG1      VAL  20  11.437  -5.896  -2.366
  136   2HG1  VAL  20          2HG1      VAL  20  11.066  -5.091  -0.841
  137   3HG1  VAL  20          3HG1      VAL  20  11.107  -4.164  -2.341
  138   1HG2  VAL  20          1HG2      VAL  20   8.988  -3.292  -2.099
  139   2HG2  VAL  20          2HG2      VAL  20   8.489  -4.132  -0.631
  140   3HG2  VAL  20          3HG2      VAL  20   7.538  -4.296  -2.107
  141    H    SER  21           H        SER  21   7.504  -7.693  -3.088
  142    HA   SER  21           HA       SER  21   5.136  -6.185  -3.966
  143   1HB   SER  21          2HB       SER  21   4.279  -8.292  -5.017
  144   2HB   SER  21          1HB       SER  21   5.701  -7.621  -5.815
  145    HG   SER  21           HG       SER  21   6.246  -9.691  -5.580
  146    H    CYS  22           H        CYS  22   3.077  -7.211  -3.272
  147    HA   CYS  22           HA       CYS  22   3.327  -8.761  -0.793
  148   1HB   CYS  22          2HB       CYS  22   3.086  -6.530   0.015
  149   2HB   CYS  22          1HB       CYS  22   1.827  -6.168  -1.159
  150    H    ALA  23           H        ALA  23   2.192 -10.558  -1.035
  151    HA   ALA  23           HA       ALA  23   0.017 -10.659  -2.955
  152   1HB   ALA  23          1HB       ALA  23   1.347 -12.812  -1.319
  153   2HB   ALA  23          2HB       ALA  23   1.578 -12.473  -3.035
  154   3HB   ALA  23          3HB       ALA  23   0.033 -13.098  -2.459
  155    H    ALA  24           H        ALA  24  -1.973 -10.145  -2.348
  156    HA   ALA  24           HA       ALA  24  -2.810 -10.735   0.415
  157   1HB   ALA  24          1HB       ALA  24  -2.807  -8.346  -0.121
  158   2HB   ALA  24          2HB       ALA  24  -4.442  -8.936   0.186
  159   3HB   ALA  24          3HB       ALA  24  -3.905  -8.648  -1.470
  160    H    SER  25           H        SER  25  -5.271 -11.045   0.576
  161    HA   SER  25           HA       SER  25  -6.720 -12.039  -1.639
  162   1HB   SER  25          2HB       SER  25  -4.998 -13.873  -1.329
  163   2HB   SER  25          1HB       SER  25  -5.750 -14.207   0.231
  164    HG   SER  25           HG       SER  25  -7.474 -15.009  -0.747
  165    H    GLY  26           H        GLY  26  -8.663 -11.321  -1.030
  166   1HA   GLY  26          2HA       GLY  26 -10.457 -12.312   0.588
  167   2HA   GLY  26          1HA       GLY  26  -9.437 -11.541   1.791
  168    H    PHE  27           H        PHE  27  -9.574  -9.876  -1.191
  169    HA   PHE  27           HA       PHE  27 -11.949  -8.385  -0.724
  170   1HB   PHE  27          2HB       PHE  27 -11.146  -6.372   0.151
  171   2HB   PHE  27          1HB       PHE  27 -10.311  -7.593   1.099
  172    HD1  PHE  27           1HD      PHE  27  -8.086  -8.390  -0.595
  173    HD2  PHE  27           2HD      PHE  27  -9.792  -4.538   0.014
  174    HE1  PHE  27           1HE      PHE  27  -5.936  -7.347  -1.177
  175    HE2  PHE  27           2HE      PHE  27  -7.647  -3.490  -0.566
  176    HZ   PHE  27           HZ       PHE  27  -5.714  -4.894  -1.164
  177    H    THR  28           H        THR  28  -9.224  -9.205  -2.514
  178    HA   THR  28           HA       THR  28  -8.630  -8.885  -4.685
  179    HB   THR  28           HB       THR  28 -11.303  -7.500  -4.972
  180    HG1  THR  28           1HG      THR  28 -10.894 -10.093  -5.905
  181   1HG2  THR  28          1HG2      THR  28 -11.071  -8.009  -7.348
  182   2HG2  THR  28          2HG2      THR  28  -9.490  -8.733  -7.050
  183   3HG2  THR  28          3HG2      THR  28  -9.731  -7.004  -6.795
  184    H    PHE  29           H        PHE  29  -7.510  -7.398  -5.905
  185    HA   PHE  29           HA       PHE  29  -7.122  -4.805  -4.648
  186   1HB   PHE  29          2HB       PHE  29  -5.574  -6.557  -6.445
  187   2HB   PHE  29          1HB       PHE  29  -5.405  -4.835  -6.766
  188    HD1  PHE  29           1HD      PHE  29  -5.003  -7.445  -4.185
  189    HD2  PHE  29           2HD      PHE  29  -4.127  -3.451  -5.356
  190    HE1  PHE  29           1HE      PHE  29  -3.377  -7.267  -2.346
  191    HE2  PHE  29           2HE      PHE  29  -2.500  -3.265  -3.522
  192    HZ   PHE  29           HZ       PHE  29  -2.122  -5.175  -2.014
  193    H    SER  30           H        SER  30  -6.541  -3.027  -6.423
  194    HA   SER  30           HA       SER  30  -7.382  -1.504  -7.883
  195   1HB   SER  30          2HB       SER  30  -7.729  -2.263 -10.015
  196   2HB   SER  30          1HB       SER  30  -7.032  -3.728  -9.326
  197    HG   SER  30           HG       SER  30  -9.015  -4.054 -10.512
  198    H    SER  31           H        SER  31  -9.144  -2.815  -5.683
  199    HA   SER  31           HA       SER  31 -11.714  -1.767  -6.676
  200   1HB   SER  31          2HB       SER  31 -11.241  -3.841  -4.520
  201   2HB   SER  31          1HB       SER  31 -12.816  -3.244  -5.043
  202    HG   SER  31           HG       SER  31 -10.935  -4.715  -6.573
  203    H    TYR  32           H        TYR  32  -9.280  -1.612  -4.231
  204    HA   TYR  32           HA       TYR  32 -10.729   0.609  -2.961
  205   1HB   TYR  32          2HB       TYR  32  -9.106  -1.501  -1.520
  206   2HB   TYR  32          1HB       TYR  32  -9.846  -0.089  -0.773
  207    HD1  TYR  32           1HD      TYR  32 -12.371   0.111  -0.799
  208    HD2  TYR  32           2HD      TYR  32 -10.342  -3.484  -1.831
  209    HE1  TYR  32           1HE      TYR  32 -14.441  -1.159  -0.418
  210    HE2  TYR  32           2HE      TYR  32 -12.406  -4.765  -1.450
  211    HH   TYR  32           HH       TYR  32 -15.196  -3.360   0.029
  212    H    HIS  33           H        HIS  33  -9.004   1.665  -1.326
  213    HA   HIS  33           HA       HIS  33  -6.753   2.420  -3.040
  214   1HB   HIS  33          2HB       HIS  33  -7.032   3.944  -0.575
  215   2HB   HIS  33          1HB       HIS  33  -7.009   4.509  -2.241
  216    HD1  HIS  33           1HD      HIS  33  -9.406   3.209   0.371
  217    HD2  HIS  33           2HD      HIS  33  -9.460   5.209  -3.271
  218    HE1  HIS  33           1HE      HIS  33 -11.787   3.948   0.046
  219    HE2  HIS  33           2HE      HIS  33 -11.770   5.256  -2.107
  220    H    MET  34           H        MET  34  -5.301   0.750  -2.662
  221    HA   MET  34           HA       MET  34  -4.614   0.009   0.046
  222   1HB   MET  34          2HB       MET  34  -3.750  -0.899  -2.675
  223   2HB   MET  34          1HB       MET  34  -2.807  -1.342  -1.257
  224   1HG   MET  34          2HG       MET  34  -5.751  -1.832  -1.311
  225   2HG   MET  34          1HG       MET  34  -4.651  -2.936  -2.133
  226   1HE   MET  34          1HE       MET  34  -2.375  -3.463  -0.938
  227   2HE   MET  34          2HE       MET  34  -2.356  -4.166   0.678
  228   3HE   MET  34          3HE       MET  34  -2.116  -2.433   0.469
  229    H    ALA  35           H        ALA  35  -2.003  -0.295   0.256
  230    HA   ALA  35           HA       ALA  35  -0.505   1.933  -0.749
  231   1HB   ALA  35          1HB       ALA  35  -0.963   3.455   0.782
  232   2HB   ALA  35          2HB       ALA  35  -0.362   2.371   2.037
  233   3HB   ALA  35          3HB       ALA  35  -2.066   2.337   1.584
  234    H    TRP  36           H        TRP  36   1.669   1.990  -0.083
  235    HA   TRP  36           HA       TRP  36   2.649  -0.557   1.010
  236   1HB   TRP  36          2HB       TRP  36   3.572   1.241  -1.127
  237   2HB   TRP  36          1HB       TRP  36   4.850   0.691  -0.048
  238    HD1  TRP  36           HD       TRP  36   2.897  -0.377  -3.010
  239    HE1  TRP  36           1HE      TRP  36   3.385  -2.847  -3.567
  240    HE3  TRP  36           3HE      TRP  36   5.341  -1.703   1.278
  241    HZ2  TRP  36           2HZ      TRP  36   4.645  -5.060  -2.342
  242    HZ3  TRP  36           3HZ      TRP  36   6.155  -4.013   1.509
  243    HH2  TRP  36           HH       TRP  36   5.813  -5.656  -0.266
  244    H    VAL  37           H        VAL  37   3.270  -0.475   3.032
  245    HA   VAL  37           HA       VAL  37   4.067   2.060   4.266
  246    HB   VAL  37           HB       VAL  37   3.782  -0.229   6.063
  247   1HG1  VAL  37          1HG1      VAL  37   2.789   1.256   7.423
  248   2HG1  VAL  37          2HG1      VAL  37   1.961   2.090   6.109
  249   3HG1  VAL  37          3HG1      VAL  37   3.678   2.377   6.395
  250   1HG2  VAL  37          1HG2      VAL  37   1.374  -0.499   5.812
  251   2HG2  VAL  37          2HG2      VAL  37   2.201  -0.952   4.320
  252   3HG2  VAL  37          3HG2      VAL  37   1.382   0.612   4.439
  253    H    ARG  38           H        ARG  38   5.769   1.923   5.986
  254    HA   ARG  38           HA       ARG  38   7.717  -0.188   5.785
  255   1HB   ARG  38          2HB       ARG  38   8.741   0.784   4.008
  256   2HB   ARG  38          1HB       ARG  38   8.044   2.363   4.335
  257   1HG   ARG  38          2HG       ARG  38   9.763   2.158   6.405
  258   2HG   ARG  38          1HG       ARG  38  10.615   1.216   5.179
  259   1HD   ARG  38          2HD       ARG  38  11.359   3.461   4.969
  260   2HD   ARG  38          1HD       ARG  38  10.282   3.147   3.610
  261    HE   ARG  38           HE       ARG  38   8.775   4.250   5.699
  262   1HH1  ARG  38          1HH1      ARG  38  11.286   5.151   3.451
  263   2HH1  ARG  38          2HH1      ARG  38  10.845   6.826   3.432
  264   1HH2  ARG  38          1HH2      ARG  38   8.193   6.453   5.677
  265   2HH2  ARG  38          2HH2      ARG  38   9.086   7.566   4.698
  266    H    GLN  39           H        GLN  39   8.764  -0.409   7.672
  267    HA   GLN  39           HA       GLN  39   8.685   1.853   9.557
  268   1HB   GLN  39          2HB       GLN  39   7.287   0.193  10.470
  269   2HB   GLN  39          1HB       GLN  39   8.379  -1.105  10.005
  270   1HG   GLN  39          2HG       GLN  39  10.003  -0.301  11.672
  271   2HG   GLN  39          1HG       GLN  39   8.855   0.945  12.161
  272   1HE2  GLN  39          1HE2      GLN  39   6.848   0.268  13.089
  273   2HE2  GLN  39          2HE2      GLN  39   6.746  -1.234  13.936
  274    H    ALA  40           H        ALA  40  10.607   2.720   9.887
  275    HA   ALA  40           HA       ALA  40  13.038   1.346   9.210
  276   1HB   ALA  40          1HB       ALA  40  13.847   3.601  10.509
  277   2HB   ALA  40          2HB       ALA  40  12.254   4.076   9.923
  278   3HB   ALA  40          3HB       ALA  40  13.476   3.504   8.787
  279    HA   PRO  41           HA       PRO  41  14.248  -0.577  12.987
  280   1HB   PRO  41          2HB       PRO  41  16.757   1.030  12.793
  281   2HB   PRO  41          1HB       PRO  41  16.550  -0.709  13.033
  282   1HG   PRO  41          2HG       PRO  41  17.270   0.249  10.659
  283   2HG   PRO  41          1HG       PRO  41  16.131  -1.103  10.785
  284   1HD   PRO  41          2HD       PRO  41  15.612   1.757  10.131
  285   2HD   PRO  41          1HD       PRO  41  14.800   0.297   9.534
  286    H    GLY  42           H        GLY  42  14.612   2.898  12.659
  287   1HA   GLY  42          2HA       GLY  42  14.162   3.154  15.570
  288   2HA   GLY  42          1HA       GLY  42  15.190   4.259  14.669
  289    H    LYS  43           H        LYS  43  12.033   2.931  13.779
  290    HA   LYS  43           HA       LYS  43  10.807   5.564  14.124
  291   1HB   LYS  43          2HB       LYS  43  11.741   4.868  11.673
  292   2HB   LYS  43          1HB       LYS  43  10.116   4.202  11.593
  293   1HG   LYS  43          2HG       LYS  43   9.246   6.209  11.245
  294   2HG   LYS  43          1HG       LYS  43  10.053   6.864  12.672
  295   1HD   LYS  43          2HD       LYS  43  11.986   6.465  10.608
  296   2HD   LYS  43          1HD       LYS  43  10.624   7.375   9.951
  297   1HE   LYS  43          2HE       LYS  43  10.955   8.632  12.314
  298   2HE   LYS  43          1HE       LYS  43  12.616   8.136  11.987
  299   1HZ   LYS  43          1HZ       LYS  43  11.087   9.416   9.837
  300   2HZ   LYS  43          2HZ       LYS  43  12.748   9.464  10.153
  301   3HZ   LYS  43          3HZ       LYS  43  11.685  10.389  11.086
  302    H    GLY  44           H        GLY  44   8.363   5.158  13.078
  303   1HA   GLY  44          2HA       GLY  44   7.380   2.686  14.360
  304   2HA   GLY  44          1HA       GLY  44   6.607   4.237  14.652
  305    H    LEU  45           H        LEU  45   7.766   2.533  11.746
  306    HA   LEU  45           HA       LEU  45   6.762   1.997   9.786
  307   1HB   LEU  45          2HB       LEU  45   5.186   0.711  10.972
  308   2HB   LEU  45          1HB       LEU  45   4.342   2.123  11.566
  309    HG   LEU  45           HG       LEU  45   4.364   1.456   8.618
  310   1HD1  LEU  45          1HD1      LEU  45   3.343  -0.220  10.630
  311   2HD1  LEU  45          2HD1      LEU  45   3.051  -0.303   8.892
  312   3HD1  LEU  45          3HD1      LEU  45   1.958   0.617   9.927
  313   1HD2  LEU  45          1HD2      LEU  45   2.745   3.167  10.475
  314   2HD2  LEU  45          2HD2      LEU  45   2.022   2.544   8.991
  315   3HD2  LEU  45          3HD2      LEU  45   3.457   3.568   8.911
  316    H    GLU  46           H        GLU  46   5.721   2.894   7.995
  317    HA   GLU  46           HA       GLU  46   4.579   5.552   8.217
  318   1HB   GLU  46          2HB       GLU  46   7.086   5.844   8.017
  319   2HB   GLU  46          1HB       GLU  46   6.962   5.119   6.420
  320   1HG   GLU  46          2HG       GLU  46   6.714   7.218   5.712
  321   2HG   GLU  46          1HG       GLU  46   5.050   7.031   6.273
  322    H    TRP  47           H        TRP  47   2.861   5.566   6.960
  323    HA   TRP  47           HA       TRP  47   2.063   3.547   5.265
  324   1HB   TRP  47          2HB       TRP  47   0.263   4.862   5.650
  325   2HB   TRP  47          1HB       TRP  47   1.233   6.326   5.784
  326    HD1  TRP  47           HD       TRP  47   0.145   3.975   2.903
  327    HE1  TRP  47           1HE      TRP  47  -0.481   5.441   0.889
  328    HE3  TRP  47           3HE      TRP  47   1.099   8.558   4.923
  329    HZ2  TRP  47           2HZ      TRP  47  -0.576   8.196   0.244
  330    HZ3  TRP  47           3HZ      TRP  47   0.719  10.564   3.548
  331    HH2  TRP  47           HH       TRP  47  -0.102  10.385   1.255
  332    H    VAL  48           H        VAL  48   4.276   6.123   4.640
  333    HA   VAL  48           HA       VAL  48   5.591   6.658   2.881
  334    HB   VAL  48           HB       VAL  48   5.081   3.753   2.355
  335   1HG1  VAL  48          1HG1      VAL  48   5.814   5.607   0.328
  336   2HG1  VAL  48          2HG1      VAL  48   5.729   3.848   0.228
  337   3HG1  VAL  48          3HG1      VAL  48   7.230   4.633   0.721
  338   1HG2  VAL  48          1HG2      VAL  48   7.150   5.418   3.594
  339   2HG2  VAL  48          2HG2      VAL  48   7.766   4.131   2.555
  340   3HG2  VAL  48          3HG2      VAL  48   6.702   3.741   3.908
  341    H    SER  49           H        SER  49   3.340   4.498   1.075
  342    HA   SER  49           HA       SER  49   2.345   6.890  -0.321
  343   1HB   SER  49          2HB       SER  49   2.825   5.902  -2.525
  344   2HB   SER  49          1HB       SER  49   4.297   6.178  -1.589
  345    HG   SER  49           HG       SER  49   4.623   4.155  -2.124
  346    H    THR  50           H        THR  50   0.455   6.626  -1.560
  347    HA   THR  50           HA       THR  50  -1.026   4.109  -1.193
  348    HB   THR  50           HB       THR  50  -1.748   6.768  -0.160
  349    HG1  THR  50           1HG      THR  50  -2.748   4.146   0.332
  350   1HG2  THR  50          1HG2      THR  50  -4.157   6.514  -0.556
  351   2HG2  THR  50          2HG2      THR  50  -3.836   5.133  -1.606
  352   3HG2  THR  50          3HG2      THR  50  -3.274   6.740  -2.065
  353    H    ILE  51           H        ILE  51  -2.411   3.559  -2.871
  354    HA   ILE  51           HA       ILE  51  -2.413   5.365  -5.205
  355    HB   ILE  51           HB       ILE  51  -0.978   3.361  -5.556
  356   1HG1  ILE  51          2HG1      ILE  51  -3.245   2.893  -7.406
  357   2HG1  ILE  51          1HG1      ILE  51  -2.668   4.557  -7.302
  358   1HG2  ILE  51          1HG2      ILE  51  -1.636   1.337  -4.939
  359   2HG2  ILE  51          2HG2      ILE  51  -3.030   1.433  -6.015
  360   3HG2  ILE  51          3HG2      ILE  51  -3.153   2.025  -4.358
  361   1HD1  ILE  51          1HD1      ILE  51  -1.439   3.660  -9.044
  362   2HD1  ILE  51          2HD1      ILE  51  -1.217   2.114  -8.225
  363   3HD1  ILE  51          3HD1      ILE  51  -0.336   3.538  -7.672
  364    H    ASN  52           H        ASN  52  -4.296   5.395  -6.489
  365    HA   ASN  52           HA       ASN  52  -6.703   4.572  -5.038
  366   1HB   ASN  52          2HB       ASN  52  -7.377   6.072  -7.352
  367   2HB   ASN  52          1HB       ASN  52  -7.481   6.570  -5.666
  368   1HD2  ASN  52          1HD2      ASN  52  -5.830   7.796  -4.771
  369   2HD2  ASN  52          2HD2      ASN  52  -4.662   8.614  -5.747
  370    HA   PRO  53           HA       PRO  53  -7.719   1.313  -7.824
  371   1HB   PRO  53          2HB       PRO  53 -10.432   1.549  -7.991
  372   2HB   PRO  53          1HB       PRO  53  -9.597   0.880  -6.585
  373   1HG   PRO  53          2HG       PRO  53 -10.675   3.642  -7.011
  374   2HG   PRO  53          1HG       PRO  53 -10.785   2.608  -5.573
  375   1HD   PRO  53          2HD       PRO  53  -8.994   4.609  -5.751
  376   2HD   PRO  53          1HD       PRO  53  -8.622   3.093  -4.906
  377    H    GLY  54           H        GLY  54  -7.701   1.049  -9.975
  378   1HA   GLY  54          2HA       GLY  54  -8.423   1.421 -12.191
  379   2HA   GLY  54          1HA       GLY  54  -9.101   2.962 -11.688
  380    H    ASP  55           H        ASP  55  -5.915   2.249 -10.620
  381    HA   ASP  55           HA       ASP  55  -3.924   3.287 -11.007
  382   1HB   ASP  55          2HB       ASP  55  -4.914   2.338 -13.605
  383   2HB   ASP  55          1HB       ASP  55  -3.716   3.623 -13.726
  384    H    GLY  56           H        GLY  56  -4.931   5.216  -9.993
  385   1HA   GLY  56          2HA       GLY  56  -5.337   7.395 -11.937
  386   2HA   GLY  56          1HA       GLY  56  -6.007   7.369 -10.314
  387    H    SER  57           H        SER  57  -5.136   9.275  -9.613
  388    HA   SER  57           HA       SER  57  -2.455  10.063 -10.005
  389   1HB   SER  57          2HB       SER  57  -4.211  10.943  -7.710
  390   2HB   SER  57          1HB       SER  57  -2.907  11.843  -8.485
  391    HG   SER  57           HG       SER  57  -5.034  11.018 -10.086
  392    H    THR  58           H        THR  58  -1.509  10.789  -7.496
  393    HA   THR  58           HA       THR  58  -1.416   8.464  -5.796
  394    HB   THR  58           HB       THR  58   1.326   8.947  -6.311
  395    HG1  THR  58           1HG      THR  58   0.923   9.664  -8.366
  396   1HG2  THR  58          1HG2      THR  58  -0.351   6.587  -7.157
  397   2HG2  THR  58          2HG2      THR  58   0.228   6.855  -5.512
  398   3HG2  THR  58          3HG2      THR  58   1.380   6.602  -6.823
  399    H    TYR  59           H        TYR  59  -0.718   8.907  -3.769
  400    HA   TYR  59           HA       TYR  59   0.427  11.565  -3.248
  401   1HB   TYR  59          2HB       TYR  59  -1.388  10.512  -1.169
  402   2HB   TYR  59          1HB       TYR  59  -1.187  12.157  -1.762
  403    HD1  TYR  59           1HD      TYR  59  -2.211  12.706  -4.061
  404    HD2  TYR  59           2HD      TYR  59  -3.256   9.263  -1.790
  405    HE1  TYR  59           1HE      TYR  59  -4.298  12.501  -5.342
  406    HE2  TYR  59           2HE      TYR  59  -5.346   9.050  -3.066
  407    HH   TYR  59           HH       TYR  59  -5.916  10.463  -5.915
  408    H    TYR  60           H        TYR  60   2.125  11.556  -1.896
  409    HA   TYR  60           HA       TYR  60   2.726   9.033  -0.496
  410   1HB   TYR  60          2HB       TYR  60   4.561  11.045  -1.796
  411   2HB   TYR  60          1HB       TYR  60   5.140   9.809  -0.686
  412    HD1  TYR  60           1HD      TYR  60   2.799   9.864  -3.615
  413    HD2  TYR  60           2HD      TYR  60   6.177   8.066  -1.757
  414    HE1  TYR  60           1HE      TYR  60   2.977   8.281  -5.487
  415    HE2  TYR  60           2HE      TYR  60   6.365   6.478  -3.623
  416    HH   TYR  60           HH       TYR  60   5.640   6.499  -6.138
  417    H    ALA  61           H        ALA  61   4.543   9.552   1.239
  418    HA   ALA  61           HA       ALA  61   3.271  11.255   3.180
  419   1HB   ALA  61          1HB       ALA  61   5.125  10.471   4.664
  420   2HB   ALA  61          2HB       ALA  61   5.759   9.554   3.299
  421   3HB   ALA  61          3HB       ALA  61   4.167   9.173   3.955
  422    H    ASP  62           H        ASP  62   4.854  12.185   0.657
  423    HA   ASP  62           HA       ASP  62   5.929  14.096   0.064
  424   1HB   ASP  62          2HB       ASP  62   4.735  14.786   2.447
  425   2HB   ASP  62          1HB       ASP  62   6.426  15.183   2.728
  426    H    SER  63           H        SER  63   7.179  11.850   2.245
  427    HA   SER  63           HA       SER  63   9.908  12.887   1.890
  428   1HB   SER  63          2HB       SER  63  10.273  10.998   3.751
  429   2HB   SER  63          1HB       SER  63   9.798  12.644   4.166
  430    HG   SER  63           HG       SER  63   7.692  11.971   4.377
  431    H    VAL  64           H        VAL  64   7.833  10.832   0.503
  432    HA   VAL  64           HA       VAL  64   9.994   9.076  -0.422
  433    HB   VAL  64           HB       VAL  64   7.993   7.333  -0.620
  434   1HG1  VAL  64          1HG1      VAL  64   9.707   6.400   0.489
  435   2HG1  VAL  64          2HG1      VAL  64   8.750   6.776   1.923
  436   3HG1  VAL  64          3HG1      VAL  64  10.041   7.865   1.413
  437   1HG2  VAL  64          1HG2      VAL  64   7.300   8.738   1.948
  438   2HG2  VAL  64          2HG2      VAL  64   6.449   7.404   1.169
  439   3HG2  VAL  64          3HG2      VAL  64   6.427   9.010   0.440
  440    H    LYS  65           H        LYS  65   7.713  11.306  -1.199
  441    HA   LYS  65           HA       LYS  65   6.320  10.447  -3.394
  442   1HB   LYS  65          2HB       LYS  65   6.214  12.732  -2.399
  443   2HB   LYS  65          1HB       LYS  65   7.734  13.111  -3.195
  444   1HG   LYS  65          2HG       LYS  65   5.950  14.020  -4.492
  445   2HG   LYS  65          1HG       LYS  65   6.645  12.663  -5.378
  446   1HD   LYS  65          2HD       LYS  65   4.738  11.477  -5.283
  447   2HD   LYS  65          1HD       LYS  65   4.433  11.924  -3.604
  448   1HE   LYS  65          2HE       LYS  65   2.857  12.742  -5.558
  449   2HE   LYS  65          1HE       LYS  65   3.217  13.773  -4.174
  450   1HZ   LYS  65          1HZ       LYS  65   4.521  15.142  -5.416
  451   2HZ   LYS  65          2HZ       LYS  65   3.461  14.633  -6.631
  452   3HZ   LYS  65          3HZ       LYS  65   4.993  13.929  -6.497
  453    H    GLY  66           H        GLY  66   9.569  11.921  -3.525
  454   1HA   GLY  66          2HA       GLY  66   9.931  10.749  -6.196
  455   2HA   GLY  66          1HA       GLY  66  10.917  12.026  -5.490
  456    H    ARG  67           H        ARG  67   9.968   9.023  -3.930
  457    HA   ARG  67           HA       ARG  67  12.792   8.183  -3.933
  458   1HB   ARG  67          2HB       ARG  67  11.988   9.010  -1.728
  459   2HB   ARG  67          1HB       ARG  67  10.767   7.749  -1.733
  460   1HG   ARG  67          2HG       ARG  67  12.343   6.715  -0.482
  461   2HG   ARG  67          1HG       ARG  67  12.894   6.212  -2.083
  462   1HD   ARG  67          2HD       ARG  67  14.787   6.986  -0.817
  463   2HD   ARG  67          1HD       ARG  67  14.447   8.140  -2.108
  464    HE   ARG  67           HE       ARG  67  13.934   8.545   0.754
  465   1HH1  ARG  67          1HH1      ARG  67  14.094   9.779  -2.500
  466   2HH1  ARG  67          2HH1      ARG  67  14.009  11.439  -2.013
  467   1HH2  ARG  67          1HH2      ARG  67  13.821  10.728   1.407
  468   2HH2  ARG  67          2HH2      ARG  67  13.855  11.978   0.209
  469    H    PHE  68           H        PHE  68   9.614   6.789  -3.102
  470    HA   PHE  68           HA       PHE  68  10.400   4.363  -4.572
  471   1HB   PHE  68          2HB       PHE  68   8.294   4.648  -2.423
  472   2HB   PHE  68          1HB       PHE  68   8.825   3.148  -3.169
  473    HD1  PHE  68           1HD      PHE  68   8.771   4.019  -0.190
  474    HD2  PHE  68           2HD      PHE  68  11.823   3.901  -3.153
  475    HE1  PHE  68           1HE      PHE  68  10.469   3.748   1.572
  476    HE2  PHE  68           2HE      PHE  68  13.523   3.626  -1.396
  477    HZ   PHE  68           HZ       PHE  68  12.843   3.549   0.966
  478    H    THR  69           H        THR  69   8.584   3.128  -5.535
  479    HA   THR  69           HA       THR  69   6.511   4.913  -6.636
  480    HB   THR  69           HB       THR  69   8.067   2.768  -8.097
  481    HG1  THR  69           1HG      THR  69   8.094   5.544  -8.033
  482   1HG2  THR  69          1HG2      THR  69   6.519   3.951  -9.992
  483   2HG2  THR  69          2HG2      THR  69   5.416   3.938  -8.616
  484   3HG2  THR  69          3HG2      THR  69   6.121   2.429  -9.194
  485    H    ILE  70           H        ILE  70   4.581   4.284  -5.996
  486    HA   ILE  70           HA       ILE  70   4.157   1.483  -5.256
  487    HB   ILE  70           HB       ILE  70   3.661   3.111  -3.528
  488   1HG1  ILE  70          2HG1      ILE  70   1.690   1.269  -4.626
  489   2HG1  ILE  70          1HG1      ILE  70   2.186   1.519  -2.958
  490   1HG2  ILE  70          1HG2      ILE  70   3.183   5.035  -4.917
  491   2HG2  ILE  70          2HG2      ILE  70   1.861   4.756  -3.783
  492   3HG2  ILE  70          3HG2      ILE  70   1.685   4.289  -5.474
  493   1HD1  ILE  70          1HD1      ILE  70   0.597   3.260  -2.667
  494   2HD1  ILE  70          2HD1      ILE  70  -0.232   1.888  -3.402
  495   3HD1  ILE  70          3HD1      ILE  70   0.217   3.279  -4.390
  496    H    SER  71           H        SER  71   3.365   0.271  -6.824
  497    HA   SER  71           HA       SER  71   1.025   1.210  -8.308
  498   1HB   SER  71          2HB       SER  71   2.297   1.529 -10.146
  499   2HB   SER  71          1HB       SER  71   3.674   0.681  -9.443
  500    HG   SER  71           HG       SER  71   1.412  -0.487 -10.696
  501    H    ARG  72           H        ARG  72  -0.048  -0.620  -9.484
  502    HA   ARG  72           HA       ARG  72   0.533  -3.277  -8.468
  503   1HB   ARG  72          2HB       ARG  72  -1.979  -3.452  -7.802
  504   2HB   ARG  72          1HB       ARG  72  -0.834  -2.732  -6.677
  505   1HG   ARG  72          2HG       ARG  72  -1.521  -0.504  -7.391
  506   2HG   ARG  72          1HG       ARG  72  -2.657  -1.218  -8.537
  507   1HD   ARG  72          2HD       ARG  72  -3.401  -2.462  -6.256
  508   2HD   ARG  72          1HD       ARG  72  -2.844  -0.917  -5.614
  509    HE   ARG  72           HE       ARG  72  -4.581  -0.573  -7.846
  510   1HH1  ARG  72          1HH1      ARG  72  -4.526  -1.267  -4.430
  511   2HH1  ARG  72          2HH1      ARG  72  -6.112  -0.631  -4.146
  512   1HH2  ARG  72          1HH2      ARG  72  -6.664   0.267  -7.481
  513   2HH2  ARG  72          2HH2      ARG  72  -7.328   0.241  -5.881
  514    H    ASP  73           H        ASP  73  -1.254  -4.840  -9.298
  515    HA   ASP  73           HA       ASP  73  -1.467  -4.378 -12.152
  516   1HB   ASP  73          2HB       ASP  73  -0.940  -6.616 -10.681
  517   2HB   ASP  73          1HB       ASP  73  -2.654  -6.831 -11.024
  518    H    ASN  74           H        ASN  74  -3.626  -5.381 -13.115
  519    HA   ASN  74           HA       ASN  74  -5.863  -4.100 -11.685
  520   1HB   ASN  74          2HB       ASN  74  -6.733  -4.046 -14.234
  521   2HB   ASN  74          1HB       ASN  74  -5.814  -2.733 -13.504
  522   1HD2  ASN  74          1HD2      ASN  74  -5.524  -5.652 -15.450
  523   2HD2  ASN  74          2HD2      ASN  74  -4.105  -5.158 -16.304
  524    H    ALA  75           H        ALA  75  -5.206  -6.768 -11.222
  525    HA   ALA  75           HA       ALA  75  -7.686  -8.032 -11.793
  526   1HB   ALA  75          1HB       ALA  75  -6.402  -8.269 -13.972
  527   2HB   ALA  75          2HB       ALA  75  -7.054  -9.749 -13.269
  528   3HB   ALA  75          3HB       ALA  75  -5.338  -9.374 -13.102
  529    H    LYS  76           H        LYS  76  -4.309  -9.081 -11.282
  530    HA   LYS  76           HA       LYS  76  -5.038 -11.065  -9.383
  531   1HB   LYS  76          2HB       LYS  76  -2.568 -10.054 -10.591
  532   2HB   LYS  76          1HB       LYS  76  -2.368 -10.604  -8.934
  533   1HG   LYS  76          2HG       LYS  76  -3.587 -12.724  -9.693
  534   2HG   LYS  76          1HG       LYS  76  -3.255 -12.160 -11.332
  535   1HD   LYS  76          2HD       LYS  76  -0.829 -11.987 -10.644
  536   2HD   LYS  76          1HD       LYS  76  -1.273 -12.852  -9.172
  537   1HE   LYS  76          2HE       LYS  76  -0.370 -14.175 -11.219
  538   2HE   LYS  76          1HE       LYS  76  -1.738 -14.811 -10.305
  539   1HZ   LYS  76          1HZ       LYS  76  -3.233 -14.129 -11.959
  540   2HZ   LYS  76          2HZ       LYS  76  -1.944 -14.826 -12.803
  541   3HZ   LYS  76          3HZ       LYS  76  -2.091 -13.143 -12.726
  542    H    ASN  77           H        ASN  77  -4.163 -11.146  -7.163
  543    HA   ASN  77           HA       ASN  77  -4.737  -8.637  -5.774
  544   1HB   ASN  77          2HB       ASN  77  -5.059 -11.478  -5.193
  545   2HB   ASN  77          1HB       ASN  77  -4.325 -10.601  -3.855
  546   1HD2  ASN  77          1HD2      ASN  77  -7.056 -11.818  -4.463
  547   2HD2  ASN  77          2HD2      ASN  77  -8.162 -10.578  -3.993
  548    H    THR  78           H        THR  78  -2.773  -7.506  -6.052
  549    HA   THR  78           HA       THR  78  -0.726  -8.215  -4.165
  550    HB   THR  78           HB       THR  78   0.943  -7.859  -6.312
  551    HG1  THR  78           1HG      THR  78  -0.154  -9.856  -7.538
  552   1HG2  THR  78          1HG2      THR  78   1.579  -9.437  -4.748
  553   2HG2  THR  78          2HG2      THR  78   1.135 -10.461  -6.113
  554   3HG2  THR  78          3HG2      THR  78   0.013 -10.246  -4.770
  555    H    LEU  79           H        LEU  79   1.028  -6.667  -4.086
  556    HA   LEU  79           HA       LEU  79   0.479  -4.067  -5.312
  557   1HB   LEU  79          2HB       LEU  79  -0.482  -4.326  -2.915
  558   2HB   LEU  79          1HB       LEU  79   1.192  -4.248  -2.398
  559    HG   LEU  79           HG       LEU  79   1.416  -2.025  -3.400
  560   1HD1  LEU  79          1HD1      LEU  79  -1.463  -1.662  -3.827
  561   2HD1  LEU  79          2HD1      LEU  79  -0.666  -2.714  -4.997
  562   3HD1  LEU  79          3HD1      LEU  79  -0.089  -1.064  -4.757
  563   1HD2  LEU  79          1HD2      LEU  79  -1.074  -1.812  -1.794
  564   2HD2  LEU  79          2HD2      LEU  79   0.438  -0.915  -1.663
  565   3HD2  LEU  79          3HD2      LEU  79   0.336  -2.567  -1.054
  566    H    TYR  80           H        TYR  80   2.299  -3.230  -6.143
  567    HA   TYR  80           HA       TYR  80   4.864  -4.317  -5.180
  568   1HB   TYR  80          2HB       TYR  80   4.230  -3.255  -7.939
  569   2HB   TYR  80          1HB       TYR  80   5.749  -3.977  -7.423
  570    HD1  TYR  80           1HD      TYR  80   2.122  -4.756  -7.814
  571    HD2  TYR  80           2HD      TYR  80   6.100  -6.261  -7.702
  572    HE1  TYR  80           1HE      TYR  80   1.300  -6.967  -8.509
  573    HE2  TYR  80           2HE      TYR  80   5.289  -8.475  -8.397
  574    HH   TYR  80           HH       TYR  80   2.451  -9.040  -9.785
  575    H    LEU  81           H        LEU  81   6.680  -2.962  -5.122
  576    HA   LEU  81           HA       LEU  81   6.318  -0.110  -5.507
  577   1HB   LEU  81          2HB       LEU  81   5.663  -0.495  -3.150
  578   2HB   LEU  81          1HB       LEU  81   7.233  -1.221  -2.850
  579    HG   LEU  81           HG       LEU  81   8.020   1.166  -3.834
  580   1HD1  LEU  81          1HD1      LEU  81   6.114   2.416  -2.139
  581   2HD1  LEU  81          2HD1      LEU  81   5.251   1.499  -3.377
  582   3HD1  LEU  81          3HD1      LEU  81   6.442   2.712  -3.848
  583   1HD2  LEU  81          1HD2      LEU  81   7.867  -0.098  -1.294
  584   2HD2  LEU  81          2HD2      LEU  81   7.505   1.617  -1.093
  585   3HD2  LEU  81          3HD2      LEU  81   9.014   1.118  -1.857
  586    H    GLN  82           H        GLN  82   8.137   0.838  -6.239
  587    HA   GLN  82           HA       GLN  82  10.534  -0.851  -6.383
  588   1HB   GLN  82          2HB       GLN  82   9.238   1.016  -8.222
  589   2HB   GLN  82          1HB       GLN  82  10.969   1.285  -8.076
  590   1HG   GLN  82          2HG       GLN  82  10.292  -1.524  -8.376
  591   2HG   GLN  82          1HG       GLN  82   9.732  -0.535  -9.724
  592   1HE2  GLN  82          1HE2      GLN  82  12.207  -2.370  -8.700
  593   2HE2  GLN  82          2HE2      GLN  82  13.507  -1.657  -9.587
  594    H    MET  83           H        MET  83  12.142  -0.392  -5.067
  595    HA   MET  83           HA       MET  83  12.238   2.142  -3.675
  596   1HB   MET  83          2HB       MET  83  13.745  -0.446  -3.462
  597   2HB   MET  83          1HB       MET  83  14.347   1.000  -2.662
  598   1HG   MET  83          2HG       MET  83  13.120  -0.064  -1.014
  599   2HG   MET  83          1HG       MET  83  12.009   1.159  -1.627
  600   1HE   MET  83          1HE       MET  83  11.948  -2.636  -0.570
  601   2HE   MET  83          2HE       MET  83  10.221  -2.279  -0.508
  602   3HE   MET  83          3HE       MET  83  11.383  -1.132   0.158
  603    H    ASN  84           H        ASN  84  12.936   3.762  -4.965
  604    HA   ASN  84           HA       ASN  84  15.506   3.363  -6.354
  605   1HB   ASN  84          2HB       ASN  84  13.668   5.595  -7.106
  606   2HB   ASN  84          1HB       ASN  84  14.814   4.703  -8.102
  607   1HD2  ASN  84          1HD2      ASN  84  14.230   2.658  -8.896
  608   2HD2  ASN  84          2HD2      ASN  84  12.574   2.177  -9.008
  609    H    SER  85           H        SER  85  16.842   5.344  -6.561
  610    HA   SER  85           HA       SER  85  18.088   6.969  -5.567
  611   1HB   SER  85          2HB       SER  85  15.318   7.815  -5.409
  612   2HB   SER  85          1HB       SER  85  16.258   8.468  -4.069
  613    HG   SER  85           HG       SER  85  16.405   9.009  -6.773
  614    H    LEU  86           H        LEU  86  17.895   4.522  -4.167
  615    HA   LEU  86           HA       LEU  86  17.322   4.801  -1.436
  616   1HB   LEU  86          2HB       LEU  86  19.417   2.983  -2.616
  617   2HB   LEU  86          1HB       LEU  86  18.545   2.764  -1.109
  618    HG   LEU  86           HG       LEU  86  16.581   2.929  -3.119
  619   1HD1  LEU  86          1HD1      LEU  86  17.399   0.862  -4.437
  620   2HD1  LEU  86          2HD1      LEU  86  19.008   1.400  -3.956
  621   3HD1  LEU  86          3HD1      LEU  86  17.971   2.463  -4.906
  622   1HD2  LEU  86          1HD2      LEU  86  16.696   0.304  -2.539
  623   2HD2  LEU  86          2HD2      LEU  86  15.979   1.510  -1.470
  624   3HD2  LEU  86          3HD2      LEU  86  17.632   0.958  -1.196
  625    H    LYS  87           H        LYS  87  18.557   5.288   0.332
  626    HA   LYS  87           HA       LYS  87  21.271   6.309  -0.125
  627   1HB   LYS  87          2HB       LYS  87  20.398   8.036   1.774
  628   2HB   LYS  87          1HB       LYS  87  20.399   8.390   0.051
  629   1HG   LYS  87          2HG       LYS  87  18.169   8.421  -0.064
  630   2HG   LYS  87          1HG       LYS  87  18.002   6.991   0.957
  631   1HD   LYS  87          2HD       LYS  87  18.433   8.400   2.941
  632   2HD   LYS  87          1HD       LYS  87  18.501   9.818   1.891
  633   1HE   LYS  87          2HE       LYS  87  16.172   9.216   1.129
  634   2HE   LYS  87          1HE       LYS  87  16.142   8.027   2.430
  635   1HZ   LYS  87          1HZ       LYS  87  15.283  10.507   2.729
  636   2HZ   LYS  87          2HZ       LYS  87  16.901  10.739   3.166
  637   3HZ   LYS  87          3HZ       LYS  87  15.953   9.616   4.002
  638    H    SER  88           H        SER  88  18.877   5.766   2.460
  639    HA   SER  88           HA       SER  88  20.393   3.785   3.776
  640   1HB   SER  88          2HB       SER  88  21.928   5.434   4.489
  641   2HB   SER  88          1HB       SER  88  20.649   6.607   4.806
  642    HG   SER  88           HG       SER  88  20.692   4.186   6.225
  643    H    GLU  89           H        GLU  89  17.822   6.033   3.584
  644    HA   GLU  89           HA       GLU  89  16.435   5.269   5.959
  645   1HB   GLU  89          2HB       GLU  89  15.908   7.404   5.111
  646   2HB   GLU  89          1HB       GLU  89  15.674   6.792   3.479
  647   1HG   GLU  89          2HG       GLU  89  13.552   6.130   3.875
  648   2HG   GLU  89          1HG       GLU  89  13.875   5.723   5.560
  649    H    ASP  90           H        ASP  90  16.306   4.302   2.570
  650    HA   ASP  90           HA       ASP  90  14.008   2.775   2.528
  651   1HB   ASP  90          2HB       ASP  90  16.212   1.476   1.111
  652   2HB   ASP  90          1HB       ASP  90  14.715   2.158   0.481
  653    H    THR  91           H        THR  91  17.096   2.076   3.977
  654    HA   THR  91           HA       THR  91  16.868  -0.700   4.316
  655    HB   THR  91           HB       THR  91  18.225   1.249   6.191
  656    HG1  THR  91           1HG      THR  91  19.506   1.568   4.542
  657   1HG2  THR  91          1HG2      THR  91  19.758  -0.805   6.459
  658   2HG2  THR  91          2HG2      THR  91  18.412  -1.718   5.780
  659   3HG2  THR  91          3HG2      THR  91  18.198  -0.819   7.282
  660    H    ALA  92           H        ALA  92  14.767  -1.232   4.926
  661    HA   ALA  92           HA       ALA  92  14.253  -1.316   7.713
  662   1HB   ALA  92          1HB       ALA  92  13.630   0.975   7.542
  663   2HB   ALA  92          2HB       ALA  92  12.133   0.043   7.637
  664   3HB   ALA  92          3HB       ALA  92  12.683   0.672   6.083
  665    H    VAL  93           H        VAL  93  11.606  -1.712   7.853
  666    HA   VAL  93           HA       VAL  93  11.203  -4.040   6.119
  667    HB   VAL  93           HB       VAL  93   9.519  -3.284   8.506
  668   1HG1  VAL  93          1HG1      VAL  93   9.821  -5.655   6.740
  669   2HG1  VAL  93          2HG1      VAL  93   8.367  -4.951   7.450
  670   3HG1  VAL  93          3HG1      VAL  93   9.446  -5.933   8.441
  671   1HG2  VAL  93          1HG2      VAL  93  10.909  -4.803   9.842
  672   2HG2  VAL  93          2HG2      VAL  93  11.833  -3.420   9.255
  673   3HG2  VAL  93          3HG2      VAL  93  12.008  -4.992   8.475
  674    H    TYR  94           H        TYR  94   9.215  -4.320   4.968
  675    HA   TYR  94           HA       TYR  94   7.677  -1.831   4.685
  676   1HB   TYR  94          2HB       TYR  94   8.681  -3.667   2.524
  677   2HB   TYR  94          1HB       TYR  94   7.382  -2.509   2.248
  678    HD1  TYR  94           1HD      TYR  94  10.867  -2.676   3.572
  679    HD2  TYR  94           2HD      TYR  94   7.925  -0.357   1.556
  680    HE1  TYR  94           1HE      TYR  94  12.529  -0.905   3.202
  681    HE2  TYR  94           2HE      TYR  94   9.582   1.422   1.175
  682    HH   TYR  94           HH       TYR  94  11.876   2.111   2.506
  683    H    TYR  95           H        TYR  95   5.625  -1.950   4.979
  684    HA   TYR  95           HA       TYR  95   4.299  -4.569   5.087
  685   1HB   TYR  95          2HB       TYR  95   3.312  -1.975   6.290
  686   2HB   TYR  95          1HB       TYR  95   2.737  -3.606   6.627
  687    HD1  TYR  95           1HD      TYR  95   4.867  -5.212   7.366
  688    HD2  TYR  95           2HD      TYR  95   4.479  -1.024   7.991
  689    HE1  TYR  95           1HE      TYR  95   6.430  -5.359   9.259
  690    HE2  TYR  95           2HE      TYR  95   6.042  -1.156   9.886
  691    HH   TYR  95           HH       TYR  95   7.550  -4.238  10.816
  692    H    CYS  96           H        CYS  96   1.925  -4.479   4.573
  693    HA   CYS  96           HA       CYS  96   1.258  -2.534   2.491
  694   1HB   CYS  96          2HB       CYS  96   0.189  -4.541   1.235
  695   2HB   CYS  96          1HB       CYS  96   1.922  -4.281   1.082
  696    H    ALA  97           H        ALA  97  -0.890  -1.925   2.512
  697    HA   ALA  97           HA       ALA  97  -2.884  -3.517   3.833
  698   1HB   ALA  97          1HB       ALA  97  -3.218  -1.362   5.430
  699   2HB   ALA  97          2HB       ALA  97  -1.459  -1.435   5.321
  700   3HB   ALA  97          3HB       ALA  97  -2.369  -2.835   5.897
  701    H    LYS  98           H        LYS  98  -4.978  -2.391   4.034
  702    HA   LYS  98           HA       LYS  98  -5.417  -0.716   1.686
  703   1HB   LYS  98          2HB       LYS  98  -7.021  -2.327   1.559
  704   2HB   LYS  98          1HB       LYS  98  -7.047  -2.587   3.295
  705   1HG   LYS  98          2HG       LYS  98  -8.221  -0.258   3.346
  706   2HG   LYS  98          1HG       LYS  98  -8.565  -0.617   1.651
  707   1HD   LYS  98          2HD       LYS  98  -9.145  -2.629   3.790
  708   2HD   LYS  98          1HD       LYS  98 -10.280  -1.318   3.458
  709   1HE   LYS  98          2HE       LYS  98 -10.648  -2.058   1.257
  710   2HE   LYS  98          1HE       LYS  98  -9.230  -3.106   1.286
  711   1HZ   LYS  98          1HZ       LYS  98 -11.767  -3.910   1.738
  712   2HZ   LYS  98          2HZ       LYS  98 -11.177  -3.728   3.313
  713   3HZ   LYS  98          3HZ       LYS  98 -10.383  -4.752   2.225
  714    H    TYR  99           H        TYR  99  -6.317   1.301   1.753
  715    HA   TYR  99           HA       TYR  99  -6.054   2.732   4.255
  716   1HB   TYR  99          2HB       TYR  99  -5.769   3.390   1.527
  717   2HB   TYR  99          1HB       TYR  99  -7.133   4.335   2.116
  718    HD1  TYR  99           1HD      TYR  99  -3.596   3.488   2.949
  719    HD2  TYR  99           2HD      TYR  99  -6.747   6.333   3.242
  720    HE1  TYR  99           1HE      TYR  99  -2.037   5.103   3.941
  721    HE2  TYR  99           2HE      TYR  99  -5.195   7.957   4.241
  722    HH   TYR  99           HH       TYR  99  -3.149   8.225   5.158
  723    H    SER 100           H        SER 100  -7.668   3.326   5.557
  724    HA   SER 100           HA       SER 100 -10.343   3.751   4.616
  725   1HB   SER 100          2HB       SER 100  -9.598   1.186   5.909
  726   2HB   SER 100          1HB       SER 100 -11.086   1.946   6.475
  727    HG   SER 100           HG       SER 100 -10.601   0.633   4.161
  728    H    GLY 101           H        GLY 101 -11.317   5.222   5.874
  729   1HA   GLY 101          2HA       GLY 101 -11.903   6.367   7.816
  730   2HA   GLY 101          1HA       GLY 101 -10.768   5.371   8.715
  731    H    GLY 102           H        GLY 102  -8.899   6.258   6.303
  732   1HA   GLY 102          2HA       GLY 102  -7.745   8.290   5.789
  733   2HA   GLY 102          1HA       GLY 102  -8.285   8.945   7.328
  734    H    ALA 103           H        ALA 103  -7.263   5.766   7.672
  735    HA   ALA 103           HA       ALA 103  -4.461   6.431   8.097
  736   1HB   ALA 103          1HB       ALA 103  -6.103   5.302  10.356
  737   2HB   ALA 103          2HB       ALA 103  -5.670   7.005  10.209
  738   3HB   ALA 103          3HB       ALA 103  -4.408   5.787  10.395
  739    H    LEU 104           H        LEU 104  -3.118   4.725   7.825
  740    HA   LEU 104           HA       LEU 104  -4.250   2.298   6.772
  741   1HB   LEU 104          2HB       LEU 104  -2.109   3.579   6.027
  742   2HB   LEU 104          1HB       LEU 104  -1.330   2.699   7.327
  743    HG   LEU 104           HG       LEU 104  -1.816   0.586   6.279
  744   1HD1  LEU 104          1HD1      LEU 104  -2.815   1.132   3.768
  745   2HD1  LEU 104          2HD1      LEU 104  -3.781   2.156   4.832
  746   3HD1  LEU 104          3HD1      LEU 104  -3.704   0.417   5.113
  747   1HD2  LEU 104          1HD2      LEU 104  -0.669   0.931   4.061
  748   2HD2  LEU 104          2HD2      LEU 104   0.183   1.553   5.477
  749   3HD2  LEU 104          3HD2      LEU 104  -0.692   2.659   4.416
  750    H    ASP 105           H        ASP 105  -3.696   0.152   7.529
  751    HA   ASP 105           HA       ASP 105  -3.414   0.073  10.460
  752   1HB   ASP 105          2HB       ASP 105  -5.326  -1.099   8.692
  753   2HB   ASP 105          1HB       ASP 105  -4.422  -2.394   9.469
  754    H    ALA 106           H        ALA 106  -2.317  -1.329   7.444
  755    HA   ALA 106           HA       ALA 106  -0.451  -2.505   6.891
  756   1HB   ALA 106          1HB       ALA 106   0.687  -0.869   8.361
  757   2HB   ALA 106          2HB       ALA 106   1.478  -2.444   8.313
  758   3HB   ALA 106          3HB       ALA 106   0.491  -1.994   9.705
  759    H    TRP 107           H        TRP 107  -1.343  -4.499   6.552
  760    HA   TRP 107           HA       TRP 107  -1.329  -6.359   8.836
  761   1HB   TRP 107          2HB       TRP 107  -2.823  -6.919   6.295
  762   2HB   TRP 107          1HB       TRP 107  -3.100  -7.570   7.904
  763    HD1  TRP 107           HD       TRP 107  -3.636  -5.129   9.647
  764    HE1  TRP 107           1HE      TRP 107  -5.641  -3.571   9.228
  765    HE3  TRP 107           3HE      TRP 107  -4.489  -6.225   4.736
  766    HZ2  TRP 107           2HZ      TRP 107  -7.355  -2.894   7.089
  767    HZ3  TRP 107           3HZ      TRP 107  -6.331  -5.083   3.573
  768    HH2  TRP 107           HH       TRP 107  -7.731  -3.454   4.726
  769    H    GLY 108           H        GLY 108   0.484  -5.459   6.346
  770   1HA   GLY 108          2HA       GLY 108   1.067  -7.803   4.920
  771   2HA   GLY 108          1HA       GLY 108   2.157  -6.438   5.114
  772    H    GLN 109           H        GLN 109   2.821  -9.246   5.041
  773    HA   GLN 109           HA       GLN 109   3.335 -10.255   7.629
  774   1HB   GLN 109          2HB       GLN 109   3.600 -11.190   5.032
  775   2HB   GLN 109          1HB       GLN 109   5.260 -11.095   5.606
  776   1HG   GLN 109          2HG       GLN 109   3.012 -12.561   6.970
  777   2HG   GLN 109          1HG       GLN 109   4.281 -13.296   5.991
  778   1HE2  GLN 109          1HE2      GLN 109   3.381 -12.183   9.066
  779   2HE2  GLN 109          2HE2      GLN 109   4.890 -12.442   9.866
  780    H    GLY 110           H        GLY 110   5.009  -7.998   5.583
  781   1HA   GLY 110          2HA       GLY 110   6.583  -6.433   6.380
  782   2HA   GLY 110          1HA       GLY 110   6.896  -7.481   7.755
  783    H    THR 111           H        THR 111   8.042  -6.398   4.801
  784    HA   THR 111           HA       THR 111   9.800  -8.724   4.446
  785    HB   THR 111           HB       THR 111   8.890  -8.267   2.359
  786    HG1  THR 111           1HG      THR 111  10.622  -7.305   1.166
  787   1HG2  THR 111          1HG2      THR 111   9.420  -5.415   2.100
  788   2HG2  THR 111          2HG2      THR 111   8.285  -5.782   3.400
  789   3HG2  THR 111          3HG2      THR 111   7.949  -6.325   1.756
  790    H    GLN 112           H        GLN 112  11.938  -8.615   4.820
  791    HA   GLN 112           HA       GLN 112  12.976  -6.231   6.083
  792   1HB   GLN 112          2HB       GLN 112  13.511  -8.321   7.123
  793   2HB   GLN 112          1HB       GLN 112  14.142  -8.973   5.618
  794   1HG   GLN 112          2HG       GLN 112  16.107  -8.446   6.588
  795   2HG   GLN 112          1HG       GLN 112  15.766  -6.879   5.858
  796   1HE2  GLN 112          1HE2      GLN 112  15.049  -5.182   7.165
  797   2HE2  GLN 112          2HE2      GLN 112  15.262  -5.201   8.879
  798    H    VAL 113           H        VAL 113  13.618  -4.636   4.801
  799    HA   VAL 113           HA       VAL 113  15.254  -5.282   2.431
  800    HB   VAL 113           HB       VAL 113  13.634  -2.785   2.972
  801   1HG1  VAL 113          1HG1      VAL 113  14.180  -2.289   0.567
  802   2HG1  VAL 113          2HG1      VAL 113  15.376  -3.584   0.650
  803   3HG1  VAL 113          3HG1      VAL 113  15.535  -2.168   1.690
  804   1HG2  VAL 113          1HG2      VAL 113  13.137  -5.215   1.293
  805   2HG2  VAL 113          2HG2      VAL 113  12.413  -3.661   0.876
  806   3HG2  VAL 113          3HG2      VAL 113  12.059  -4.409   2.433
  807    H    THR 114           H        THR 114  17.287  -4.397   2.250
  808    HA   THR 114           HA       THR 114  18.088  -2.373   4.215
  809    HB   THR 114           HB       THR 114  19.630  -4.938   3.810
  810    HG1  THR 114           1HG      THR 114  17.733  -4.112   5.679
  811   1HG2  THR 114          1HG2      THR 114  20.624  -2.489   4.517
  812   2HG2  THR 114          2HG2      THR 114  21.339  -4.039   4.965
  813   3HG2  THR 114          3HG2      THR 114  20.262  -3.207   6.087
  814    H    VAL 115           H        VAL 115  20.016  -1.242   3.726
  815    HA   VAL 115           HA       VAL 115  20.935  -1.477   0.934
  816    HB   VAL 115           HB       VAL 115  20.729   1.145   2.407
  817   1HG1  VAL 115          1HG1      VAL 115  21.399   0.282  -0.357
  818   2HG1  VAL 115          2HG1      VAL 115  22.111   1.554   0.637
  819   3HG1  VAL 115          3HG1      VAL 115  20.552   1.814  -0.145
  820   1HG2  VAL 115          1HG2      VAL 115  18.681  -0.161   0.624
  821   2HG2  VAL 115          2HG2      VAL 115  18.665   1.546   1.066
  822   3HG2  VAL 115          3HG2      VAL 115  18.490   0.308   2.313
  823    H    SER 116           H        SER 116  23.053  -1.867   0.805
  824    HA   SER 116           HA       SER 116  24.943  -0.499   2.477
  825   1HB   SER 116          2HB       SER 116  23.980  -3.007   3.366
  826   2HB   SER 116          1HB       SER 116  25.620  -3.275   2.778
  827    HG   SER 116           HG       SER 116  25.675  -1.044   4.164
  828    H    SER 117           H        SER 117  26.301  -3.426   1.661
  829    HA   SER 117           HA       SER 117  27.652  -4.182   0.004
  830   1HB   SER 117          2HB       SER 117  25.879  -4.013  -1.577
  831   2HB   SER 117          1HB       SER 117  26.019  -2.257  -1.651
  832    HG   SER 117           HG       SER 117  27.011  -3.232  -3.447
  833    H    GLN 118           H        GLN 118  27.595  -0.937   0.979
  834    HA   GLN 118           HA       GLN 118  30.410  -0.676   0.696
  835   1HB   GLN 118          2HB       GLN 118  30.378   1.323  -0.794
  836   2HB   GLN 118          1HB       GLN 118  29.933  -0.172  -1.605
  837   1HG   GLN 118          2HG       GLN 118  27.496   0.636  -0.964
  838   2HG   GLN 118          1HG       GLN 118  28.287   2.211  -0.973
  839   1HE2  GLN 118          1HE2      GLN 118  28.328  -0.743  -2.945
  840   2HE2  GLN 118          2HE2      GLN 118  28.189   0.065  -4.465
  841    H    SER 119           H        SER 119  31.157   1.534   1.402
  842    HA   SER 119           HA       SER 119  29.858   2.233   3.814
  843   1HB   SER 119          2HB       SER 119  32.319   2.470   3.361
  844   2HB   SER 119          1HB       SER 119  31.942   3.860   2.344
  845    HG   SER 119           HG       SER 119  30.694   4.222   4.636
  846    H    GLU 120           H        GLU 120  28.965   4.295   4.404
  847    HA   GLU 120           HA       GLU 120  27.302   5.391   2.278
  848   1HB   GLU 120          2HB       GLU 120  26.290   6.657   4.304
  849   2HB   GLU 120          1HB       GLU 120  25.992   4.932   4.145
  850   1HG   GLU 120          2HG       GLU 120  27.952   4.579   5.694
  851   2HG   GLU 120          1HG       GLU 120  27.908   6.315   5.995
  852    H    GLN 121           H        GLN 121  28.524   6.798   1.096
  853    HA   GLN 121           HA       GLN 121  29.916   8.943   2.548
  854   1HB   GLN 121          2HB       GLN 121  30.813   7.334   0.497
  855   2HB   GLN 121          1HB       GLN 121  30.346   8.805  -0.345
  856   1HG   GLN 121          2HG       GLN 121  31.931  10.083   0.718
  857   2HG   GLN 121          1HG       GLN 121  32.027   9.001   2.106
  858   1HE2  GLN 121          1HE2      GLN 121  33.270   9.786  -0.980
  859   2HE2  GLN 121          2HE2      GLN 121  34.475   8.551  -1.062
  860    H    LYS 122           H        LYS 122  30.052  10.963   0.866
  861    HA   LYS 122           HA       LYS 122  27.288  11.847   0.663
  862   1HB   LYS 122          2HB       LYS 122  29.289  13.173   1.681
  863   2HB   LYS 122          1HB       LYS 122  29.664  13.555   0.006
  864   1HG   LYS 122          2HG       LYS 122  28.381  15.355   0.620
  865   2HG   LYS 122          1HG       LYS 122  27.172  14.294  -0.101
  866   1HD   LYS 122          2HD       LYS 122  26.084  14.044   1.839
  867   2HD   LYS 122          1HD       LYS 122  27.581  13.790   2.740
  868   1HE   LYS 122          2HE       LYS 122  27.959  16.247   2.684
  869   2HE   LYS 122          1HE       LYS 122  26.380  16.433   1.924
  870   1HZ   LYS 122          1HZ       LYS 122  25.303  15.650   3.848
  871   2HZ   LYS 122          2HZ       LYS 122  26.460  16.752   4.401
  872   3HZ   LYS 122          3HZ       LYS 122  26.743  15.091   4.540
  873    H    LEU 123           H        LEU 123  27.705   9.946  -1.196
  874    HA   LEU 123           HA       LEU 123  28.684  10.757  -3.689
  875   1HB   LEU 123          2HB       LEU 123  27.136   8.563  -2.618
  876   2HB   LEU 123          1HB       LEU 123  26.534   9.035  -4.195
  877    HG   LEU 123           HG       LEU 123  29.289   8.935  -4.542
  878   1HD1  LEU 123          1HD1      LEU 123  28.464   6.451  -3.066
  879   2HD1  LEU 123          2HD1      LEU 123  29.322   7.781  -2.289
  880   3HD1  LEU 123          3HD1      LEU 123  30.073   6.910  -3.626
  881   1HD2  LEU 123          1HD2      LEU 123  27.830   8.220  -6.238
  882   2HD2  LEU 123          2HD2      LEU 123  27.051   7.038  -5.187
  883   3HD2  LEU 123          3HD2      LEU 123  28.703   6.771  -5.742
  884    H    ILE 124           H        ILE 124  27.789  11.778  -5.432
  885    HA   ILE 124           HA       ILE 124  25.559  13.516  -4.897
  886    HB   ILE 124           HB       ILE 124  26.001  14.525  -7.027
  887   1HG1  ILE 124          2HG1      ILE 124  28.071  12.416  -7.616
  888   2HG1  ILE 124          1HG1      ILE 124  26.403  12.243  -8.150
  889   1HG2  ILE 124          1HG2      ILE 124  28.743  14.423  -6.690
  890   2HG2  ILE 124          2HG2      ILE 124  28.105  14.039  -5.092
  891   3HG2  ILE 124          3HG2      ILE 124  27.630  15.536  -5.894
  892   1HD1  ILE 124          1HD1      ILE 124  27.811  14.767  -8.807
  893   2HD1  ILE 124          2HD1      ILE 124  26.591  13.877  -9.718
  894   3HD1  ILE 124          3HD1      ILE 124  28.259  13.305  -9.687
  895    H    SER 125           H        SER 125  25.488  10.406  -5.486
  896    HA   SER 125           HA       SER 125  24.015   8.920  -6.368
  897   1HB   SER 125          2HB       SER 125  21.792   9.444  -6.130
  898   2HB   SER 125          1HB       SER 125  22.496  10.771  -5.205
  899    HG   SER 125           HG       SER 125  21.626  12.073  -6.587
  900    H    GLU 126           H        GLU 126  22.283   8.754  -8.325
  901    HA   GLU 126           HA       GLU 126  22.099   8.515 -10.577
  902   1HB   GLU 126          2HB       GLU 126  21.637  10.992 -10.260
  903   2HB   GLU 126          1HB       GLU 126  23.297  11.277 -10.767
  904   1HG   GLU 126          2HG       GLU 126  21.690  11.568 -12.592
  905   2HG   GLU 126          1HG       GLU 126  22.856  10.287 -12.918
  906    H    GLU 127           H        GLU 127  24.769  10.696 -11.127
  907    HA   GLU 127           HA       GLU 127  26.404   8.397 -11.981
  908   1HB   GLU 127          2HB       GLU 127  25.767   9.686 -13.904
  909   2HB   GLU 127          1HB       GLU 127  26.226  11.190 -13.116
  910   1HG   GLU 127          2HG       GLU 127  28.211  11.020 -14.071
  911   2HG   GLU 127          1HG       GLU 127  28.521   9.594 -13.080
  912    H    ASP 128           H        ASP 128  28.313   8.126 -11.020
  913    HA   ASP 128           HA       ASP 128  29.447  10.392  -9.516
  914   1HB   ASP 128          2HB       ASP 128  30.423   8.505  -8.028
  915   2HB   ASP 128          1HB       ASP 128  28.735   8.956  -7.816
  916    H    LEU 129           H        LEU 129  30.013   9.621 -12.239
  917    HA   LEU 129           HA       LEU 129  32.894   9.336 -11.996
  918   1HB   LEU 129          2HB       LEU 129  31.107   7.314 -13.259
  919   2HB   LEU 129          1HB       LEU 129  32.651   7.646 -14.023
  920    HG   LEU 129           HG       LEU 129  33.096   7.252 -11.231
  921   1HD1  LEU 129          1HD1      LEU 129  31.942   5.433 -10.633
  922   2HD1  LEU 129          2HD1      LEU 129  32.093   4.694 -12.227
  923   3HD1  LEU 129          3HD1      LEU 129  30.836   5.894 -11.926
  924   1HD2  LEU 129          1HD2      LEU 129  34.912   6.725 -12.477
  925   2HD2  LEU 129          2HD2      LEU 129  33.950   6.113 -13.822
  926   3HD2  LEU 129          3HD2      LEU 129  34.202   5.113 -12.392
  927    H    ASN 130           H        ASN 130  33.506   9.003 -14.676
  928    HA   ASN 130           HA       ASN 130  32.448  11.500 -15.814
  929   1HB   ASN 130          2HB       ASN 130  35.072  10.083 -16.319
  930   2HB   ASN 130          1HB       ASN 130  34.544  11.538 -17.157
  931   1HD2  ASN 130          1HD2      ASN 130  33.623  13.185 -15.377
  932   2HD2  ASN 130          2HD2      ASN 130  34.770  13.534 -14.134
  933    H    HIS 131           H        HIS 131  33.094  11.318 -18.406
  934    HA   HIS 131           HA       HIS 131  31.296   9.220 -19.346
  935   1HB   HIS 131          2HB       HIS 131  31.617  10.558 -21.564
  936   2HB   HIS 131          1HB       HIS 131  30.625  11.237 -20.278
  937    HD1  HIS 131           1HD      HIS 131  31.973  13.018 -18.689
  938    HD2  HIS 131           2HD      HIS 131  33.575  12.217 -22.439
  939    HE1  HIS 131           1HE      HIS 131  33.546  14.920 -19.168
  940    HE2  HIS 131           2HE      HIS 131  34.560  14.377 -21.409
  941    H    HIS 132           H        HIS 132  32.036   7.408 -20.206
  942    HA   HIS 132           HA       HIS 132  34.442   7.412 -21.831
  943   1HB   HIS 132          2HB       HIS 132  34.499   6.568 -19.108
  944   2HB   HIS 132          1HB       HIS 132  34.685   5.142 -20.123
  945    HD1  HIS 132           1HD      HIS 132  36.162   8.661 -20.209
  946    HD2  HIS 132           2HD      HIS 132  37.305   4.678 -20.525
  947    HE1  HIS 132           1HE      HIS 132  38.649   8.702 -20.580
  948    HE2  HIS 132           2HE      HIS 132  39.308   6.285 -20.841
  949    H    HIS 133           H        HIS 133  34.341   5.967 -23.457
  950    HA   HIS 133           HA       HIS 133  33.497   4.421 -24.891
  951   1HB   HIS 133          2HB       HIS 133  33.778   3.137 -22.453
  952   2HB   HIS 133          1HB       HIS 133  32.131   2.744 -22.933
  953    HD1  HIS 133           1HD      HIS 133  34.193   0.519 -22.818
  954    HD2  HIS 133           2HD      HIS 133  33.418   2.738 -26.245
  955    HE1  HIS 133           1HE      HIS 133  34.943  -0.923 -24.737
  956    HE2  HIS 133           2HE      HIS 133  34.425   0.422 -26.804
  957    H    HIS 134           H        HIS 134  31.327   3.046 -25.284
  958    HA   HIS 134           HA       HIS 134  29.170   3.193 -25.982
  959   1HB   HIS 134          2HB       HIS 134  29.176   3.522 -23.230
  960   2HB   HIS 134          1HB       HIS 134  28.173   4.852 -23.800
  961    HD1  HIS 134           1HD      HIS 134  25.806   4.293 -24.327
  962    HD2  HIS 134           2HD      HIS 134  28.218   0.913 -24.188
  963    HE1  HIS 134           1HE      HIS 134  24.239   2.340 -24.561
  964    HE2  HIS 134           2HE      HIS 134  25.713   0.303 -24.404
  965    H    HIS 135           H        HIS 135  29.659   4.530 -27.767
  966    HA   HIS 135           HA       HIS 135  29.661   7.373 -27.581
  967   1HB   HIS 135          2HB       HIS 135  30.626   5.740 -29.427
  968   2HB   HIS 135          1HB       HIS 135  29.038   5.978 -30.149
  969    HD1  HIS 135           1HD      HIS 135  32.097   7.107 -30.904
  970    HD2  HIS 135           2HD      HIS 135  28.713   9.189 -29.687
  971    HE1  HIS 135           1HE      HIS 135  32.429   9.465 -31.717
  972    HE2  HIS 135           2HE      HIS 135  30.338  10.690 -31.027
  Start of MODEL    3
    1   1H    ASP   1          1HT       ASP   1 -10.079  -8.007  11.019
    2   2H    ASP   1          2HT       ASP   1  -9.346  -9.461  10.562
    3   3H    ASP   1          3HT       ASP   1 -11.024  -9.389  10.769
    4    HA   ASP   1           HA       ASP   1 -11.384  -8.630   8.733
    5   1HB   ASP   1          2HB       ASP   1  -9.368  -6.714   9.682
    6   2HB   ASP   1          1HB       ASP   1  -9.397  -6.907   7.931
    7    H    VAL   2           H        VAL   2  -9.615  -8.042   6.625
    8    HA   VAL   2           HA       VAL   2  -8.639 -10.697   6.058
    9    HB   VAL   2           HB       VAL   2  -8.707 -10.136   3.868
   10   1HG1  VAL   2          1HG1      VAL   2 -10.023  -7.575   4.144
   11   2HG1  VAL   2          2HG1      VAL   2 -10.637  -8.755   5.305
   12   3HG1  VAL   2          3HG1      VAL   2 -10.663  -9.120   3.579
   13   1HG2  VAL   2          1HG2      VAL   2  -8.153  -7.578   3.258
   14   2HG2  VAL   2          2HG2      VAL   2  -6.923  -8.833   3.397
   15   3HG2  VAL   2          3HG2      VAL   2  -7.224  -7.741   4.748
   16    H    GLN   3           H        GLN   3  -6.483 -11.182   5.368
   17    HA   GLN   3           HA       GLN   3  -4.455  -9.306   6.372
   18   1HB   GLN   3          2HB       GLN   3  -5.011 -11.574   7.692
   19   2HB   GLN   3          1HB       GLN   3  -3.854 -12.206   6.527
   20   1HG   GLN   3          2HG       GLN   3  -2.416 -10.167   7.288
   21   2HG   GLN   3          1HG       GLN   3  -3.453 -10.223   8.712
   22   1HE2  GLN   3          1HE2      GLN   3  -0.608 -11.259   7.464
   23   2HE2  GLN   3          2HE2      GLN   3  -0.347 -12.658   8.445
   24    H    LEU   4           H        LEU   4  -2.345  -9.526   5.387
   25    HA   LEU   4           HA       LEU   4  -2.408 -10.815   2.745
   26   1HB   LEU   4          2HB       LEU   4  -0.893  -8.332   2.795
   27   2HB   LEU   4          1HB       LEU   4  -2.093  -8.891   1.643
   28    HG   LEU   4           HG       LEU   4  -2.912  -7.780   4.311
   29   1HD1  LEU   4          1HD1      LEU   4  -2.048  -5.817   3.738
   30   2HD1  LEU   4          2HD1      LEU   4  -3.317  -5.753   2.512
   31   3HD1  LEU   4          3HD1      LEU   4  -1.715  -6.351   2.088
   32   1HD2  LEU   4          1HD2      LEU   4  -4.611  -7.181   2.083
   33   2HD2  LEU   4          2HD2      LEU   4  -4.970  -8.091   3.550
   34   3HD2  LEU   4          3HD2      LEU   4  -4.287  -8.913   2.146
   35    H    GLN   5           H        GLN   5  -0.095 -10.660   1.736
   36    HA   GLN   5           HA       GLN   5   1.939 -11.106   3.808
   37   1HB   GLN   5          2HB       GLN   5   2.317 -12.897   1.566
   38   2HB   GLN   5          1HB       GLN   5   2.252 -13.259   3.285
   39   1HG   GLN   5          2HG       GLN   5   0.094 -13.897   3.209
   40   2HG   GLN   5          1HG       GLN   5  -0.332 -12.700   1.989
   41   1HE2  GLN   5          1HE2      GLN   5  -0.951 -15.569   2.184
   42   2HE2  GLN   5          2HE2      GLN   5  -0.381 -16.267   0.710
   43    H    ALA   6           H        ALA   6   3.575  -9.774   3.451
   44    HA   ALA   6           HA       ALA   6   4.154  -8.960   0.682
   45   1HB   ALA   6          1HB       ALA   6   4.168  -7.519   3.252
   46   2HB   ALA   6          2HB       ALA   6   3.806  -6.941   1.625
   47   3HB   ALA   6          3HB       ALA   6   5.483  -7.132   2.141
   48    H    SER   7           H        SER   7   6.174  -9.159  -0.155
   49    HA   SER   7           HA       SER   7   8.498  -9.667   1.395
   50   1HB   SER   7          2HB       SER   7   7.170 -11.894   1.431
   51   2HB   SER   7          1HB       SER   7   7.667 -12.044  -0.254
   52    HG   SER   7           HG       SER   7   9.068 -12.987   1.476
   53    H    GLY   8           H        GLY   8  10.266 -10.675  -0.240
   54   1HA   GLY   8          2HA       GLY   8  10.983 -10.694  -2.557
   55   2HA   GLY   8          1HA       GLY   8   9.884  -9.354  -2.851
   56    H    GLY   9           H        GLY   9  11.078  -8.523  -0.007
   57   1HA   GLY   9          2HA       GLY   9  12.774  -6.504  -1.028
   58   2HA   GLY   9          1HA       GLY   9  12.591  -6.934   0.666
   59    H    GLY  10           H        GLY  10  15.015  -6.152  -0.074
   60   1HA   GLY  10          2HA       GLY  10  16.633  -8.416   0.525
   61   2HA   GLY  10          1HA       GLY  10  16.790  -7.977  -1.168
   62    H    LEU  11           H        LEU  11  19.069  -7.804  -0.198
   63    HA   LEU  11           HA       LEU  11  19.533  -5.204   1.065
   64   1HB   LEU  11          2HB       LEU  11  20.688  -7.703   1.419
   65   2HB   LEU  11          1HB       LEU  11  21.890  -6.817   0.503
   66    HG   LEU  11           HG       LEU  11  21.014  -5.099   2.575
   67   1HD1  LEU  11          1HD1      LEU  11  21.579  -7.911   3.488
   68   2HD1  LEU  11          2HD1      LEU  11  20.149  -6.933   3.821
   69   3HD1  LEU  11          3HD1      LEU  11  21.702  -6.497   4.536
   70   1HD2  LEU  11          1HD2      LEU  11  23.298  -5.053   3.148
   71   2HD2  LEU  11          2HD2      LEU  11  23.258  -5.332   1.407
   72   3HD2  LEU  11          3HD2      LEU  11  23.575  -6.672   2.508
   73    H    VAL  12           H        VAL  12  19.951  -3.519  -0.187
   74    HA   VAL  12           HA       VAL  12  21.277  -3.976  -2.780
   75    HB   VAL  12           HB       VAL  12  20.116  -2.108  -3.711
   76   1HG1  VAL  12          1HG1      VAL  12  18.755  -3.961  -3.952
   77   2HG1  VAL  12          2HG1      VAL  12  17.672  -2.793  -3.195
   78   3HG1  VAL  12          3HG1      VAL  12  18.415  -4.066  -2.225
   79   1HG2  VAL  12          1HG2      VAL  12  18.543  -1.607  -1.227
   80   2HG2  VAL  12          2HG2      VAL  12  18.914  -0.519  -2.565
   81   3HG2  VAL  12          3HG2      VAL  12  20.156  -0.910  -1.377
   82    H    GLN  13           H        GLN  13  22.026  -1.542  -3.519
   83    HA   GLN  13           HA       GLN  13  23.770  -0.598  -1.339
   84   1HB   GLN  13          2HB       GLN  13  24.321  -0.635  -4.313
   85   2HB   GLN  13          1HB       GLN  13  25.392   0.038  -3.092
   86   1HG   GLN  13          2HG       GLN  13  26.281  -1.944  -2.676
   87   2HG   GLN  13          1HG       GLN  13  24.694  -2.674  -2.439
   88   1HE2  GLN  13          1HE2      GLN  13  23.646  -3.633  -4.196
   89   2HE2  GLN  13          2HE2      GLN  13  24.503  -4.095  -5.624
   90    HA   PRO  14           HA       PRO  14  21.966   3.422  -1.463
   91   1HB   PRO  14          2HB       PRO  14  24.758   4.426  -1.792
   92   2HB   PRO  14          1HB       PRO  14  23.512   4.926  -0.644
   93   1HG   PRO  14          2HG       PRO  14  25.519   3.366   0.138
   94   2HG   PRO  14          1HG       PRO  14  23.873   3.106   0.748
   95   1HD   PRO  14          2HD       PRO  14  25.418   1.549  -1.269
   96   2HD   PRO  14          1HD       PRO  14  24.216   0.991  -0.090
   97    H    GLY  15           H        GLY  15  20.976   3.189  -3.520
   98   1HA   GLY  15          2HA       GLY  15  20.760   4.773  -5.411
   99   2HA   GLY  15          1HA       GLY  15  22.469   4.499  -5.710
  100    H    GLY  16           H        GLY  16  20.641   1.746  -4.763
  101   1HA   GLY  16          2HA       GLY  16  20.978   0.624  -7.435
  102   2HA   GLY  16          1HA       GLY  16  20.576  -0.266  -5.976
  103    H    SER  17           H        SER  17  18.772  -1.327  -6.620
  104    HA   SER  17           HA       SER  17  16.324   0.115  -6.712
  105   1HB   SER  17          2HB       SER  17  15.832  -0.994  -9.097
  106   2HB   SER  17          1HB       SER  17  16.507   0.627  -8.939
  107    HG   SER  17           HG       SER  17  17.939  -1.780  -9.394
  108    H    LEU  18           H        LEU  18  14.820  -1.163  -5.847
  109    HA   LEU  18           HA       LEU  18  15.055  -4.072  -6.232
  110   1HB   LEU  18          2HB       LEU  18  15.650  -2.799  -3.866
  111   2HB   LEU  18          1HB       LEU  18  13.981  -3.281  -3.630
  112    HG   LEU  18           HG       LEU  18  16.246  -5.142  -4.358
  113   1HD1  LEU  18          1HD1      LEU  18  16.188  -5.911  -2.124
  114   2HD1  LEU  18          2HD1      LEU  18  14.733  -4.979  -1.765
  115   3HD1  LEU  18          3HD1      LEU  18  16.266  -4.151  -2.039
  116   1HD2  LEU  18          1HD2      LEU  18  14.334  -6.125  -5.254
  117   2HD2  LEU  18          2HD2      LEU  18  13.304  -5.547  -3.944
  118   3HD2  LEU  18          3HD2      LEU  18  14.457  -6.850  -3.652
  119    H    ARG  19           H        ARG  19  13.211  -5.086  -6.730
  120    HA   ARG  19           HA       ARG  19  10.726  -3.514  -6.681
  121   1HB   ARG  19          2HB       ARG  19  11.534  -4.378  -8.884
  122   2HB   ARG  19          1HB       ARG  19  11.344  -6.013  -8.268
  123   1HG   ARG  19          2HG       ARG  19   8.963  -5.704  -8.046
  124   2HG   ARG  19          1HG       ARG  19   9.112  -4.007  -8.513
  125   1HD   ARG  19          2HD       ARG  19   9.303  -6.467 -10.177
  126   2HD   ARG  19          1HD       ARG  19   8.483  -4.943 -10.510
  127    HE   ARG  19           HE       ARG  19  11.420  -5.155 -10.572
  128   1HH1  ARG  19          1HH1      ARG  19   8.390  -4.283 -12.053
  129   2HH1  ARG  19          2HH1      ARG  19   9.131  -3.529 -13.426
  130   1HH2  ARG  19          1HH2      ARG  19  12.403  -4.166 -12.374
  131   2HH2  ARG  19          2HH2      ARG  19  11.412  -3.464 -13.609
  132    H    VAL  20           H        VAL  20   9.627  -3.915  -4.849
  133    HA   VAL  20           HA       VAL  20   9.533  -6.689  -3.872
  134    HB   VAL  20           HB       VAL  20   9.130  -5.903  -1.708
  135   1HG1  VAL  20          1HG1      VAL  20  11.416  -5.445  -2.511
  136   2HG1  VAL  20          2HG1      VAL  20  10.899  -4.328  -1.248
  137   3HG1  VAL  20          3HG1      VAL  20  10.917  -3.807  -2.932
  138   1HG2  VAL  20          1HG2      VAL  20   8.220  -3.377  -3.042
  139   2HG2  VAL  20          2HG2      VAL  20   8.701  -3.376  -1.346
  140   3HG2  VAL  20          3HG2      VAL  20   7.365  -4.395  -1.884
  141    H    SER  21           H        SER  21   7.540  -7.648  -3.281
  142    HA   SER  21           HA       SER  21   5.142  -6.300  -4.337
  143   1HB   SER  21          2HB       SER  21   4.495  -8.122  -5.598
  144   2HB   SER  21          1HB       SER  21   6.248  -8.228  -5.760
  145    HG   SER  21           HG       SER  21   6.074  -9.658  -3.828
  146    H    CYS  22           H        CYS  22   3.084  -7.334  -3.581
  147    HA   CYS  22           HA       CYS  22   3.256  -8.762  -1.053
  148   1HB   CYS  22          2HB       CYS  22   3.400  -6.414  -0.366
  149   2HB   CYS  22          1HB       CYS  22   1.939  -6.052  -1.274
  150    H    ALA  23           H        ALA  23   1.887 -10.390  -1.287
  151    HA   ALA  23           HA       ALA  23  -0.415 -10.138  -3.031
  152   1HB   ALA  23          1HB       ALA  23   0.496 -12.216  -3.355
  153   2HB   ALA  23          2HB       ALA  23  -0.727 -12.597  -2.142
  154   3HB   ALA  23          3HB       ALA  23   0.959 -12.397  -1.662
  155    H    ALA  24           H        ALA  24  -2.446 -11.434  -2.044
  156    HA   ALA  24           HA       ALA  24  -2.954 -10.957   0.730
  157   1HB   ALA  24          1HB       ALA  24  -3.190  -8.677   0.079
  158   2HB   ALA  24          2HB       ALA  24  -4.811  -9.321   0.352
  159   3HB   ALA  24          3HB       ALA  24  -4.209  -9.114  -1.294
  160    H    SER  25           H        SER  25  -4.932 -11.825   1.445
  161    HA   SER  25           HA       SER  25  -6.478 -13.302  -0.575
  162   1HB   SER  25          2HB       SER  25  -6.132 -14.591   2.077
  163   2HB   SER  25          1HB       SER  25  -6.238 -15.318   0.475
  164    HG   SER  25           HG       SER  25  -4.070 -14.878   1.896
  165    H    GLY  26           H        GLY  26  -8.633 -13.127  -0.380
  166   1HA   GLY  26          2HA       GLY  26 -10.475 -13.183   1.371
  167   2HA   GLY  26          1HA       GLY  26  -9.656 -11.779   2.038
  168    H    PHE  27           H        PHE  27  -9.004 -10.643  -0.566
  169    HA   PHE  27           HA       PHE  27 -11.572 -10.156  -1.828
  170   1HB   PHE  27          2HB       PHE  27 -11.642  -7.807  -1.423
  171   2HB   PHE  27          1HB       PHE  27 -11.407  -8.579   0.140
  172    HD1  PHE  27           1HD      PHE  27  -9.315  -8.348   1.340
  173    HD2  PHE  27           2HD      PHE  27  -9.890  -6.487  -2.444
  174    HE1  PHE  27           1HE      PHE  27  -7.337  -6.938   1.735
  175    HE2  PHE  27           2HE      PHE  27  -7.916  -5.076  -2.055
  176    HZ   PHE  27           HZ       PHE  27  -6.637  -5.301   0.036
  177    H    THR  28           H        THR  28 -11.101  -8.098  -3.420
  178    HA   THR  28           HA       THR  28  -9.217  -9.122  -5.304
  179    HB   THR  28           HB       THR  28 -10.405  -6.382  -5.558
  180    HG1  THR  28           1HG      THR  28 -12.032  -8.324  -6.545
  181   1HG2  THR  28          1HG2      THR  28  -8.866  -7.749  -7.239
  182   2HG2  THR  28          2HG2      THR  28 -10.162  -6.697  -7.807
  183   3HG2  THR  28          3HG2      THR  28 -10.422  -8.438  -7.704
  184    H    PHE  29           H        PHE  29  -9.013  -5.781  -5.492
  185    HA   PHE  29           HA       PHE  29  -7.021  -5.144  -3.631
  186   1HB   PHE  29          2HB       PHE  29  -6.016  -6.852  -5.559
  187   2HB   PHE  29          1HB       PHE  29  -5.560  -5.261  -6.159
  188    HD1  PHE  29           1HD      PHE  29  -5.508  -7.273  -3.021
  189    HD2  PHE  29           2HD      PHE  29  -3.607  -4.310  -5.412
  190    HE1  PHE  29           1HE      PHE  29  -3.617  -7.223  -1.449
  191    HE2  PHE  29           2HE      PHE  29  -1.712  -4.258  -3.844
  192    HZ   PHE  29           HZ       PHE  29  -1.715  -5.717  -1.860
  193    H    SER  30           H        SER  30  -7.695  -4.644  -7.091
  194    HA   SER  30           HA       SER  30  -6.987  -1.956  -7.210
  195   1HB   SER  30          2HB       SER  30  -8.614  -3.795  -8.867
  196   2HB   SER  30          1HB       SER  30  -8.890  -2.071  -9.117
  197    HG   SER  30           HG       SER  30  -6.463  -3.507  -9.372
  198    H    SER  31           H        SER  31 -10.237  -3.359  -6.782
  199    HA   SER  31           HA       SER  31 -11.721  -1.055  -6.615
  200   1HB   SER  31          2HB       SER  31 -12.489  -3.511  -6.527
  201   2HB   SER  31          1HB       SER  31 -12.260  -3.381  -4.784
  202    HG   SER  31           HG       SER  31 -13.621  -1.264  -5.460
  203    H    TYR  32           H        TYR  32  -9.431  -2.234  -4.310
  204    HA   TYR  32           HA       TYR  32 -10.390  -0.293  -2.317
  205   1HB   TYR  32          2HB       TYR  32  -8.776  -2.815  -2.098
  206   2HB   TYR  32          1HB       TYR  32  -8.709  -1.597  -0.828
  207    HD1  TYR  32           1HD      TYR  32 -10.671  -1.143   0.563
  208    HD2  TYR  32           2HD      TYR  32 -10.761  -4.143  -2.454
  209    HE1  TYR  32           1HE      TYR  32 -12.716  -2.076   1.559
  210    HE2  TYR  32           2HE      TYR  32 -12.806  -5.084  -1.466
  211    HH   TYR  32           HH       TYR  32 -14.580  -3.451   0.997
  212    H    HIS  33           H        HIS  33  -8.709   0.839  -1.059
  213    HA   HIS  33           HA       HIS  33  -6.598   1.801  -2.845
  214   1HB   HIS  33          2HB       HIS  33  -7.498   2.970  -0.203
  215   2HB   HIS  33          1HB       HIS  33  -6.455   3.735  -1.397
  216    HD1  HIS  33           1HD      HIS  33  -9.822   2.054  -1.939
  217    HD2  HIS  33           2HD      HIS  33  -7.995   5.765  -2.326
  218    HE1  HIS  33           1HE      HIS  33 -11.536   3.537  -3.031
  219    HE2  HIS  33           2HE      HIS  33 -10.400   5.772  -3.276
  220    H    MET  34           H        MET  34  -4.830   0.554  -2.663
  221    HA   MET  34           HA       MET  34  -4.014  -0.440  -0.049
  222   1HB   MET  34          2HB       MET  34  -3.377  -1.118  -2.869
  223   2HB   MET  34          1HB       MET  34  -2.127  -1.417  -1.670
  224   1HG   MET  34          2HG       MET  34  -4.881  -2.383  -1.122
  225   2HG   MET  34          1HG       MET  34  -3.893  -3.251  -2.297
  226   1HE   MET  34          1HE       MET  34  -5.305  -4.020   0.258
  227   2HE   MET  34          2HE       MET  34  -4.306  -4.455   1.643
  228   3HE   MET  34          3HE       MET  34  -4.280  -5.453   0.188
  229    H    ALA  35           H        ALA  35  -1.752  -0.263   0.633
  230    HA   ALA  35           HA       ALA  35  -0.239   1.957  -0.488
  231   1HB   ALA  35          1HB       ALA  35  -0.245   3.337   1.371
  232   2HB   ALA  35          2HB       ALA  35  -0.802   2.057   2.447
  233   3HB   ALA  35          3HB       ALA  35  -1.918   2.786   1.293
  234    H    TRP  36           H        TRP  36   1.943   1.959   0.029
  235    HA   TRP  36           HA       TRP  36   2.916  -0.508   1.304
  236   1HB   TRP  36          2HB       TRP  36   3.987   1.259  -0.855
  237   2HB   TRP  36          1HB       TRP  36   5.132   0.376   0.151
  238    HD1  TRP  36           HD       TRP  36   2.574  -0.104  -2.589
  239    HE1  TRP  36           1HE      TRP  36   2.643  -2.534  -3.425
  240    HE3  TRP  36           3HE      TRP  36   5.737  -2.046   0.917
  241    HZ2  TRP  36           2HZ      TRP  36   3.932  -4.950  -2.711
  242    HZ3  TRP  36           3HZ      TRP  36   6.350  -4.424   0.765
  243    HH2  TRP  36           HH       TRP  36   5.465  -5.844  -1.013
  244    H    VAL  37           H        VAL  37   3.315  -0.192   3.390
  245    HA   VAL  37           HA       VAL  37   4.538   2.328   4.272
  246    HB   VAL  37           HB       VAL  37   3.761   1.864   6.468
  247   1HG1  VAL  37          1HG1      VAL  37   1.278   0.899   5.658
  248   2HG1  VAL  37          2HG1      VAL  37   1.925   1.739   4.246
  249   3HG1  VAL  37          3HG1      VAL  37   1.776   2.587   5.786
  250   1HG2  VAL  37          1HG2      VAL  37   4.053  -0.837   5.714
  251   2HG2  VAL  37          2HG2      VAL  37   2.368  -0.611   6.186
  252   3HG2  VAL  37          3HG2      VAL  37   3.664  -0.184   7.306
  253    H    ARG  38           H        ARG  38   6.147   2.131   6.093
  254    HA   ARG  38           HA       ARG  38   7.638  -0.368   6.129
  255   1HB   ARG  38          2HB       ARG  38   9.479   0.306   5.035
  256   2HB   ARG  38          1HB       ARG  38   8.433   1.536   4.346
  257   1HG   ARG  38          2HG       ARG  38   9.552   2.331   6.908
  258   2HG   ARG  38          1HG       ARG  38  10.783   1.965   5.698
  259   1HD   ARG  38          2HD       ARG  38   9.985   3.588   4.218
  260   2HD   ARG  38          1HD       ARG  38   8.433   3.706   5.047
  261    HE   ARG  38           HE       ARG  38   9.624   4.827   6.871
  262   1HH1  ARG  38          1HH1      ARG  38  11.173   4.635   3.759
  263   2HH1  ARG  38          2HH1      ARG  38  12.191   6.007   4.037
  264   1HH2  ARG  38          1HH2      ARG  38  10.965   6.634   7.249
  265   2HH2  ARG  38          2HH2      ARG  38  12.076   7.143   6.022
  266    H    GLN  39           H        GLN  39   9.059  -0.581   7.906
  267    HA   GLN  39           HA       GLN  39   8.747   1.474   9.988
  268   1HB   GLN  39          2HB       GLN  39   7.332  -0.593  10.335
  269   2HB   GLN  39          1HB       GLN  39   8.830  -1.501  10.496
  270   1HG   GLN  39          2HG       GLN  39   9.342  -0.559  12.523
  271   2HG   GLN  39          1HG       GLN  39   8.408   0.901  12.205
  272   1HE2  GLN  39          1HE2      GLN  39   6.235   0.936  12.657
  273   2HE2  GLN  39          2HE2      GLN  39   5.440  -0.307  13.556
  274    H    ALA  40           H        ALA  40  10.664   2.342  10.387
  275    HA   ALA  40           HA       ALA  40  13.101   0.799   9.957
  276   1HB   ALA  40          1HB       ALA  40  13.035   3.038   9.032
  277   2HB   ALA  40          2HB       ALA  40  14.253   2.952  10.304
  278   3HB   ALA  40          3HB       ALA  40  12.695   3.713  10.625
  279    HA   PRO  41           HA       PRO  41  14.008  -0.328  14.120
  280   1HB   PRO  41          2HB       PRO  41  16.596   1.116  13.757
  281   2HB   PRO  41          1HB       PRO  41  16.297  -0.526  14.338
  282   1HG   PRO  41          2HG       PRO  41  17.190  -0.110  11.868
  283   2HG   PRO  41          1HG       PRO  41  15.986  -1.370  12.200
  284   1HD   PRO  41          2HD       PRO  41  15.633   1.304  10.930
  285   2HD   PRO  41          1HD       PRO  41  14.788  -0.223  10.606
  286    H    GLY  42           H        GLY  42  12.567   0.968  15.265
  287   1HA   GLY  42          2HA       GLY  42  12.337   2.417  17.108
  288   2HA   GLY  42          1HA       GLY  42  13.798   3.255  16.604
  289    H    LYS  43           H        LYS  43  11.035   2.509  14.546
  290    HA   LYS  43           HA       LYS  43  10.493   5.402  14.359
  291   1HB   LYS  43          2HB       LYS  43  11.374   3.732  12.335
  292   2HB   LYS  43          1HB       LYS  43   9.640   3.819  12.059
  293   1HG   LYS  43          2HG       LYS  43   9.935   6.359  12.257
  294   2HG   LYS  43          1HG       LYS  43  11.655   6.031  12.045
  295   1HD   LYS  43          2HD       LYS  43  10.935   6.424   9.873
  296   2HD   LYS  43          1HD       LYS  43  10.898   4.663   9.984
  297   1HE   LYS  43          2HE       LYS  43   8.884   5.569   8.905
  298   2HE   LYS  43          1HE       LYS  43   8.511   4.711  10.399
  299   1HZ   LYS  43          1HZ       LYS  43   7.262   6.729  10.333
  300   2HZ   LYS  43          2HZ       LYS  43   8.645   7.652  10.025
  301   3HZ   LYS  43          3HZ       LYS  43   8.452   6.896  11.525
  302    H    GLY  44           H        GLY  44   8.201   5.547  13.050
  303   1HA   GLY  44          2HA       GLY  44   6.324   3.964  14.697
  304   2HA   GLY  44          1HA       GLY  44   6.040   5.633  14.228
  305    H    LEU  45           H        LEU  45   7.452   3.604  11.854
  306    HA   LEU  45           HA       LEU  45   6.713   2.712   9.903
  307   1HB   LEU  45          2HB       LEU  45   5.267   1.373  11.416
  308   2HB   LEU  45          1HB       LEU  45   4.015   2.587  11.245
  309    HG   LEU  45           HG       LEU  45   4.214   2.074   8.699
  310   1HD1  LEU  45          1HD1      LEU  45   5.012  -0.065   8.113
  311   2HD1  LEU  45          2HD1      LEU  45   5.221  -0.531   9.801
  312   3HD1  LEU  45          3HD1      LEU  45   6.280   0.684   9.084
  313   1HD2  LEU  45          1HD2      LEU  45   2.352   0.788   8.902
  314   2HD2  LEU  45          2HD2      LEU  45   2.439   1.396  10.555
  315   3HD2  LEU  45          3HD2      LEU  45   3.047  -0.215  10.175
  316    H    GLU  46           H        GLU  46   6.450   3.764   8.071
  317    HA   GLU  46           HA       GLU  46   4.629   6.081   8.009
  318   1HB   GLU  46          2HB       GLU  46   6.935   6.769   7.743
  319   2HB   GLU  46          1HB       GLU  46   7.187   5.560   6.490
  320   1HG   GLU  46          2HG       GLU  46   6.963   7.639   5.400
  321   2HG   GLU  46          1HG       GLU  46   5.462   6.753   5.128
  322    H    TRP  47           H        TRP  47   3.142   6.234   6.358
  323    HA   TRP  47           HA       TRP  47   2.428   3.853   5.015
  324   1HB   TRP  47          2HB       TRP  47   0.478   4.919   4.806
  325   2HB   TRP  47          1HB       TRP  47   1.218   6.352   5.503
  326    HD1  TRP  47           HD       TRP  47   0.886   4.754   1.965
  327    HE1  TRP  47           1HE      TRP  47   0.614   6.668   0.270
  328    HE3  TRP  47           3HE      TRP  47   1.242   8.728   5.154
  329    HZ2  TRP  47           2HZ      TRP  47   0.540   9.486   0.281
  330    HZ3  TRP  47           3HZ      TRP  47   1.055  11.004   4.234
  331    HH2  TRP  47           HH       TRP  47   0.711  11.373   1.845
  332    H    VAL  48           H        VAL  48   4.514   6.460   4.179
  333    HA   VAL  48           HA       VAL  48   5.823   6.898   2.386
  334    HB   VAL  48           HB       VAL  48   5.538   3.919   2.163
  335   1HG1  VAL  48          1HG1      VAL  48   6.194   3.951   0.029
  336   2HG1  VAL  48          2HG1      VAL  48   7.715   4.659   0.577
  337   3HG1  VAL  48          3HG1      VAL  48   6.391   5.705   0.062
  338   1HG2  VAL  48          1HG2      VAL  48   7.500   3.822   3.284
  339   2HG2  VAL  48          2HG2      VAL  48   6.998   5.417   3.846
  340   3HG2  VAL  48          3HG2      VAL  48   8.141   5.272   2.508
  341    H    SER  49           H        SER  49   3.888   4.337   0.796
  342    HA   SER  49           HA       SER  49   2.965   6.432  -1.078
  343   1HB   SER  49          2HB       SER  49   3.665   3.601  -1.846
  344   2HB   SER  49          1HB       SER  49   3.269   4.935  -2.929
  345    HG   SER  49           HG       SER  49   5.615   4.306  -2.399
  346    H    THR  50           H        THR  50   0.968   6.277  -1.988
  347    HA   THR  50           HA       THR  50  -0.802   4.080  -1.227
  348    HB   THR  50           HB       THR  50  -1.126   6.925  -0.374
  349    HG1  THR  50           1HG      THR  50  -1.710   5.948   1.490
  350   1HG2  THR  50          1HG2      THR  50  -3.026   6.401  -1.975
  351   2HG2  THR  50          2HG2      THR  50  -3.490   6.873  -0.340
  352   3HG2  THR  50          3HG2      THR  50  -3.536   5.175  -0.814
  353    H    ILE  51           H        ILE  51  -2.173   3.534  -2.842
  354    HA   ILE  51           HA       ILE  51  -2.277   5.339  -5.171
  355    HB   ILE  51           HB       ILE  51  -1.025   3.292  -5.636
  356   1HG1  ILE  51          2HG1      ILE  51  -3.535   2.775  -7.124
  357   2HG1  ILE  51          1HG1      ILE  51  -2.903   4.417  -7.213
  358   1HG2  ILE  51          1HG2      ILE  51  -2.199   1.113  -5.661
  359   2HG2  ILE  51          2HG2      ILE  51  -3.577   1.880  -4.871
  360   3HG2  ILE  51          3HG2      ILE  51  -2.022   1.790  -4.042
  361   1HD1  ILE  51          1HD1      ILE  51  -2.050   3.204  -9.063
  362   2HD1  ILE  51          2HD1      ILE  51  -1.523   1.876  -8.028
  363   3HD1  ILE  51          3HD1      ILE  51  -0.720   3.446  -7.930
  364    H    ASN  52           H        ASN  52  -4.215   5.728  -6.161
  365    HA   ASN  52           HA       ASN  52  -6.601   4.669  -4.796
  366   1HB   ASN  52          2HB       ASN  52  -6.526   6.996  -4.370
  367   2HB   ASN  52          1HB       ASN  52  -6.050   7.365  -6.025
  368   1HD2  ASN  52          1HD2      ASN  52  -7.577   7.862  -7.449
  369   2HD2  ASN  52          2HD2      ASN  52  -9.278   7.717  -7.181
  370    HA   PRO  53           HA       PRO  53  -7.536   2.867  -8.765
  371   1HB   PRO  53          2HB       PRO  53  -9.975   1.888  -8.174
  372   2HB   PRO  53          1HB       PRO  53  -8.492   1.166  -7.537
  373   1HG   PRO  53          2HG       PRO  53 -10.403   3.053  -6.210
  374   2HG   PRO  53          1HG       PRO  53  -9.633   1.598  -5.552
  375   1HD   PRO  53          2HD       PRO  53  -8.730   4.114  -5.045
  376   2HD   PRO  53          1HD       PRO  53  -7.665   2.695  -5.096
  377    H    GLY  54           H        GLY  54  -9.480   2.846 -10.300
  378   1HA   GLY  54          2HA       GLY  54 -11.144   3.935 -11.478
  379   2HA   GLY  54          1HA       GLY  54 -11.311   5.057 -10.137
  380    H    ASP  55           H        ASP  55  -9.446   6.646  -9.918
  381    HA   ASP  55           HA       ASP  55  -9.163   7.993 -12.431
  382   1HB   ASP  55          2HB       ASP  55  -8.154   8.617  -9.653
  383   2HB   ASP  55          1HB       ASP  55  -7.852   9.655 -11.044
  384    H    GLY  56           H        GLY  56  -6.566   7.412 -10.060
  385   1HA   GLY  56          2HA       GLY  56  -4.808   5.768 -10.952
  386   2HA   GLY  56          1HA       GLY  56  -4.775   6.858 -12.331
  387    H    SER  57           H        SER  57  -5.389   8.856  -9.875
  388    HA   SER  57           HA       SER  57  -2.862  10.056  -9.845
  389   1HB   SER  57          2HB       SER  57  -4.942  10.336  -7.670
  390   2HB   SER  57          1HB       SER  57  -3.725  11.517  -8.155
  391    HG   SER  57           HG       SER  57  -5.391  12.233  -9.270
  392    H    THR  58           H        THR  58  -1.905  10.573  -7.464
  393    HA   THR  58           HA       THR  58  -1.691   8.124  -5.905
  394    HB   THR  58           HB       THR  58   0.973   8.905  -6.147
  395    HG1  THR  58           1HG      THR  58   0.079   8.455  -8.774
  396   1HG2  THR  58          1HG2      THR  58   0.902   6.721  -7.684
  397   2HG2  THR  58          2HG2      THR  58  -0.712   6.610  -6.977
  398   3HG2  THR  58          3HG2      THR  58   0.711   6.658  -5.932
  399    H    TYR  59           H        TYR  59  -0.567   8.394  -3.893
  400    HA   TYR  59           HA       TYR  59  -0.178  11.168  -3.026
  401   1HB   TYR  59          2HB       TYR  59  -1.582   9.195  -1.241
  402   2HB   TYR  59          1HB       TYR  59  -1.523  10.948  -1.110
  403    HD1  TYR  59           1HD      TYR  59  -3.121   8.108  -2.788
  404    HD2  TYR  59           2HD      TYR  59  -3.019  12.344  -2.408
  405    HE1  TYR  59           1HE      TYR  59  -5.284   8.258  -3.948
  406    HE2  TYR  59           2HE      TYR  59  -5.183  12.506  -3.567
  407    HH   TYR  59           HH       TYR  59  -6.641   9.776  -5.130
  408    H    TYR  60           H        TYR  60   1.762  11.378  -2.122
  409    HA   TYR  60           HA       TYR  60   2.958   9.022  -0.813
  410   1HB   TYR  60          2HB       TYR  60   4.265  11.146  -2.512
  411   2HB   TYR  60          1HB       TYR  60   5.181  10.071  -1.464
  412    HD1  TYR  60           1HD      TYR  60   5.979   8.079  -2.332
  413    HD2  TYR  60           2HD      TYR  60   2.655   9.953  -4.213
  414    HE1  TYR  60           1HE      TYR  60   6.055   6.400  -4.127
  415    HE2  TYR  60           2HE      TYR  60   2.723   8.277  -6.012
  416    HH   TYR  60           HH       TYR  60   5.299   6.308  -6.596
  417    H    ALA  61           H        ALA  61   4.588   9.558   0.844
  418    HA   ALA  61           HA       ALA  61   3.548  11.475   2.688
  419   1HB   ALA  61          1HB       ALA  61   6.113  10.565   3.514
  420   2HB   ALA  61          2HB       ALA  61   5.244   9.206   2.801
  421   3HB   ALA  61          3HB       ALA  61   4.528  10.107   4.137
  422    H    ASP  62           H        ASP  62   5.110  12.106   0.011
  423    HA   ASP  62           HA       ASP  62   6.162  13.957  -0.781
  424   1HB   ASP  62          2HB       ASP  62   6.277  14.868   2.101
  425   2HB   ASP  62          1HB       ASP  62   6.682  15.852   0.697
  426    H    SER  63           H        SER  63   7.589  12.609   2.172
  427    HA   SER  63           HA       SER  63  10.269  13.240   1.319
  428   1HB   SER  63          2HB       SER  63   9.460  13.104   3.745
  429   2HB   SER  63          1HB       SER  63   9.505  11.353   3.547
  430    HG   SER  63           HG       SER  63  11.795  12.408   2.651
  431    H    VAL  64           H        VAL  64   8.189  11.187   0.075
  432    HA   VAL  64           HA       VAL  64  10.227   9.131  -0.461
  433    HB   VAL  64           HB       VAL  64   8.167   7.607  -0.869
  434   1HG1  VAL  64          1HG1      VAL  64   8.079   7.494   1.865
  435   2HG1  VAL  64          2HG1      VAL  64   9.623   8.293   1.567
  436   3HG1  VAL  64          3HG1      VAL  64   9.293   6.718   0.848
  437   1HG2  VAL  64          1HG2      VAL  64   6.173   8.501  -0.476
  438   2HG2  VAL  64          2HG2      VAL  64   6.914   9.985   0.123
  439   3HG2  VAL  64          3HG2      VAL  64   6.610   8.644   1.227
  440    H    LYS  65           H        LYS  65   8.269  11.535  -1.719
  441    HA   LYS  65           HA       LYS  65   7.473  10.474  -4.193
  442   1HB   LYS  65          2HB       LYS  65   7.963  13.232  -3.148
  443   2HB   LYS  65          1HB       LYS  65   7.761  13.012  -4.881
  444   1HG   LYS  65          2HG       LYS  65   5.778  12.042  -2.840
  445   2HG   LYS  65          1HG       LYS  65   5.683  13.615  -3.633
  446   1HD   LYS  65          2HD       LYS  65   5.946  11.172  -5.322
  447   2HD   LYS  65          1HD       LYS  65   4.381  11.526  -4.583
  448   1HE   LYS  65          2HE       LYS  65   5.346  13.944  -5.671
  449   2HE   LYS  65          1HE       LYS  65   5.598  12.701  -6.894
  450   1HZ   LYS  65          1HZ       LYS  65   3.422  13.734  -7.100
  451   2HZ   LYS  65          2HZ       LYS  65   3.025  13.272  -5.523
  452   3HZ   LYS  65          3HZ       LYS  65   3.270  12.095  -6.712
  453    H    GLY  66           H        GLY  66   8.576   9.956  -5.980
  454   1HA   GLY  66          2HA       GLY  66  10.268  10.066  -7.591
  455   2HA   GLY  66          1HA       GLY  66  11.118  11.226  -6.577
  456    H    ARG  67           H        ARG  67  10.683   9.325  -4.270
  457    HA   ARG  67           HA       ARG  67  13.174   7.916  -4.543
  458   1HB   ARG  67          2HB       ARG  67  12.388   9.014  -2.429
  459   2HB   ARG  67          1HB       ARG  67  11.150   7.775  -2.302
  460   1HG   ARG  67          2HG       ARG  67  12.685   6.783  -0.996
  461   2HG   ARG  67          1HG       ARG  67  13.320   6.220  -2.546
  462   1HD   ARG  67          2HD       ARG  67  15.092   7.145  -1.137
  463   2HD   ARG  67          1HD       ARG  67  14.873   8.090  -2.610
  464    HE   ARG  67           HE       ARG  67  13.490   9.011  -0.217
  465   1HH1  ARG  67          1HH1      ARG  67  16.182   9.352  -2.404
  466   2HH1  ARG  67          2HH1      ARG  67  16.542  10.972  -1.911
  467   1HH2  ARG  67          1HH2      ARG  67  13.952  11.144   0.432
  468   2HH2  ARG  67          2HH2      ARG  67  15.274  11.990  -0.298
  469    H    PHE  68           H        PHE  68   9.911   6.843  -3.611
  470    HA   PHE  68           HA       PHE  68  10.506   4.232  -4.833
  471   1HB   PHE  68          2HB       PHE  68   8.528   4.909  -2.647
  472   2HB   PHE  68          1HB       PHE  68   8.802   3.305  -3.313
  473    HD1  PHE  68           1HD      PHE  68   8.945   3.905  -0.436
  474    HD2  PHE  68           2HD      PHE  68  11.956   4.069  -3.438
  475    HE1  PHE  68           1HE      PHE  68  10.665   3.494   1.271
  476    HE2  PHE  68           2HE      PHE  68  13.681   3.655  -1.733
  477    HZ   PHE  68           HZ       PHE  68  13.031   3.365   0.623
  478    H    THR  69           H        THR  69   8.856   3.164  -5.992
  479    HA   THR  69           HA       THR  69   6.739   4.944  -7.011
  480    HB   THR  69           HB       THR  69   8.306   2.820  -8.490
  481    HG1  THR  69           1HG      THR  69   9.408   4.538  -9.034
  482   1HG2  THR  69          1HG2      THR  69   6.004   4.442  -9.572
  483   2HG2  THR  69          2HG2      THR  69   5.842   2.779  -9.004
  484   3HG2  THR  69          3HG2      THR  69   6.881   3.145 -10.382
  485    H    ILE  70           H        ILE  70   4.804   4.321  -6.412
  486    HA   ILE  70           HA       ILE  70   4.370   1.527  -5.668
  487    HB   ILE  70           HB       ILE  70   3.860   3.532  -4.134
  488   1HG1  ILE  70          2HG1      ILE  70   2.757   0.967  -4.379
  489   2HG1  ILE  70          1HG1      ILE  70   2.795   1.983  -2.942
  490   1HG2  ILE  70          1HG2      ILE  70   1.452   3.680  -5.933
  491   2HG2  ILE  70          2HG2      ILE  70   2.675   4.927  -5.687
  492   3HG2  ILE  70          3HG2      ILE  70   1.598   4.475  -4.365
  493   1HD1  ILE  70          1HD1      ILE  70   0.574   1.373  -3.143
  494   2HD1  ILE  70          2HD1      ILE  70   0.573   1.577  -4.897
  495   3HD1  ILE  70          3HD1      ILE  70   0.623   2.990  -3.843
  496    H    SER  71           H        SER  71   3.288   0.222  -6.953
  497    HA   SER  71           HA       SER  71   1.344   1.330  -8.851
  498   1HB   SER  71          2HB       SER  71   3.039   1.000 -10.373
  499   2HB   SER  71          1HB       SER  71   3.769  -0.304  -9.438
  500    HG   SER  71           HG       SER  71   2.260  -1.708 -10.211
  501    H    ARG  72           H        ARG  72  -0.045  -0.396  -9.814
  502    HA   ARG  72           HA       ARG  72  -0.353  -2.783  -8.159
  503   1HB   ARG  72          2HB       ARG  72  -1.808  -0.544  -7.555
  504   2HB   ARG  72          1HB       ARG  72  -2.894  -1.385  -8.652
  505   1HG   ARG  72          2HG       ARG  72  -2.703  -3.396  -7.228
  506   2HG   ARG  72          1HG       ARG  72  -1.720  -2.460  -6.099
  507   1HD   ARG  72          2HD       ARG  72  -4.230  -2.682  -5.612
  508   2HD   ARG  72          1HD       ARG  72  -3.501  -1.082  -5.500
  509    HE   ARG  72           HE       ARG  72  -4.880  -1.910  -7.959
  510   1HH1  ARG  72          1HH1      ARG  72  -4.600   0.210  -5.205
  511   2HH1  ARG  72          2HH1      ARG  72  -5.738   1.363  -5.817
  512   1HH2  ARG  72          1HH2      ARG  72  -6.376  -0.395  -8.769
  513   2HH2  ARG  72          2HH2      ARG  72  -6.747   1.020  -7.841
  514    H    ASP  73           H        ASP  73  -1.990  -4.278  -9.060
  515    HA   ASP  73           HA       ASP  73  -2.128  -4.029 -11.992
  516   1HB   ASP  73          2HB       ASP  73  -0.727  -5.912 -10.883
  517   2HB   ASP  73          1HB       ASP  73  -2.284  -6.651 -10.527
  518    H    ASN  74           H        ASN  74  -4.073  -4.078 -12.941
  519    HA   ASN  74           HA       ASN  74  -6.425  -4.260 -11.247
  520   1HB   ASN  74          2HB       ASN  74  -6.029  -3.460 -14.132
  521   2HB   ASN  74          1HB       ASN  74  -7.613  -3.557 -13.370
  522   1HD2  ASN  74          1HD2      ASN  74  -4.484  -1.969 -13.237
  523   2HD2  ASN  74          2HD2      ASN  74  -5.039  -0.531 -12.457
  524    H    ALA  75           H        ALA  75  -4.923  -6.700 -11.800
  525    HA   ALA  75           HA       ALA  75  -7.153  -8.294 -12.772
  526   1HB   ALA  75          1HB       ALA  75  -5.223  -9.602 -14.105
  527   2HB   ALA  75          2HB       ALA  75  -4.625  -7.948 -14.249
  528   3HB   ALA  75          3HB       ALA  75  -6.238  -8.356 -14.833
  529    H    LYS  76           H        LYS  76  -5.339  -7.793 -10.307
  530    HA   LYS  76           HA       LYS  76  -5.496 -10.430  -9.289
  531   1HB   LYS  76          2HB       LYS  76  -2.929 -10.540  -8.851
  532   2HB   LYS  76          1HB       LYS  76  -3.570 -11.081 -10.395
  533   1HG   LYS  76          2HG       LYS  76  -2.615  -9.384 -11.547
  534   2HG   LYS  76          1HG       LYS  76  -2.769  -8.242 -10.211
  535   1HD   LYS  76          2HD       LYS  76  -0.617  -8.564  -9.754
  536   2HD   LYS  76          1HD       LYS  76  -0.994 -10.237  -9.337
  537   1HE   LYS  76          2HE       LYS  76  -0.898 -10.048 -12.163
  538   2HE   LYS  76          1HE       LYS  76   0.534  -9.242 -11.524
  539   1HZ   LYS  76          1HZ       LYS  76  -0.305 -12.050 -11.189
  540   2HZ   LYS  76          2HZ       LYS  76   0.764 -11.334 -10.092
  541   3HZ   LYS  76          3HZ       LYS  76   1.180 -11.443 -11.728
  542    H    ASN  77           H        ASN  77  -4.468 -10.594  -7.086
  543    HA   ASN  77           HA       ASN  77  -4.821  -8.032  -5.701
  544   1HB   ASN  77          2HB       ASN  77  -4.686  -9.833  -3.694
  545   2HB   ASN  77          1HB       ASN  77  -6.182  -9.420  -4.523
  546   1HD2  ASN  77          1HD2      ASN  77  -7.314 -11.218  -4.681
  547   2HD2  ASN  77          2HD2      ASN  77  -6.728 -12.735  -5.261
  548    H    THR  78           H        THR  78  -2.653  -7.319  -6.357
  549    HA   THR  78           HA       THR  78  -0.688  -8.105  -4.372
  550    HB   THR  78           HB       THR  78   0.438  -8.018  -7.110
  551    HG1  THR  78           1HG      THR  78  -0.049 -10.356  -7.240
  552   1HG2  THR  78          1HG2      THR  78   2.195  -8.891  -6.046
  553   2HG2  THR  78          2HG2      THR  78   1.220 -10.219  -5.416
  554   3HG2  THR  78          3HG2      THR  78   1.305  -8.693  -4.536
  555    H    LEU  79           H        LEU  79   0.791  -6.544  -3.895
  556    HA   LEU  79           HA       LEU  79   0.437  -3.950  -5.238
  557   1HB   LEU  79          2HB       LEU  79   0.324  -4.672  -2.513
  558   2HB   LEU  79          1HB       LEU  79   1.816  -3.776  -2.712
  559    HG   LEU  79           HG       LEU  79  -0.982  -2.843  -3.233
  560   1HD1  LEU  79          1HD1      LEU  79  -0.095  -0.947  -1.732
  561   2HD1  LEU  79          2HD1      LEU  79   1.167  -2.105  -1.307
  562   3HD1  LEU  79          3HD1      LEU  79  -0.524  -2.492  -0.997
  563   1HD2  LEU  79          1HD2      LEU  79   1.423  -1.175  -3.826
  564   2HD2  LEU  79          2HD2      LEU  79  -0.260  -0.888  -4.266
  565   3HD2  LEU  79          3HD2      LEU  79   0.650  -2.172  -5.059
  566    H    TYR  80           H        TYR  80   2.256  -2.759  -5.842
  567    HA   TYR  80           HA       TYR  80   4.848  -4.107  -5.534
  568   1HB   TYR  80          2HB       TYR  80   3.779  -2.885  -8.086
  569   2HB   TYR  80          1HB       TYR  80   5.406  -3.520  -7.866
  570    HD1  TYR  80           1HD      TYR  80   5.857  -5.793  -8.185
  571    HD2  TYR  80           2HD      TYR  80   1.824  -4.487  -7.842
  572    HE1  TYR  80           1HE      TYR  80   5.087  -8.030  -8.837
  573    HE2  TYR  80           2HE      TYR  80   1.034  -6.718  -8.489
  574    HH   TYR  80           HH       TYR  80   1.681  -8.903  -8.744
  575    H    LEU  81           H        LEU  81   6.662  -2.794  -5.523
  576    HA   LEU  81           HA       LEU  81   6.388   0.059  -5.780
  577   1HB   LEU  81          2HB       LEU  81   5.668  -0.269  -3.469
  578   2HB   LEU  81          1HB       LEU  81   7.141  -1.146  -3.115
  579    HG   LEU  81           HG       LEU  81   8.263   1.125  -3.945
  580   1HD1  LEU  81          1HD1      LEU  81   5.473   1.765  -3.746
  581   2HD1  LEU  81          2HD1      LEU  81   6.817   2.775  -4.276
  582   3HD1  LEU  81          3HD1      LEU  81   6.395   2.697  -2.563
  583   1HD2  LEU  81          1HD2      LEU  81   7.712  -0.077  -1.468
  584   2HD2  LEU  81          2HD2      LEU  81   7.350   1.641  -1.287
  585   3HD2  LEU  81          3HD2      LEU  81   8.946   1.130  -1.839
  586    H    GLN  82           H        GLN  82   8.245   0.984  -6.435
  587    HA   GLN  82           HA       GLN  82  10.574  -0.785  -6.667
  588   1HB   GLN  82          2HB       GLN  82   9.742   0.046  -8.786
  589   2HB   GLN  82          1HB       GLN  82   9.803   1.703  -8.201
  590   1HG   GLN  82          2HG       GLN  82  11.659   1.190  -9.700
  591   2HG   GLN  82          1HG       GLN  82  12.215   1.610  -8.081
  592   1HE2  GLN  82          1HE2      GLN  82  11.718  -1.003 -10.351
  593   2HE2  GLN  82          2HE2      GLN  82  12.802  -2.119  -9.602
  594    H    MET  83           H        MET  83  12.075  -0.499  -5.195
  595    HA   MET  83           HA       MET  83  12.342   2.021  -3.794
  596   1HB   MET  83          2HB       MET  83  14.133  -0.342  -3.371
  597   2HB   MET  83          1HB       MET  83  13.601   0.863  -2.209
  598   1HG   MET  83          2HG       MET  83  11.402  -0.669  -3.325
  599   2HG   MET  83          1HG       MET  83  12.593  -1.676  -2.504
  600   1HE   MET  83          1HE       MET  83  10.289  -2.220  -0.660
  601   2HE   MET  83          2HE       MET  83  11.111  -1.698   0.811
  602   3HE   MET  83          3HE       MET  83  12.028  -2.461  -0.488
  603    H    ASN  84           H        ASN  84  13.261   3.482  -5.160
  604    HA   ASN  84           HA       ASN  84  15.954   2.834  -6.164
  605   1HB   ASN  84          2HB       ASN  84  13.721   3.655  -7.637
  606   2HB   ASN  84          1HB       ASN  84  14.729   5.093  -7.504
  607   1HD2  ASN  84          1HD2      ASN  84  14.056   2.796  -9.554
  608   2HD2  ASN  84          2HD2      ASN  84  15.594   2.513 -10.286
  609    H    SER  85           H        SER  85  17.342   4.827  -6.447
  610    HA   SER  85           HA       SER  85  18.495   6.524  -5.463
  611   1HB   SER  85          2HB       SER  85  15.704   7.383  -5.587
  612   2HB   SER  85          1HB       SER  85  16.609   8.192  -4.308
  613    HG   SER  85           HG       SER  85  16.666   9.172  -6.479
  614    H    LEU  86           H        LEU  86  18.343   4.271  -3.915
  615    HA   LEU  86           HA       LEU  86  17.403   4.618  -1.300
  616   1HB   LEU  86          2HB       LEU  86  19.780   2.984  -2.194
  617   2HB   LEU  86          1HB       LEU  86  18.899   2.790  -0.694
  618    HG   LEU  86           HG       LEU  86  18.081   1.052  -1.986
  619   1HD1  LEU  86          1HD1      LEU  86  16.142   2.034  -1.165
  620   2HD1  LEU  86          2HD1      LEU  86  15.806   1.833  -2.885
  621   3HD1  LEU  86          3HD1      LEU  86  16.262   3.415  -2.254
  622   1HD2  LEU  86          1HD2      LEU  86  18.640   2.863  -4.227
  623   2HD2  LEU  86          2HD2      LEU  86  17.236   1.817  -4.438
  624   3HD2  LEU  86          3HD2      LEU  86  18.818   1.113  -4.103
  625    H    LYS  87           H        LYS  87  18.414   5.263   0.610
  626    HA   LYS  87           HA       LYS  87  21.098   6.306   0.587
  627   1HB   LYS  87          2HB       LYS  87  20.239   8.586   1.434
  628   2HB   LYS  87          1HB       LYS  87  20.211   8.275  -0.295
  629   1HG   LYS  87          2HG       LYS  87  18.091   8.932  -0.234
  630   2HG   LYS  87          1HG       LYS  87  17.744   7.386   0.542
  631   1HD   LYS  87          2HD       LYS  87  17.179   8.408   2.435
  632   2HD   LYS  87          1HD       LYS  87  18.726   9.257   2.484
  633   1HE   LYS  87          2HE       LYS  87  16.884  10.340   0.504
  634   2HE   LYS  87          1HE       LYS  87  16.251  10.414   2.148
  635   1HZ   LYS  87          1HZ       LYS  87  17.855  11.862   2.800
  636   2HZ   LYS  87          2HZ       LYS  87  17.779  12.298   1.167
  637   3HZ   LYS  87          3HZ       LYS  87  19.011  11.275   1.713
  638    H    SER  88           H        SER  88  20.249   4.270   2.074
  639    HA   SER  88           HA       SER  88  20.233   3.459   4.194
  640   1HB   SER  88          2HB       SER  88  20.749   6.236   5.240
  641   2HB   SER  88          1HB       SER  88  21.256   4.691   5.924
  642    HG   SER  88           HG       SER  88  22.312   6.114   3.748
  643    H    GLU  89           H        GLU  89  17.988   5.429   2.981
  644    HA   GLU  89           HA       GLU  89  16.383   5.728   5.401
  645   1HB   GLU  89          2HB       GLU  89  16.210   7.655   4.104
  646   2HB   GLU  89          1HB       GLU  89  16.200   6.759   2.592
  647   1HG   GLU  89          2HG       GLU  89  14.007   7.007   2.544
  648   2HG   GLU  89          1HG       GLU  89  13.903   5.939   3.942
  649    H    ASP  90           H        ASP  90  16.469   3.969   2.372
  650    HA   ASP  90           HA       ASP  90  13.930   2.736   2.576
  651   1HB   ASP  90          2HB       ASP  90  14.906   2.744   0.432
  652   2HB   ASP  90          1HB       ASP  90  16.441   2.126   1.032
  653    H    THR  91           H        THR  91  16.904   2.197   4.177
  654    HA   THR  91           HA       THR  91  16.778  -0.554   4.708
  655    HB   THR  91           HB       THR  91  17.862   1.446   6.676
  656    HG1  THR  91           1HG      THR  91  19.850   1.090   5.286
  657   1HG2  THR  91          1HG2      THR  91  18.480  -0.468   7.657
  658   2HG2  THR  91          2HG2      THR  91  19.645  -0.638   6.344
  659   3HG2  THR  91          3HG2      THR  91  18.069  -1.423   6.233
  660    H    ALA  92           H        ALA  92  14.760  -1.272   5.295
  661    HA   ALA  92           HA       ALA  92  14.074  -1.234   8.014
  662   1HB   ALA  92          1HB       ALA  92  13.381   1.082   7.514
  663   2HB   ALA  92          2HB       ALA  92  12.032   0.063   8.020
  664   3HB   ALA  92          3HB       ALA  92  12.245   0.460   6.316
  665    H    VAL  93           H        VAL  93  11.375  -1.729   7.968
  666    HA   VAL  93           HA       VAL  93  11.211  -4.094   6.213
  667    HB   VAL  93           HB       VAL  93   9.645  -3.627   8.758
  668   1HG1  VAL  93          1HG1      VAL  93   9.988  -5.962   6.895
  669   2HG1  VAL  93          2HG1      VAL  93   8.497  -5.178   7.413
  670   3HG1  VAL  93          3HG1      VAL  93   9.418  -6.161   8.552
  671   1HG2  VAL  93          1HG2      VAL  93  11.790  -3.834   9.595
  672   2HG2  VAL  93          2HG2      VAL  93  12.308  -4.906   8.293
  673   3HG2  VAL  93          3HG2      VAL  93  11.246  -5.512   9.565
  674    H    TYR  94           H        TYR  94   9.717  -4.053   4.637
  675    HA   TYR  94           HA       TYR  94   7.697  -1.930   4.773
  676   1HB   TYR  94          2HB       TYR  94   8.872  -3.414   2.427
  677   2HB   TYR  94          1HB       TYR  94   7.504  -2.313   2.289
  678    HD1  TYR  94           1HD      TYR  94  10.981  -2.393   3.655
  679    HD2  TYR  94           2HD      TYR  94   7.929  -0.094   1.782
  680    HE1  TYR  94           1HE      TYR  94  12.531  -0.496   3.472
  681    HE2  TYR  94           2HE      TYR  94   9.474   1.813   1.597
  682    HH   TYR  94           HH       TYR  94  11.982   2.312   3.256
  683    H    TYR  95           H        TYR  95   5.586  -2.259   4.501
  684    HA   TYR  95           HA       TYR  95   4.587  -4.982   4.092
  685   1HB   TYR  95          2HB       TYR  95   3.121  -3.258   6.030
  686   2HB   TYR  95          1HB       TYR  95   3.262  -5.009   5.972
  687    HD1  TYR  95           1HD      TYR  95   4.865  -1.897   7.121
  688    HD2  TYR  95           2HD      TYR  95   5.028  -6.150   7.125
  689    HE1  TYR  95           1HE      TYR  95   6.513  -1.826   8.938
  690    HE2  TYR  95           2HE      TYR  95   6.681  -6.088   8.944
  691    HH   TYR  95           HH       TYR  95   7.321  -3.310  10.752
  692    H    CYS  96           H        CYS  96   2.210  -4.941   3.587
  693    HA   CYS  96           HA       CYS  96   1.395  -2.442   2.279
  694   1HB   CYS  96          2HB       CYS  96   0.940  -3.450   0.272
  695   2HB   CYS  96          1HB       CYS  96   2.260  -4.492   0.791
  696    H    ALA  97           H        ALA  97  -0.803  -1.968   2.449
  697    HA   ALA  97           HA       ALA  97  -2.573  -3.962   3.602
  698   1HB   ALA  97          1HB       ALA  97  -1.692  -3.230   5.630
  699   2HB   ALA  97          2HB       ALA  97  -3.207  -2.343   5.465
  700   3HB   ALA  97          3HB       ALA  97  -1.673  -1.542   5.120
  701    H    LYS  98           H        LYS  98  -4.779  -3.164   3.934
  702    HA   LYS  98           HA       LYS  98  -5.611  -1.566   1.665
  703   1HB   LYS  98          2HB       LYS  98  -6.926  -3.491   1.935
  704   2HB   LYS  98          1HB       LYS  98  -7.008  -3.308   3.678
  705   1HG   LYS  98          2HG       LYS  98  -8.233  -1.024   2.647
  706   2HG   LYS  98          1HG       LYS  98  -8.811  -2.361   1.652
  707   1HD   LYS  98          2HD       LYS  98 -10.338  -2.443   3.357
  708   2HD   LYS  98          1HD       LYS  98  -9.103  -3.529   4.000
  709   1HE   LYS  98          2HE       LYS  98  -8.698  -2.181   5.726
  710   2HE   LYS  98          1HE       LYS  98  -8.554  -0.772   4.675
  711   1HZ   LYS  98          1HZ       LYS  98 -10.392  -0.153   5.794
  712   2HZ   LYS  98          2HZ       LYS  98 -10.845  -1.735   6.183
  713   3HZ   LYS  98          3HZ       LYS  98 -11.180  -1.115   4.647
  714    H    TYR  99           H        TYR  99  -6.733   0.372   1.776
  715    HA   TYR  99           HA       TYR  99  -6.315   1.888   4.220
  716   1HB   TYR  99          2HB       TYR  99  -6.354   2.513   1.450
  717   2HB   TYR  99          1HB       TYR  99  -7.652   3.426   2.212
  718    HD1  TYR  99           1HD      TYR  99  -7.163   5.136   3.876
  719    HD2  TYR  99           2HD      TYR  99  -4.033   2.943   2.007
  720    HE1  TYR  99           1HE      TYR  99  -5.529   6.779   4.699
  721    HE2  TYR  99           2HE      TYR  99  -2.392   4.581   2.823
  722    HH   TYR  99           HH       TYR  99  -2.336   6.923   3.563
  723    H    SER 100           H        SER 100  -7.938   3.005   5.329
  724    HA   SER 100           HA       SER 100 -10.675   2.027   4.839
  725   1HB   SER 100          2HB       SER 100 -10.095   2.856   7.590
  726   2HB   SER 100          1HB       SER 100 -10.899   1.403   6.998
  727    HG   SER 100           HG       SER 100  -8.933   0.895   8.023
  728    H    GLY 101           H        GLY 101  -8.701   4.669   6.134
  729   1HA   GLY 101          2HA       GLY 101 -10.703   6.571   5.183
  730   2HA   GLY 101          1HA       GLY 101 -10.336   6.599   6.901
  731    H    GLY 102           H        GLY 102  -8.102   7.037   7.534
  732   1HA   GLY 102          2HA       GLY 102  -6.589   8.503   5.471
  733   2HA   GLY 102          1HA       GLY 102  -6.919   9.244   7.030
  734    H    ALA 103           H        ALA 103  -6.500   6.001   7.536
  735    HA   ALA 103           HA       ALA 103  -3.585   6.206   7.838
  736   1HB   ALA 103          1HB       ALA 103  -4.135   4.843  10.067
  737   2HB   ALA 103          2HB       ALA 103  -5.598   5.824   9.974
  738   3HB   ALA 103          3HB       ALA 103  -4.016   6.602  10.030
  739    H    LEU 104           H        LEU 104  -2.513   4.116   8.070
  740    HA   LEU 104           HA       LEU 104  -4.070   1.975   6.782
  741   1HB   LEU 104          2HB       LEU 104  -1.992   3.009   5.637
  742   2HB   LEU 104          1HB       LEU 104  -1.070   2.080   6.808
  743    HG   LEU 104           HG       LEU 104  -2.217   0.015   5.973
  744   1HD1  LEU 104          1HD1      LEU 104  -3.146   0.356   3.589
  745   2HD1  LEU 104          2HD1      LEU 104  -3.391   2.024   4.107
  746   3HD1  LEU 104          3HD1      LEU 104  -4.181   0.705   4.974
  747   1HD2  LEU 104          1HD2      LEU 104  -0.214  -0.044   4.985
  748   2HD2  LEU 104          2HD2      LEU 104  -0.293   1.652   4.502
  749   3HD2  LEU 104          3HD2      LEU 104  -1.100   0.420   3.533
  750    H    ASP 105           H        ASP 105  -3.556  -0.223   7.346
  751    HA   ASP 105           HA       ASP 105  -2.983  -0.479  10.205
  752   1HB   ASP 105          2HB       ASP 105  -4.959  -1.581   8.567
  753   2HB   ASP 105          1HB       ASP 105  -3.851  -2.912   8.883
  754    H    ALA 106           H        ALA 106  -1.550  -0.882   7.215
  755    HA   ALA 106           HA       ALA 106   0.526  -1.541   6.610
  756   1HB   ALA 106          1HB       ALA 106   0.964  -2.591   9.382
  757   2HB   ALA 106          2HB       ALA 106   1.138  -0.892   8.941
  758   3HB   ALA 106          3HB       ALA 106   2.176  -2.109   8.194
  759    H    TRP 107           H        TRP 107  -0.793  -4.032   8.802
  760    HA   TRP 107           HA       TRP 107  -0.824  -6.314   8.619
  761   1HB   TRP 107          2HB       TRP 107  -1.683  -5.549   5.818
  762   2HB   TRP 107          1HB       TRP 107  -1.948  -7.117   6.572
  763    HD1  TRP 107           HD       TRP 107  -2.631  -5.134   9.377
  764    HE1  TRP 107           1HE      TRP 107  -5.109  -4.456   9.567
  765    HE3  TRP 107           3HE      TRP 107  -4.090  -6.078   4.583
  766    HZ2  TRP 107           2HZ      TRP 107  -7.382  -4.325   7.887
  767    HZ3  TRP 107           3HZ      TRP 107  -6.426  -5.645   3.946
  768    HH2  TRP 107           HH       TRP 107  -8.038  -4.789   5.567
  769    H    GLY 108           H        GLY 108  -0.435  -7.816   6.099
  770   1HA   GLY 108          2HA       GLY 108   1.239  -8.741   4.826
  771   2HA   GLY 108          1HA       GLY 108   2.212  -7.318   5.156
  772    H    GLN 109           H        GLN 109   3.472  -9.682   5.038
  773    HA   GLN 109           HA       GLN 109   3.700 -10.842   7.677
  774   1HB   GLN 109          2HB       GLN 109   4.881 -11.413   4.991
  775   2HB   GLN 109          1HB       GLN 109   5.664 -12.065   6.424
  776   1HG   GLN 109          2HG       GLN 109   3.328 -12.954   7.030
  777   2HG   GLN 109          1HG       GLN 109   2.940 -12.645   5.338
  778   1HE2  GLN 109          1HE2      GLN 109   2.631 -14.835   4.936
  779   2HE2  GLN 109          2HE2      GLN 109   3.953 -15.940   4.814
  780    H    GLY 110           H        GLY 110   5.609  -8.750   5.561
  781   1HA   GLY 110          2HA       GLY 110   6.914  -6.995   6.668
  782   2HA   GLY 110          1HA       GLY 110   7.340  -8.185   7.887
  783    H    THR 111           H        THR 111   8.003  -6.962   4.702
  784    HA   THR 111           HA       THR 111  10.040  -8.969   4.192
  785    HB   THR 111           HB       THR 111   8.774  -8.164   2.275
  786    HG1  THR 111           1HG      THR 111  10.945  -8.732   1.890
  787   1HG2  THR 111          1HG2      THR 111   9.287  -5.781   1.483
  788   2HG2  THR 111          2HG2      THR 111   9.790  -5.474   3.145
  789   3HG2  THR 111          3HG2      THR 111   8.133  -5.969   2.803
  790    H    GLN 112           H        GLN 112  12.116  -8.781   4.724
  791    HA   GLN 112           HA       GLN 112  12.998  -6.401   6.106
  792   1HB   GLN 112          2HB       GLN 112  13.487  -8.804   6.811
  793   2HB   GLN 112          1HB       GLN 112  14.666  -8.835   5.508
  794   1HG   GLN 112          2HG       GLN 112  15.748  -8.340   7.605
  795   2HG   GLN 112          1HG       GLN 112  15.836  -6.945   6.531
  796   1HE2  GLN 112          1HE2      GLN 112  15.672  -5.150   7.654
  797   2HE2  GLN 112          2HE2      GLN 112  14.587  -4.861   8.967
  798    H    VAL 113           H        VAL 113  13.643  -4.734   4.942
  799    HA   VAL 113           HA       VAL 113  15.323  -5.215   2.569
  800    HB   VAL 113           HB       VAL 113  13.702  -2.746   3.221
  801   1HG1  VAL 113          1HG1      VAL 113  14.464  -1.791   1.291
  802   2HG1  VAL 113          2HG1      VAL 113  14.775  -3.343   0.513
  803   3HG1  VAL 113          3HG1      VAL 113  15.886  -2.731   1.738
  804   1HG2  VAL 113          1HG2      VAL 113  12.445  -3.598   1.104
  805   2HG2  VAL 113          2HG2      VAL 113  12.067  -4.284   2.684
  806   3HG2  VAL 113          3HG2      VAL 113  13.110  -5.164   1.567
  807    H    THR 114           H        THR 114  17.364  -4.418   2.545
  808    HA   THR 114           HA       THR 114  18.114  -2.426   4.566
  809    HB   THR 114           HB       THR 114  19.900  -4.794   4.084
  810    HG1  THR 114           1HG      THR 114  18.931  -5.835   5.800
  811   1HG2  THR 114          1HG2      THR 114  20.207  -2.400   5.456
  812   2HG2  THR 114          2HG2      THR 114  21.214  -3.839   5.622
  813   3HG2  THR 114          3HG2      THR 114  19.858  -3.580   6.720
  814    H    VAL 115           H        VAL 115  20.065  -1.295   4.128
  815    HA   VAL 115           HA       VAL 115  20.988  -1.479   1.335
  816    HB   VAL 115           HB       VAL 115  20.859   1.128   2.831
  817   1HG1  VAL 115          1HG1      VAL 115  20.495   1.213  -0.027
  818   2HG1  VAL 115          2HG1      VAL 115  21.970   0.344   0.397
  819   3HG1  VAL 115          3HG1      VAL 115  21.720   1.992   0.973
  820   1HG2  VAL 115          1HG2      VAL 115  18.785   1.218   1.024
  821   2HG2  VAL 115          2HG2      VAL 115  18.630   1.023   2.770
  822   3HG2  VAL 115          3HG2      VAL 115  18.641  -0.396   1.722
  823    H    SER 116           H        SER 116  23.170  -1.258   0.987
  824    HA   SER 116           HA       SER 116  24.943  -0.340   3.061
  825   1HB   SER 116          2HB       SER 116  26.116  -2.383   3.471
  826   2HB   SER 116          1HB       SER 116  24.402  -2.729   3.699
  827    HG   SER 116           HG       SER 116  25.005  -3.139   1.143
  828    H    SER 117           H        SER 117  27.090  -0.047   2.352
  829    HA   SER 117           HA       SER 117  27.427  -0.260  -0.567
  830   1HB   SER 117          2HB       SER 117  27.589   1.997  -0.424
  831   2HB   SER 117          1HB       SER 117  27.894   1.961   1.312
  832    HG   SER 117           HG       SER 117  29.757   1.516  -0.780
  833    H    GLN 118           H        GLN 118  28.750  -1.898  -1.002
  834    HA   GLN 118           HA       GLN 118  31.368  -1.973   0.252
  835   1HB   GLN 118          2HB       GLN 118  30.911  -4.610   0.391
  836   2HB   GLN 118          1HB       GLN 118  30.620  -3.521   1.741
  837   1HG   GLN 118          2HG       GLN 118  28.479  -4.064   1.771
  838   2HG   GLN 118          1HG       GLN 118  28.299  -3.602   0.080
  839   1HE2  GLN 118          1HE2      GLN 118  26.771  -5.597   0.954
  840   2HE2  GLN 118          2HE2      GLN 118  27.320  -7.120   0.354
  841    H    SER 119           H        SER 119  31.363  -1.169  -2.135
  842    HA   SER 119           HA       SER 119  31.316  -3.322  -4.082
  843   1HB   SER 119          2HB       SER 119  30.812  -0.609  -4.244
  844   2HB   SER 119          1HB       SER 119  32.406  -0.758  -4.983
  845    HG   SER 119           HG       SER 119  29.948  -1.695  -5.846
  846    H    GLU 120           H        GLU 120  33.086  -4.285  -2.580
  847    HA   GLU 120           HA       GLU 120  35.234  -4.978  -2.321
  848   1HB   GLU 120          2HB       GLU 120  35.282  -3.868  -5.110
  849   2HB   GLU 120          1HB       GLU 120  36.758  -4.474  -4.370
  850   1HG   GLU 120          2HG       GLU 120  36.199  -6.550  -4.866
  851   2HG   GLU 120          1HG       GLU 120  34.677  -6.385  -3.990
  852    H    GLN 121           H        GLN 121  34.376  -2.180  -1.584
  853    HA   GLN 121           HA       GLN 121  37.072  -1.175  -1.043
  854   1HB   GLN 121          2HB       GLN 121  35.852  -0.032  -3.059
  855   2HB   GLN 121          1HB       GLN 121  34.931   0.779  -1.800
  856   1HG   GLN 121          2HG       GLN 121  36.935   1.732  -0.876
  857   2HG   GLN 121          1HG       GLN 121  37.933   0.816  -2.006
  858   1HE2  GLN 121          1HE2      GLN 121  34.937   2.623  -2.514
  859   2HE2  GLN 121          2HE2      GLN 121  35.585   3.715  -3.684
  860    H    LYS 122           H        LYS 122  37.310  -0.764   1.048
  861    HA   LYS 122           HA       LYS 122  35.013  -0.778   2.798
  862   1HB   LYS 122          2HB       LYS 122  37.898  -1.137   3.060
  863   2HB   LYS 122          1HB       LYS 122  37.211  -0.175   4.363
  864   1HG   LYS 122          2HG       LYS 122  37.041  -2.295   5.215
  865   2HG   LYS 122          1HG       LYS 122  35.451  -2.087   4.478
  866   1HD   LYS 122          2HD       LYS 122  35.883  -3.574   2.801
  867   2HD   LYS 122          1HD       LYS 122  37.612  -3.222   2.790
  868   1HE   LYS 122          2HE       LYS 122  37.970  -5.046   4.000
  869   2HE   LYS 122          1HE       LYS 122  37.014  -4.348   5.306
  870   1HZ   LYS 122          1HZ       LYS 122  35.693  -5.719   3.054
  871   2HZ   LYS 122          2HZ       LYS 122  35.120  -5.458   4.623
  872   3HZ   LYS 122          3HZ       LYS 122  36.326  -6.610   4.347
  873    H    LEU 123           H        LEU 123  35.175   0.859   4.723
  874    HA   LEU 123           HA       LEU 123  35.579   3.554   3.602
  875   1HB   LEU 123          2HB       LEU 123  33.647   3.583   5.717
  876   2HB   LEU 123          1HB       LEU 123  33.472   4.105   4.053
  877    HG   LEU 123           HG       LEU 123  33.324   1.198   4.385
  878   1HD1  LEU 123          1HD1      LEU 123  31.231   2.960   5.650
  879   2HD1  LEU 123          2HD1      LEU 123  32.274   1.806   6.482
  880   3HD1  LEU 123          3HD1      LEU 123  31.060   1.233   5.338
  881   1HD2  LEU 123          1HD2      LEU 123  31.130   2.825   3.250
  882   2HD2  LEU 123          2HD2      LEU 123  31.894   1.358   2.636
  883   3HD2  LEU 123          3HD2      LEU 123  32.694   2.918   2.441
  884    H    ILE 124           H        ILE 124  37.740   3.140   4.601
  885    HA   ILE 124           HA       ILE 124  39.298   3.504   6.221
  886    HB   ILE 124           HB       ILE 124  37.169   5.207   7.517
  887   1HG1  ILE 124          2HG1      ILE 124  39.256   6.274   5.646
  888   2HG1  ILE 124          1HG1      ILE 124  37.777   5.579   4.990
  889   1HG2  ILE 124          1HG2      ILE 124  38.726   5.799   8.982
  890   2HG2  ILE 124          2HG2      ILE 124  39.850   6.212   7.687
  891   3HG2  ILE 124          3HG2      ILE 124  39.782   4.560   8.303
  892   1HD1  ILE 124          1HD1      ILE 124  37.851   8.097   5.361
  893   2HD1  ILE 124          2HD1      ILE 124  37.711   7.723   7.079
  894   3HD1  ILE 124          3HD1      ILE 124  36.440   7.225   5.962
  895    H    SER 125           H        SER 125  39.295   1.352   6.981
  896    HA   SER 125           HA       SER 125  37.643   0.752   9.312
  897   1HB   SER 125          2HB       SER 125  37.815  -0.946   7.526
  898   2HB   SER 125          1HB       SER 125  39.558  -1.027   7.782
  899    HG   SER 125           HG       SER 125  38.636  -2.672   8.952
  900    H    GLU 126           H        GLU 126  41.046   0.978   8.365
  901    HA   GLU 126           HA       GLU 126  41.738   1.438  11.172
  902   1HB   GLU 126          2HB       GLU 126  42.256  -0.986   9.894
  903   2HB   GLU 126          1HB       GLU 126  43.788  -0.124   9.828
  904   1HG   GLU 126          2HG       GLU 126  43.082   0.306  12.401
  905   2HG   GLU 126          1HG       GLU 126  42.359  -1.278  12.118
  906    H    GLU 127           H        GLU 127  41.608   3.593   9.869
  907    HA   GLU 127           HA       GLU 127  44.347   4.221   9.000
  908   1HB   GLU 127          2HB       GLU 127  41.818   5.260   7.709
  909   2HB   GLU 127          1HB       GLU 127  43.458   5.727   7.280
  910   1HG   GLU 127          2HG       GLU 127  42.881   2.842   7.198
  911   2HG   GLU 127          1HG       GLU 127  42.052   3.834   6.000
  912    H    ASP 128           H        ASP 128  41.248   5.539  10.123
  913    HA   ASP 128           HA       ASP 128  42.505   7.987  11.024
  914   1HB   ASP 128          2HB       ASP 128  39.776   7.025  10.597
  915   2HB   ASP 128          1HB       ASP 128  39.948   7.981  12.066
  916    H    LEU 129           H        LEU 129  42.892   5.127  12.195
  917    HA   LEU 129           HA       LEU 129  42.675   5.987  14.998
  918   1HB   LEU 129          2HB       LEU 129  41.597   3.591  13.699
  919   2HB   LEU 129          1HB       LEU 129  42.532   3.247  15.140
  920    HG   LEU 129           HG       LEU 129  40.259   3.422  15.806
  921   1HD1  LEU 129          1HD1      LEU 129  40.739   4.599  17.628
  922   2HD1  LEU 129          2HD1      LEU 129  40.819   6.104  16.713
  923   3HD1  LEU 129          3HD1      LEU 129  42.243   5.072  16.839
  924   1HD2  LEU 129          1HD2      LEU 129  38.808   4.606  14.624
  925   2HD2  LEU 129          2HD2      LEU 129  40.124   5.365  13.729
  926   3HD2  LEU 129          3HD2      LEU 129  39.542   6.093  15.227
  927    H    ASN 130           H        ASN 130  43.831   2.998  15.227
  928    HA   ASN 130           HA       ASN 130  45.861   2.075  15.603
  929   1HB   ASN 130          2HB       ASN 130  46.015   3.285  13.034
  930   2HB   ASN 130          1HB       ASN 130  47.556   3.553  13.843
  931   1HD2  ASN 130          1HD2      ASN 130  47.601   2.034  11.668
  932   2HD2  ASN 130          2HD2      ASN 130  47.818   0.367  12.067
  933    H    HIS 131           H        HIS 131  47.602   4.907  14.594
  934    HA   HIS 131           HA       HIS 131  47.999   5.685  17.402
  935   1HB   HIS 131          2HB       HIS 131  49.951   4.588  15.565
  936   2HB   HIS 131          1HB       HIS 131  50.426   6.197  16.098
  937    HD1  HIS 131           1HD      HIS 131  52.142   3.889  16.973
  938    HD2  HIS 131           2HD      HIS 131  48.878   5.218  19.175
  939    HE1  HIS 131           1HE      HIS 131  52.557   3.109  19.326
  940    HE2  HIS 131           2HE      HIS 131  50.619   4.010  20.659
  941    H    HIS 132           H        HIS 132  49.197   7.852  17.514
  942    HA   HIS 132           HA       HIS 132  47.694   9.740  15.953
  943   1HB   HIS 132          2HB       HIS 132  49.871  10.166  18.012
  944   2HB   HIS 132          1HB       HIS 132  48.880  11.440  17.310
  945    HD1  HIS 132           1HD      HIS 132  48.066   8.112  18.990
  946    HD2  HIS 132           2HD      HIS 132  46.967  12.118  19.079
  947    HE1  HIS 132           1HE      HIS 132  46.264   8.277  20.738
  948    HE2  HIS 132           2HE      HIS 132  45.578  10.701  20.737
  949    H    HIS 133           H        HIS 133  50.756   8.234  15.723
  950    HA   HIS 133           HA       HIS 133  51.978  10.299  14.113
  951   1HB   HIS 133          2HB       HIS 133  52.852   7.925  15.483
  952   2HB   HIS 133          1HB       HIS 133  53.398   7.877  13.810
  953    HD1  HIS 133           1HD      HIS 133  55.086   9.700  13.062
  954    HD2  HIS 133           2HD      HIS 133  54.064   9.860  17.086
  955    HE1  HIS 133           1HE      HIS 133  56.776  11.229  14.124
  956    HE2  HIS 133           2HE      HIS 133  56.188  11.244  16.574
  957    H    HIS 134           H        HIS 134  51.565  10.582  12.033
  958    HA   HIS 134           HA       HIS 134  50.177   8.545  10.515
  959   1HB   HIS 134          2HB       HIS 134  49.659  11.031  10.410
  960   2HB   HIS 134          1HB       HIS 134  51.159  11.215   9.505
  961    HD1  HIS 134           1HD      HIS 134  51.222   9.568   7.260
  962    HD2  HIS 134           2HD      HIS 134  47.517  10.610   8.825
  963    HE1  HIS 134           1HE      HIS 134  49.574   9.166   5.405
  964    HE2  HIS 134           2HE      HIS 134  47.327   9.710   6.408
  965    H    HIS 135           H        HIS 135  53.382   9.905  10.743
  966    HA   HIS 135           HA       HIS 135  54.286   8.585   8.322
  967   1HB   HIS 135          2HB       HIS 135  55.099  10.863   9.588
  968   2HB   HIS 135          1HB       HIS 135  56.311   9.711  10.141
  969    HD1  HIS 135           1HD      HIS 135  56.312  12.175   7.854
  970    HD2  HIS 135           2HD      HIS 135  56.844   8.080   7.384
  971    HE1  HIS 135           1HE      HIS 135  57.569  11.904   5.694
  972    HE2  HIS 135           2HE      HIS 135  57.944   9.423   5.467
  Start of MODEL    4
    1   1H    ASP   1          1HT       ASP   1 -10.880 -11.394   8.485
    2   2H    ASP   1          2HT       ASP   1 -11.212  -9.736   8.495
    3   3H    ASP   1          3HT       ASP   1  -9.764 -10.303   7.831
    4    HA   ASP   1           HA       ASP   1 -11.909 -11.599   6.564
    5   1HB   ASP   1          2HB       ASP   1 -12.559  -8.999   7.431
    6   2HB   ASP   1          1HB       ASP   1 -12.202  -8.852   5.713
    7    H    VAL   2           H        VAL   2  -9.447  -9.067   6.486
    8    HA   VAL   2           HA       VAL   2  -8.528 -10.151   3.906
    9    HB   VAL   2           HB       VAL   2  -7.867  -7.327   4.470
   10   1HG1  VAL   2          1HG1      VAL   2  -7.328  -8.771   2.407
   11   2HG1  VAL   2          2HG1      VAL   2  -7.893  -7.119   2.157
   12   3HG1  VAL   2          3HG1      VAL   2  -9.005  -8.471   1.949
   13   1HG2  VAL   2          1HG2      VAL   2 -10.571  -7.793   3.314
   14   2HG2  VAL   2          2HG2      VAL   2  -9.929  -6.379   4.151
   15   3HG2  VAL   2          3HG2      VAL   2 -10.388  -7.814   5.068
   16    H    GLN   3           H        GLN   3  -6.594 -11.042   4.082
   17    HA   GLN   3           HA       GLN   3  -4.686  -9.916   6.027
   18   1HB   GLN   3          2HB       GLN   3  -5.757 -12.516   5.972
   19   2HB   GLN   3          1HB       GLN   3  -4.111 -12.667   5.373
   20   1HG   GLN   3          2HG       GLN   3  -4.288 -10.971   7.721
   21   2HG   GLN   3          1HG       GLN   3  -4.894 -12.601   8.010
   22   1HE2  GLN   3          1HE2      GLN   3  -2.158 -10.907   6.524
   23   2HE2  GLN   3          2HE2      GLN   3  -0.958 -12.044   7.025
   24    H    LEU   4           H        LEU   4  -2.658  -9.476   5.312
   25    HA   LEU   4           HA       LEU   4  -2.143 -10.040   2.467
   26   1HB   LEU   4          2HB       LEU   4  -0.630  -7.958   3.964
   27   2HB   LEU   4          1HB       LEU   4  -1.054  -8.025   2.264
   28    HG   LEU   4           HG       LEU   4  -3.430  -7.805   3.903
   29   1HD1  LEU   4          1HD1      LEU   4  -1.637  -5.424   4.063
   30   2HD1  LEU   4          2HD1      LEU   4  -1.629  -6.650   5.326
   31   3HD1  LEU   4          3HD1      LEU   4  -3.113  -5.765   4.959
   32   1HD2  LEU   4          1HD2      LEU   4  -3.801  -7.149   1.767
   33   2HD2  LEU   4          2HD2      LEU   4  -2.162  -6.530   1.561
   34   3HD2  LEU   4          3HD2      LEU   4  -3.357  -5.581   2.441
   35    H    GLN   5           H        GLN   5   0.173 -10.182   1.864
   36    HA   GLN   5           HA       GLN   5   1.928 -11.286   3.919
   37   1HB   GLN   5          2HB       GLN   5   1.380 -12.758   1.335
   38   2HB   GLN   5          1HB       GLN   5   2.415 -13.287   2.654
   39   1HG   GLN   5          2HG       GLN   5   0.280 -13.218   4.080
   40   2HG   GLN   5          1HG       GLN   5  -0.572 -13.169   2.536
   41   1HE2  GLN   5          1HE2      GLN   5  -0.223 -14.926   1.053
   42   2HE2  GLN   5          2HE2      GLN   5   0.165 -16.497   1.659
   43    H    ALA   6           H        ALA   6   3.170  -9.409   3.617
   44    HA   ALA   6           HA       ALA   6   4.176  -8.758   0.988
   45   1HB   ALA   6          1HB       ALA   6   3.560  -7.139   2.919
   46   2HB   ALA   6          2HB       ALA   6   4.955  -6.788   1.897
   47   3HB   ALA   6          3HB       ALA   6   5.188  -7.495   3.496
   48    H    SER   7           H        SER   7   6.180  -9.073   0.199
   49    HA   SER   7           HA       SER   7   8.427  -9.833   1.760
   50   1HB   SER   7          2HB       SER   7   7.968 -12.042   1.919
   51   2HB   SER   7          1HB       SER   7   6.718 -11.963   0.680
   52    HG   SER   7           HG       SER   7   8.115 -12.620  -0.747
   53    H    GLY   8           H        GLY   8  10.320 -10.406   0.332
   54   1HA   GLY   8          2HA       GLY   8  11.168 -10.445  -1.974
   55   2HA   GLY   8          1HA       GLY   8   9.998  -9.187  -2.341
   56    H    GLY   9           H        GLY   9  11.797  -9.129   0.637
   57   1HA   GLY   9          2HA       GLY   9  12.961  -6.585  -0.123
   58   2HA   GLY   9          1HA       GLY   9  13.030  -7.335   1.464
   59    H    GLY  10           H        GLY  10  14.905  -6.303  -0.927
   60   1HA   GLY  10          2HA       GLY  10  16.892  -8.456  -0.538
   61   2HA   GLY  10          1HA       GLY  10  16.771  -7.506  -2.010
   62    H    LEU  11           H        LEU  11  19.155  -7.404  -1.325
   63    HA   LEU  11           HA       LEU  11  19.550  -5.060   0.415
   64   1HB   LEU  11          2HB       LEU  11  20.881  -7.627   0.277
   65   2HB   LEU  11          1HB       LEU  11  22.022  -6.313   0.064
   66    HG   LEU  11           HG       LEU  11  20.672  -5.403   2.217
   67   1HD1  LEU  11          1HD1      LEU  11  19.251  -7.106   2.766
   68   2HD1  LEU  11          2HD1      LEU  11  20.675  -7.588   3.688
   69   3HD1  LEU  11          3HD1      LEU  11  20.326  -8.355   2.139
   70   1HD2  LEU  11          1HD2      LEU  11  22.697  -5.542   3.142
   71   2HD2  LEU  11          2HD2      LEU  11  23.210  -6.308   1.640
   72   3HD2  LEU  11          3HD2      LEU  11  22.725  -7.300   3.016
   73    H    VAL  12           H        VAL  12  20.220  -3.266  -0.561
   74    HA   VAL  12           HA       VAL  12  21.712  -3.511  -3.091
   75    HB   VAL  12           HB       VAL  12  20.528  -1.672  -4.068
   76   1HG1  VAL  12          1HG1      VAL  12  18.188  -3.136  -3.032
   77   2HG1  VAL  12          2HG1      VAL  12  19.461  -4.115  -3.760
   78   3HG1  VAL  12          3HG1      VAL  12  18.694  -2.828  -4.692
   79   1HG2  VAL  12          1HG2      VAL  12  20.193  -0.390  -1.983
   80   2HG2  VAL  12          2HG2      VAL  12  18.899  -1.502  -1.535
   81   3HG2  VAL  12          3HG2      VAL  12  18.732  -0.487  -2.967
   82    H    GLN  13           H        GLN  13  22.316  -1.013  -3.671
   83    HA   GLN  13           HA       GLN  13  23.761  -0.012  -1.307
   84   1HB   GLN  13          2HB       GLN  13  24.839   0.926  -3.823
   85   2HB   GLN  13          1HB       GLN  13  25.648   0.074  -2.514
   86   1HG   GLN  13          2HG       GLN  13  25.904  -1.586  -3.968
   87   2HG   GLN  13          1HG       GLN  13  24.192  -1.915  -3.713
   88   1HE2  GLN  13          1HE2      GLN  13  22.679  -0.829  -5.168
   89   2HE2  GLN  13          2HE2      GLN  13  23.156  -0.548  -6.804
   90    HA   PRO  14           HA       PRO  14  21.696   3.874  -1.470
   91   1HB   PRO  14          2HB       PRO  14  24.394   5.137  -1.693
   92   2HB   PRO  14          1HB       PRO  14  23.076   5.489  -0.569
   93   1HG   PRO  14          2HG       PRO  14  25.181   4.113   0.262
   94   2HG   PRO  14          1HG       PRO  14  23.546   3.637   0.766
   95   1HD   PRO  14          2HD       PRO  14  25.330   2.400  -1.290
   96   2HD   PRO  14          1HD       PRO  14  24.235   1.621  -0.130
   97    H    GLY  15           H        GLY  15  20.771   3.630  -3.545
   98   1HA   GLY  15          2HA       GLY  15  20.518   5.247  -5.421
   99   2HA   GLY  15          1HA       GLY  15  22.239   5.030  -5.696
  100    H    GLY  16           H        GLY  16  20.697   2.148  -4.785
  101   1HA   GLY  16          2HA       GLY  16  21.007   1.112  -7.486
  102   2HA   GLY  16          1HA       GLY  16  20.699   0.171  -6.035
  103    H    SER  17           H        SER  17  18.924  -0.979  -6.523
  104    HA   SER  17           HA       SER  17  16.411   0.366  -6.697
  105   1HB   SER  17          2HB       SER  17  15.835   0.114  -8.885
  106   2HB   SER  17          1HB       SER  17  17.581   0.155  -9.127
  107    HG   SER  17           HG       SER  17  16.637  -1.635 -10.173
  108    H    LEU  18           H        LEU  18  14.826  -0.888  -5.902
  109    HA   LEU  18           HA       LEU  18  15.242  -3.795  -5.806
  110   1HB   LEU  18          2HB       LEU  18  15.263  -1.979  -3.580
  111   2HB   LEU  18          1HB       LEU  18  13.889  -3.058  -3.442
  112    HG   LEU  18           HG       LEU  18  16.701  -4.049  -3.877
  113   1HD1  LEU  18          1HD1      LEU  18  15.794  -2.741  -1.607
  114   2HD1  LEU  18          2HD1      LEU  18  17.195  -3.804  -1.727
  115   3HD1  LEU  18          3HD1      LEU  18  15.635  -4.455  -1.222
  116   1HD2  LEU  18          1HD2      LEU  18  14.799  -5.552  -4.451
  117   2HD2  LEU  18          2HD2      LEU  18  14.272  -5.445  -2.771
  118   3HD2  LEU  18          3HD2      LEU  18  15.835  -6.161  -3.161
  119    H    ARG  19           H        ARG  19  13.368  -5.041  -5.826
  120    HA   ARG  19           HA       ARG  19  10.861  -3.562  -6.281
  121   1HB   ARG  19          2HB       ARG  19  11.717  -4.403  -8.409
  122   2HB   ARG  19          1HB       ARG  19  11.834  -6.025  -7.741
  123   1HG   ARG  19          2HG       ARG  19   9.661  -6.443  -8.064
  124   2HG   ARG  19          1HG       ARG  19   9.171  -4.837  -7.520
  125   1HD   ARG  19          2HD       ARG  19   8.642  -5.287  -9.904
  126   2HD   ARG  19          1HD       ARG  19   9.689  -3.889  -9.662
  127    HE   ARG  19           HE       ARG  19  11.448  -5.055 -10.645
  128   1HH1  ARG  19          1HH1      ARG  19   8.617  -7.067 -10.346
  129   2HH1  ARG  19          2HH1      ARG  19   9.214  -8.285 -11.422
  130   1HH2  ARG  19          1HH2      ARG  19  12.239  -6.657 -12.062
  131   2HH2  ARG  19          2HH2      ARG  19  11.271  -8.053 -12.396
  132    H    VAL  20           H        VAL  20   9.607  -3.944  -4.572
  133    HA   VAL  20           HA       VAL  20   9.575  -6.668  -3.446
  134    HB   VAL  20           HB       VAL  20   8.881  -5.778  -1.359
  135   1HG1  VAL  20          1HG1      VAL  20  10.678  -4.174  -0.819
  136   2HG1  VAL  20          2HG1      VAL  20  11.007  -4.001  -2.543
  137   3HG1  VAL  20          3HG1      VAL  20  11.248  -5.559  -1.751
  138   1HG2  VAL  20          1HG2      VAL  20   7.728  -3.882  -1.066
  139   2HG2  VAL  20          2HG2      VAL  20   7.598  -3.834  -2.823
  140   3HG2  VAL  20          3HG2      VAL  20   8.880  -2.937  -2.008
  141    H    SER  21           H        SER  21   7.482  -7.484  -2.684
  142    HA   SER  21           HA       SER  21   5.163  -6.263  -3.994
  143   1HB   SER  21          2HB       SER  21   4.467  -8.329  -5.012
  144   2HB   SER  21          1HB       SER  21   6.125  -8.005  -5.513
  145    HG   SER  21           HG       SER  21   6.733  -9.432  -3.719
  146    H    CYS  22           H        CYS  22   3.098  -7.286  -3.310
  147    HA   CYS  22           HA       CYS  22   3.189  -8.602  -0.706
  148   1HB   CYS  22          2HB       CYS  22   2.952  -6.521   0.220
  149   2HB   CYS  22          1HB       CYS  22   2.220  -5.842  -1.228
  150    H    ALA  23           H        ALA  23   2.040 -10.378  -1.038
  151    HA   ALA  23           HA       ALA  23  -0.139 -10.396  -2.944
  152   1HB   ALA  23          1HB       ALA  23   0.823 -12.675  -1.231
  153   2HB   ALA  23          2HB       ALA  23   1.537 -12.243  -2.784
  154   3HB   ALA  23          3HB       ALA  23  -0.145 -12.768  -2.703
  155    H    ALA  24           H        ALA  24  -2.254 -10.383  -2.486
  156    HA   ALA  24           HA       ALA  24  -3.109 -10.821   0.288
  157   1HB   ALA  24          1HB       ALA  24  -2.959  -8.424   0.033
  158   2HB   ALA  24          2HB       ALA  24  -4.655  -8.902   0.116
  159   3HB   ALA  24          3HB       ALA  24  -3.931  -8.488  -1.438
  160    H    SER  25           H        SER  25  -5.590 -10.966   0.376
  161    HA   SER  25           HA       SER  25  -7.034 -11.694  -1.950
  162   1HB   SER  25          2HB       SER  25  -5.329 -13.706  -1.103
  163   2HB   SER  25          1HB       SER  25  -6.872 -14.148  -0.372
  164    HG   SER  25           HG       SER  25  -7.644 -14.596  -2.281
  165    H    GLY  26           H        GLY  26  -9.191 -11.709  -1.546
  166   1HA   GLY  26          2HA       GLY  26 -10.933 -12.455   0.105
  167   2HA   GLY  26          1HA       GLY  26  -9.984 -11.580   1.297
  168    H    PHE  27           H        PHE  27  -9.796  -9.861  -1.515
  169    HA   PHE  27           HA       PHE  27 -12.332  -8.514  -1.386
  170   1HB   PHE  27          2HB       PHE  27 -11.559  -6.370  -0.628
  171   2HB   PHE  27          1HB       PHE  27 -11.095  -7.570   0.568
  172    HD1  PHE  27           1HD      PHE  27  -9.970  -4.759   0.158
  173    HD2  PHE  27           2HD      PHE  27  -8.684  -8.589  -1.185
  174    HE1  PHE  27           1HE      PHE  27  -7.652  -3.946   0.061
  175    HE2  PHE  27           2HE      PHE  27  -6.366  -7.780  -1.285
  176    HZ   PHE  27           HZ       PHE  27  -5.846  -5.456  -0.657
  177    H    THR  28           H        THR  28  -9.411  -9.281  -2.854
  178    HA   THR  28           HA       THR  28  -8.601  -9.032  -4.957
  179    HB   THR  28           HB       THR  28 -11.267  -7.765  -5.613
  180    HG1  THR  28           1HG      THR  28 -10.480 -10.392  -5.185
  181   1HG2  THR  28          1HG2      THR  28  -9.649  -7.314  -7.337
  182   2HG2  THR  28          2HG2      THR  28 -10.737  -8.578  -7.911
  183   3HG2  THR  28          3HG2      THR  28  -9.120  -8.996  -7.342
  184    H    PHE  29           H        PHE  29  -7.374  -7.580  -6.078
  185    HA   PHE  29           HA       PHE  29  -7.152  -4.938  -4.923
  186   1HB   PHE  29          2HB       PHE  29  -5.487  -6.695  -6.597
  187   2HB   PHE  29          1HB       PHE  29  -5.361  -4.986  -6.996
  188    HD1  PHE  29           1HD      PHE  29  -5.287  -7.263  -4.050
  189    HD2  PHE  29           2HD      PHE  29  -3.852  -3.684  -5.846
  190    HE1  PHE  29           1HE      PHE  29  -3.728  -6.952  -2.172
  191    HE2  PHE  29           2HE      PHE  29  -2.291  -3.364  -3.972
  192    HZ   PHE  29           HZ       PHE  29  -2.225  -5.000  -2.133
  193    H    SER  30           H        SER  30  -6.414  -3.272  -6.852
  194    HA   SER  30           HA       SER  30  -7.242  -1.788  -8.365
  195   1HB   SER  30          2HB       SER  30  -6.667  -3.672  -9.883
  196   2HB   SER  30          1HB       SER  30  -8.314  -4.280  -9.712
  197    HG   SER  30           HG       SER  30  -7.476  -1.830 -10.867
  198    H    SER  31           H        SER  31  -8.949  -2.643  -6.087
  199    HA   SER  31           HA       SER  31 -11.420  -1.441  -7.055
  200   1HB   SER  31          2HB       SER  31 -11.181  -4.245  -6.439
  201   2HB   SER  31          1HB       SER  31 -12.270  -3.472  -5.287
  202    HG   SER  31           HG       SER  31 -12.706  -4.104  -7.858
  203    H    TYR  32           H        TYR  32  -9.271  -2.369  -4.497
  204    HA   TYR  32           HA       TYR  32 -10.658  -0.529  -2.660
  205   1HB   TYR  32          2HB       TYR  32  -9.122  -3.064  -2.155
  206   2HB   TYR  32          1HB       TYR  32  -9.292  -1.853  -0.890
  207    HD1  TYR  32           1HD      TYR  32 -11.141  -4.205  -3.055
  208    HD2  TYR  32           2HD      TYR  32 -11.341  -1.588   0.294
  209    HE1  TYR  32           1HE      TYR  32 -13.331  -5.150  -2.455
  210    HE2  TYR  32           2HE      TYR  32 -13.532  -2.525   0.902
  211    HH   TYR  32           HH       TYR  32 -14.847  -4.516   0.551
  212    H    HIS  33           H        HIS  33  -9.210   0.609  -1.130
  213    HA   HIS  33           HA       HIS  33  -6.934   1.693  -2.562
  214   1HB   HIS  33          2HB       HIS  33  -7.992   2.440   0.174
  215   2HB   HIS  33          1HB       HIS  33  -6.867   3.373  -0.806
  216    HD1  HIS  33           1HD      HIS  33  -7.850   4.709  -2.790
  217    HD2  HIS  33           2HD      HIS  33 -10.686   2.653  -0.556
  218    HE1  HIS  33           1HE      HIS  33 -10.075   5.633  -3.513
  219    HE2  HIS  33           2HE      HIS  33 -11.769   4.439  -2.080
  220    H    MET  34           H        MET  34  -4.800   1.483  -1.983
  221    HA   MET  34           HA       MET  34  -4.177  -0.068   0.421
  222   1HB   MET  34          2HB       MET  34  -2.848  -0.672  -2.212
  223   2HB   MET  34          1HB       MET  34  -2.723  -1.571  -0.708
  224   1HG   MET  34          2HG       MET  34  -5.348  -1.273  -2.104
  225   2HG   MET  34          1HG       MET  34  -4.190  -2.508  -2.595
  226   1HE   MET  34          1HE       MET  34  -3.815  -4.654   0.610
  227   2HE   MET  34          2HE       MET  34  -3.059  -3.066   0.740
  228   3HE   MET  34          3HE       MET  34  -2.979  -3.958  -0.778
  229    H    ALA  35           H        ALA  35  -1.656  -0.163   0.648
  230    HA   ALA  35           HA       ALA  35  -0.227   2.096  -0.387
  231   1HB   ALA  35          1HB       ALA  35   0.093   3.211   1.804
  232   2HB   ALA  35          2HB       ALA  35  -1.141   2.150   2.483
  233   3HB   ALA  35          3HB       ALA  35  -1.564   3.292   1.207
  234    H    TRP  36           H        TRP  36   1.964   2.112   0.147
  235    HA   TRP  36           HA       TRP  36   2.965  -0.383   1.340
  236   1HB   TRP  36          2HB       TRP  36   3.857   1.343  -0.888
  237   2HB   TRP  36          1HB       TRP  36   5.142   0.747   0.156
  238    HD1  TRP  36           HD       TRP  36   3.187  -0.207  -2.798
  239    HE1  TRP  36           1HE      TRP  36   3.522  -2.700  -3.349
  240    HE3  TRP  36           3HE      TRP  36   5.397  -1.719   1.559
  241    HZ2  TRP  36           2HZ      TRP  36   4.579  -5.001  -2.106
  242    HZ3  TRP  36           3HZ      TRP  36   6.039  -4.084   1.797
  243    HH2  TRP  36           HH       TRP  36   5.637  -5.690   0.000
  244    H    VAL  37           H        VAL  37   3.375  -0.059   3.453
  245    HA   VAL  37           HA       VAL  37   4.506   2.511   4.289
  246    HB   VAL  37           HB       VAL  37   3.788   2.066   6.491
  247   1HG1  VAL  37          1HG1      VAL  37   1.378   0.861   5.640
  248   2HG1  VAL  37          2HG1      VAL  37   1.962   1.878   4.320
  249   3HG1  VAL  37          3HG1      VAL  37   1.711   2.571   5.922
  250   1HG2  VAL  37          1HG2      VAL  37   4.349  -0.586   5.930
  251   2HG2  VAL  37          2HG2      VAL  37   2.604  -0.562   6.191
  252   3HG2  VAL  37          3HG2      VAL  37   3.692   0.053   7.437
  253    H    ARG  38           H        ARG  38   6.118   2.454   6.058
  254    HA   ARG  38           HA       ARG  38   7.875   0.115   5.982
  255   1HB   ARG  38          2HB       ARG  38   8.938   1.366   4.341
  256   2HB   ARG  38          1HB       ARG  38   8.530   2.897   5.097
  257   1HG   ARG  38          2HG       ARG  38  10.140   1.934   6.985
  258   2HG   ARG  38          1HG       ARG  38  10.805   1.077   5.591
  259   1HD   ARG  38          2HD       ARG  38  12.002   3.131   5.826
  260   2HD   ARG  38          1HD       ARG  38  10.957   3.269   4.411
  261    HE   ARG  38           HE       ARG  38   9.631   4.286   6.684
  262   1HH1  ARG  38          1HH1      ARG  38  12.240   5.044   4.502
  263   2HH1  ARG  38          2HH1      ARG  38  12.070   6.757   4.688
  264   1HH2  ARG  38          1HH2      ARG  38   9.395   6.540   6.932
  265   2HH2  ARG  38          2HH2      ARG  38  10.452   7.609   6.071
  266    H    GLN  39           H        GLN  39   9.297  -0.061   7.762
  267    HA   GLN  39           HA       GLN  39   8.837   1.808   9.976
  268   1HB   GLN  39          2HB       GLN  39   7.462  -0.350  10.131
  269   2HB   GLN  39          1HB       GLN  39   8.995  -1.170  10.397
  270   1HG   GLN  39          2HG       GLN  39   9.310  -0.206  12.460
  271   2HG   GLN  39          1HG       GLN  39   8.279   1.175  12.089
  272   1HE2  GLN  39          1HE2      GLN  39   6.597   1.171  13.388
  273   2HE2  GLN  39          2HE2      GLN  39   5.650  -0.205  13.830
  274    H    ALA  40           H        ALA  40  10.732   2.670  10.454
  275    HA   ALA  40           HA       ALA  40  13.183   1.125  10.034
  276   1HB   ALA  40          1HB       ALA  40  12.476   3.879   9.736
  277   2HB   ALA  40          2HB       ALA  40  13.966   3.057   9.270
  278   3HB   ALA  40          3HB       ALA  40  13.803   3.737  10.890
  279    HA   PRO  41           HA       PRO  41  14.056   0.333  14.278
  280   1HB   PRO  41          2HB       PRO  41  16.660   1.247  14.495
  281   2HB   PRO  41          1HB       PRO  41  16.194  -0.339  13.873
  282   1HG   PRO  41          2HG       PRO  41  16.893   2.156  12.383
  283   2HG   PRO  41          1HG       PRO  41  17.317   0.473  12.017
  284   1HD   PRO  41          2HD       PRO  41  15.369   1.736  10.686
  285   2HD   PRO  41          1HD       PRO  41  15.232   0.015  11.107
  286    H    GLY  42           H        GLY  42  12.607   1.868  15.177
  287   1HA   GLY  42          2HA       GLY  42  12.632   3.407  17.041
  288   2HA   GLY  42          1HA       GLY  42  13.976   4.240  16.273
  289    H    LYS  43           H        LYS  43  11.094   3.182  14.570
  290    HA   LYS  43           HA       LYS  43  10.186   5.973  14.407
  291   1HB   LYS  43          2HB       LYS  43  11.464   4.769  12.337
  292   2HB   LYS  43          1HB       LYS  43   9.799   4.328  11.985
  293   1HG   LYS  43          2HG       LYS  43   9.136   6.602  11.848
  294   2HG   LYS  43          1HG       LYS  43  10.678   7.155  12.501
  295   1HD   LYS  43          2HD       LYS  43  11.734   6.023  10.457
  296   2HD   LYS  43          1HD       LYS  43  10.097   5.981   9.798
  297   1HE   LYS  43          2HE       LYS  43  11.708   8.401  10.587
  298   2HE   LYS  43          1HE       LYS  43  11.160   7.950   8.971
  299   1HZ   LYS  43          1HZ       LYS  43   8.875   8.076  10.474
  300   2HZ   LYS  43          2HZ       LYS  43   9.410   9.234   9.364
  301   3HZ   LYS  43          3HZ       LYS  43   9.786   9.400  11.005
  302    H    GLY  44           H        GLY  44   7.925   6.209  13.778
  303   1HA   GLY  44          2HA       GLY  44   6.331   3.996  14.864
  304   2HA   GLY  44          1HA       GLY  44   5.805   5.666  14.716
  305    H    LEU  45           H        LEU  45   7.287   3.572  12.275
  306    HA   LEU  45           HA       LEU  45   6.591   2.863  10.232
  307   1HB   LEU  45          2HB       LEU  45   4.726   1.934  11.759
  308   2HB   LEU  45          1HB       LEU  45   3.746   3.236  11.111
  309    HG   LEU  45           HG       LEU  45   4.265   2.310   8.802
  310   1HD1  LEU  45          1HD1      LEU  45   5.475   0.198  10.532
  311   2HD1  LEU  45          2HD1      LEU  45   6.092   0.921   9.046
  312   3HD1  LEU  45          3HD1      LEU  45   4.755  -0.228   8.979
  313   1HD2  LEU  45          1HD2      LEU  45   2.431   0.880   8.866
  314   2HD2  LEU  45          2HD2      LEU  45   2.161   1.947  10.243
  315   3HD2  LEU  45          3HD2      LEU  45   2.798   0.322  10.498
  316    H    GLU  46           H        GLU  46   5.537   3.529   8.242
  317    HA   GLU  46           HA       GLU  46   4.410   6.191   8.112
  318   1HB   GLU  46          2HB       GLU  46   6.484   7.106   7.867
  319   2HB   GLU  46          1HB       GLU  46   7.206   5.590   7.348
  320   1HG   GLU  46          2HG       GLU  46   6.674   5.932   5.144
  321   2HG   GLU  46          1HG       GLU  46   5.339   7.022   5.522
  322    H    TRP  47           H        TRP  47   2.941   6.278   6.513
  323    HA   TRP  47           HA       TRP  47   2.268   3.985   5.061
  324   1HB   TRP  47          2HB       TRP  47   0.359   5.114   4.885
  325   2HB   TRP  47          1HB       TRP  47   1.149   6.549   5.524
  326    HD1  TRP  47           HD       TRP  47   0.693   4.828   2.072
  327    HE1  TRP  47           1HE      TRP  47   0.477   6.670   0.296
  328    HE3  TRP  47           3HE      TRP  47   1.323   8.911   5.073
  329    HZ2  TRP  47           2HZ      TRP  47   0.541   9.497   0.186
  330    HZ3  TRP  47           3HZ      TRP  47   1.226  11.151   4.057
  331    HH2  TRP  47           HH       TRP  47   0.843  11.436   1.663
  332    H    VAL  48           H        VAL  48   4.421   6.586   4.235
  333    HA   VAL  48           HA       VAL  48   5.733   6.997   2.434
  334    HB   VAL  48           HB       VAL  48   5.538   4.022   2.434
  335   1HG1  VAL  48          1HG1      VAL  48   7.471   4.493   0.535
  336   2HG1  VAL  48          2HG1      VAL  48   6.173   5.583   0.055
  337   3HG1  VAL  48          3HG1      VAL  48   5.855   3.856   0.222
  338   1HG2  VAL  48          1HG2      VAL  48   8.179   5.071   2.246
  339   2HG2  VAL  48          2HG2      VAL  48   7.406   4.252   3.606
  340   3HG2  VAL  48          3HG2      VAL  48   7.282   6.004   3.444
  341    H    SER  49           H        SER  49   3.796   4.414   0.857
  342    HA   SER  49           HA       SER  49   2.858   6.497  -1.022
  343   1HB   SER  49          2HB       SER  49   3.530   3.668  -1.823
  344   2HB   SER  49          1HB       SER  49   3.198   5.041  -2.877
  345    HG   SER  49           HG       SER  49   5.462   4.516  -2.611
  346    H    THR  50           H        THR  50   0.852   6.301  -1.941
  347    HA   THR  50           HA       THR  50  -0.881   4.095  -1.097
  348    HB   THR  50           HB       THR  50  -1.248   6.968  -0.383
  349    HG1  THR  50           1HG      THR  50  -2.616   5.193   1.093
  350   1HG2  THR  50          1HG2      THR  50  -3.109   6.390  -2.005
  351   2HG2  THR  50          2HG2      THR  50  -3.617   6.909  -0.399
  352   3HG2  THR  50          3HG2      THR  50  -3.645   5.197  -0.822
  353    H    ILE  51           H        ILE  51  -2.088   3.366  -2.757
  354    HA   ILE  51           HA       ILE  51  -2.410   5.152  -5.085
  355    HB   ILE  51           HB       ILE  51  -0.828   3.330  -5.557
  356   1HG1  ILE  51          2HG1      ILE  51  -3.176   2.514  -7.166
  357   2HG1  ILE  51          1HG1      ILE  51  -2.821   4.240  -7.148
  358   1HG2  ILE  51          1HG2      ILE  51  -3.013   1.705  -4.436
  359   2HG2  ILE  51          2HG2      ILE  51  -1.271   1.431  -4.425
  360   3HG2  ILE  51          3HG2      ILE  51  -2.217   1.040  -5.862
  361   1HD1  ILE  51          1HD1      ILE  51  -1.216   3.944  -8.633
  362   2HD1  ILE  51          2HD1      ILE  51  -1.616   2.228  -8.698
  363   3HD1  ILE  51          3HD1      ILE  51  -0.397   2.805  -7.563
  364    H    ASN  52           H        ASN  52  -4.355   5.204  -6.125
  365    HA   ASN  52           HA       ASN  52  -6.600   4.035  -4.660
  366   1HB   ASN  52          2HB       ASN  52  -7.989   5.634  -5.912
  367   2HB   ASN  52          1HB       ASN  52  -6.677   6.451  -5.072
  368   1HD2  ASN  52          1HD2      ASN  52  -8.120   7.509  -7.233
  369   2HD2  ASN  52          2HD2      ASN  52  -7.032   7.716  -8.558
  370    HA   PRO  53           HA       PRO  53  -7.502   0.846  -7.568
  371   1HB   PRO  53          2HB       PRO  53 -10.317   1.820  -7.454
  372   2HB   PRO  53          1HB       PRO  53  -9.677   0.193  -7.194
  373   1HG   PRO  53          2HG       PRO  53 -10.457   1.675  -5.132
  374   2HG   PRO  53          1HG       PRO  53  -9.005   0.662  -5.021
  375   1HD   PRO  53          2HD       PRO  53  -9.232   3.620  -5.385
  376   2HD   PRO  53          1HD       PRO  53  -8.052   2.685  -4.443
  377    H    GLY  54           H        GLY  54  -9.977   3.267  -8.360
  378   1HA   GLY  54          2HA       GLY  54  -9.193   3.099 -11.166
  379   2HA   GLY  54          1HA       GLY  54 -10.647   3.860 -10.535
  380    H    ASP  55           H        ASP  55  -9.759   5.428 -12.259
  381    HA   ASP  55           HA       ASP  55  -8.980   7.511 -12.719
  382   1HB   ASP  55          2HB       ASP  55  -8.903   7.562  -9.713
  383   2HB   ASP  55          1HB       ASP  55  -8.310   8.927 -10.656
  384    H    GLY  56           H        GLY  56  -6.878   6.965  -9.906
  385   1HA   GLY  56          2HA       GLY  56  -4.640   5.906 -10.476
  386   2HA   GLY  56          1HA       GLY  56  -4.581   7.109 -11.755
  387    H    SER  57           H        SER  57  -6.117   8.516  -9.204
  388    HA   SER  57           HA       SER  57  -4.169  10.405  -8.664
  389   1HB   SER  57          2HB       SER  57  -6.702  10.338  -8.035
  390   2HB   SER  57          1HB       SER  57  -6.133   9.590  -6.543
  391    HG   SER  57           HG       SER  57  -5.279  12.096  -7.569
  392    H    THR  58           H        THR  58  -2.244  10.212  -7.746
  393    HA   THR  58           HA       THR  58  -1.809   8.032  -5.823
  394    HB   THR  58           HB       THR  58   0.686   9.062  -6.436
  395    HG1  THR  58           1HG      THR  58  -0.084  10.241  -8.187
  396   1HG2  THR  58          1HG2      THR  58  -0.183   6.663  -6.242
  397   2HG2  THR  58          2HG2      THR  58   1.089   6.967  -7.427
  398   3HG2  THR  58          3HG2      THR  58  -0.588   6.800  -7.954
  399    H    TYR  59           H        TYR  59  -0.668   8.398  -3.906
  400    HA   TYR  59           HA       TYR  59  -0.194  11.178  -3.123
  401   1HB   TYR  59          2HB       TYR  59  -1.605   9.326  -1.221
  402   2HB   TYR  59          1HB       TYR  59  -1.491  11.081  -1.169
  403    HD1  TYR  59           1HD      TYR  59  -2.896  12.458  -2.654
  404    HD2  TYR  59           2HD      TYR  59  -3.310   8.227  -2.499
  405    HE1  TYR  59           1HE      TYR  59  -5.087  12.639  -3.758
  406    HE2  TYR  59           2HE      TYR  59  -5.501   8.395  -3.605
  407    HH   TYR  59           HH       TYR  59  -7.279  10.044  -3.928
  408    H    TYR  60           H        TYR  60   1.734  11.377  -2.200
  409    HA   TYR  60           HA       TYR  60   2.889   9.033  -0.839
  410   1HB   TYR  60          2HB       TYR  60   4.317  11.025  -2.611
  411   2HB   TYR  60          1HB       TYR  60   5.122   9.799  -1.638
  412    HD1  TYR  60           1HD      TYR  60   2.697  10.239  -4.420
  413    HD2  TYR  60           2HD      TYR  60   5.442   7.636  -2.478
  414    HE1  TYR  60           1HE      TYR  60   2.489   8.642  -6.278
  415    HE2  TYR  60           2HE      TYR  60   5.241   6.032  -4.330
  416    HH   TYR  60           HH       TYR  60   2.946   5.819  -6.339
  417    H    ALA  61           H        ALA  61   4.654   9.639   0.701
  418    HA   ALA  61           HA       ALA  61   3.728  11.760   2.410
  419   1HB   ALA  61          1HB       ALA  61   5.395   9.416   2.673
  420   2HB   ALA  61          2HB       ALA  61   4.504  10.306   3.907
  421   3HB   ALA  61          3HB       ALA  61   6.130  10.816   3.451
  422    H    ASP  62           H        ASP  62   5.218  12.097  -0.304
  423    HA   ASP  62           HA       ASP  62   6.395  13.799  -1.245
  424   1HB   ASP  62          2HB       ASP  62   5.781  14.847   1.321
  425   2HB   ASP  62          1HB       ASP  62   7.470  15.217   0.988
  426    H    SER  63           H        SER  63   7.899  12.594   1.744
  427    HA   SER  63           HA       SER  63  10.552  12.826   0.649
  428   1HB   SER  63          2HB       SER  63   9.642  11.420   3.170
  429   2HB   SER  63          1HB       SER  63  11.294  11.882   2.765
  430    HG   SER  63           HG       SER  63  10.876  13.770   3.558
  431    H    VAL  64           H        VAL  64   8.294  10.936  -0.372
  432    HA   VAL  64           HA       VAL  64  10.087   8.662  -0.801
  433    HB   VAL  64           HB       VAL  64   8.101   7.126  -0.616
  434   1HG1  VAL  64          1HG1      VAL  64   9.117   8.572   1.823
  435   2HG1  VAL  64          2HG1      VAL  64   9.757   7.095   1.103
  436   3HG1  VAL  64          3HG1      VAL  64   8.177   7.082   1.886
  437   1HG2  VAL  64          1HG2      VAL  64   6.806   9.638  -0.128
  438   2HG2  VAL  64          2HG2      VAL  64   6.575   8.555   1.244
  439   3HG2  VAL  64          3HG2      VAL  64   6.097   8.043  -0.374
  440    H    LYS  65           H        LYS  65   8.765  11.064  -2.273
  441    HA   LYS  65           HA       LYS  65   7.201   9.827  -4.338
  442   1HB   LYS  65          2HB       LYS  65   8.226  12.570  -3.787
  443   2HB   LYS  65          1HB       LYS  65   7.759  12.180  -5.437
  444   1HG   LYS  65          2HG       LYS  65   5.882  11.559  -3.208
  445   2HG   LYS  65          1HG       LYS  65   6.039  13.222  -3.775
  446   1HD   LYS  65          2HD       LYS  65   5.513  10.918  -5.639
  447   2HD   LYS  65          1HD       LYS  65   4.215  11.817  -4.851
  448   1HE   LYS  65          2HE       LYS  65   6.199  12.758  -6.889
  449   2HE   LYS  65          1HE       LYS  65   4.439  12.864  -6.922
  450   1HZ   LYS  65          1HZ       LYS  65   4.792  14.369  -4.869
  451   2HZ   LYS  65          2HZ       LYS  65   5.057  15.005  -6.414
  452   3HZ   LYS  65          3HZ       LYS  65   6.370  14.533  -5.459
  453    H    GLY  66           H        GLY  66  10.292  11.606  -4.526
  454   1HA   GLY  66          2HA       GLY  66  10.925  10.351  -7.043
  455   2HA   GLY  66          1HA       GLY  66  11.929  11.492  -6.161
  456    H    ARG  67           H        ARG  67  10.643   8.512  -4.802
  457    HA   ARG  67           HA       ARG  67  13.237   7.207  -5.068
  458   1HB   ARG  67          2HB       ARG  67  12.622   6.635  -2.446
  459   2HB   ARG  67          1HB       ARG  67  13.849   7.767  -2.988
  460   1HG   ARG  67          2HG       ARG  67  11.123   8.842  -2.802
  461   2HG   ARG  67          1HG       ARG  67  11.883   8.376  -1.274
  462   1HD   ARG  67          2HD       ARG  67  13.819   9.769  -2.797
  463   2HD   ARG  67          1HD       ARG  67  12.326  10.705  -2.870
  464    HE   ARG  67           HE       ARG  67  13.344   9.803  -0.270
  465   1HH1  ARG  67          1HH1      ARG  67  12.602  12.383  -2.494
  466   2HH1  ARG  67          2HH1      ARG  67  12.727  13.625  -1.294
  467   1HH2  ARG  67          1HH2      ARG  67  13.510  11.436   1.314
  468   2HH2  ARG  67          2HH2      ARG  67  13.242  13.088   0.869
  469    H    PHE  68           H        PHE  68  10.072   6.872  -3.449
  470    HA   PHE  68           HA       PHE  68  10.077   4.051  -4.256
  471   1HB   PHE  68          2HB       PHE  68   8.462   5.447  -2.119
  472   2HB   PHE  68          1HB       PHE  68   8.372   3.731  -2.499
  473    HD1  PHE  68           1HD      PHE  68   9.040   5.002   0.186
  474    HD2  PHE  68           2HD      PHE  68  11.482   3.591  -3.001
  475    HE1  PHE  68           1HE      PHE  68  10.863   4.559   1.779
  476    HE2  PHE  68           2HE      PHE  68  13.305   3.146  -1.414
  477    HZ   PHE  68           HZ       PHE  68  12.995   3.631   0.977
  478    H    THR  69           H        THR  69   8.774   3.367  -5.788
  479    HA   THR  69           HA       THR  69   6.563   5.108  -6.644
  480    HB   THR  69           HB       THR  69   8.166   3.027  -8.125
  481    HG1  THR  69           1HG      THR  69   8.675   4.753  -9.415
  482   1HG2  THR  69          1HG2      THR  69   6.651   3.139  -9.979
  483   2HG2  THR  69          2HG2      THR  69   5.667   4.360  -9.174
  484   3HG2  THR  69          3HG2      THR  69   5.706   2.710  -8.552
  485    H    ILE  70           H        ILE  70   4.513   4.416  -6.553
  486    HA   ILE  70           HA       ILE  70   4.076   1.744  -5.431
  487    HB   ILE  70           HB       ILE  70   3.220   4.059  -4.420
  488   1HG1  ILE  70          2HG1      ILE  70   1.980   1.330  -4.378
  489   2HG1  ILE  70          1HG1      ILE  70   2.908   2.159  -3.131
  490   1HG2  ILE  70          1HG2      ILE  70   0.834   3.213  -6.047
  491   2HG2  ILE  70          2HG2      ILE  70   1.896   4.549  -6.490
  492   3HG2  ILE  70          3HG2      ILE  70   0.981   4.612  -4.984
  493   1HD1  ILE  70          1HD1      ILE  70   0.909   3.754  -2.995
  494   2HD1  ILE  70          2HD1      ILE  70   0.762   2.144  -2.289
  495   3HD1  ILE  70          3HD1      ILE  70   0.033   2.490  -3.859
  496    H    SER  71           H        SER  71   3.139   0.216  -6.602
  497    HA   SER  71           HA       SER  71   1.269   0.826  -8.710
  498   1HB   SER  71          2HB       SER  71   2.716  -0.561 -10.365
  499   2HB   SER  71          1HB       SER  71   3.124   1.134 -10.103
  500    HG   SER  71           HG       SER  71   4.779  -0.774  -9.911
  501    H    ARG  72           H        ARG  72  -0.144  -0.782  -8.967
  502    HA   ARG  72           HA       ARG  72   0.501  -3.382  -7.734
  503   1HB   ARG  72          2HB       ARG  72  -2.024  -3.546  -7.390
  504   2HB   ARG  72          1HB       ARG  72  -1.152  -2.415  -6.363
  505   1HG   ARG  72          2HG       ARG  72  -2.070  -0.577  -7.367
  506   2HG   ARG  72          1HG       ARG  72  -2.338  -1.411  -8.898
  507   1HD   ARG  72          2HD       ARG  72  -3.913  -2.795  -7.087
  508   2HD   ARG  72          1HD       ARG  72  -4.098  -1.109  -6.610
  509    HE   ARG  72           HE       ARG  72  -5.207  -2.352  -8.901
  510   1HH1  ARG  72          1HH1      ARG  72  -3.796   0.645  -7.816
  511   2HH1  ARG  72          2HH1      ARG  72  -4.641   1.611  -8.979
  512   1HH2  ARG  72          1HH2      ARG  72  -6.320  -1.088 -10.433
  513   2HH2  ARG  72          2HH2      ARG  72  -6.076   0.626 -10.465
  514    H    ASP  73           H        ASP  73  -1.358  -5.019  -8.554
  515    HA   ASP  73           HA       ASP  73  -1.107  -4.998 -11.480
  516   1HB   ASP  73          2HB       ASP  73  -0.215  -6.923  -9.955
  517   2HB   ASP  73          1HB       ASP  73  -1.905  -7.416  -9.892
  518    H    ASN  74           H        ASN  74  -2.852  -4.821 -12.731
  519    HA   ASN  74           HA       ASN  74  -5.426  -4.395 -11.544
  520   1HB   ASN  74          2HB       ASN  74  -6.021  -4.448 -14.150
  521   2HB   ASN  74          1HB       ASN  74  -5.261  -3.054 -13.390
  522   1HD2  ASN  74          1HD2      ASN  74  -4.632  -5.977 -15.237
  523   2HD2  ASN  74          2HD2      ASN  74  -3.167  -5.422 -15.965
  524    H    ALA  75           H        ALA  75  -7.233  -5.675 -11.624
  525    HA   ALA  75           HA       ALA  75  -8.452  -7.598 -11.649
  526   1HB   ALA  75          1HB       ALA  75  -8.172  -7.281 -14.100
  527   2HB   ALA  75          2HB       ALA  75  -8.368  -8.966 -13.618
  528   3HB   ALA  75          3HB       ALA  75  -6.769  -8.348 -14.033
  529    H    LYS  76           H        LYS  76  -5.961  -7.468 -10.124
  530    HA   LYS  76           HA       LYS  76  -5.581 -10.351  -9.764
  531   1HB   LYS  76          2HB       LYS  76  -3.647  -8.652 -10.893
  532   2HB   LYS  76          1HB       LYS  76  -3.115  -8.950  -9.242
  533   1HG   LYS  76          2HG       LYS  76  -4.005 -11.295 -10.810
  534   2HG   LYS  76          1HG       LYS  76  -2.480 -10.540 -11.277
  535   1HD   LYS  76          2HD       LYS  76  -1.753 -10.717  -8.893
  536   2HD   LYS  76          1HD       LYS  76  -3.219 -11.643  -8.569
  537   1HE   LYS  76          2HE       LYS  76  -2.494 -13.259 -10.327
  538   2HE   LYS  76          1HE       LYS  76  -0.971 -12.378 -10.438
  539   1HZ   LYS  76          1HZ       LYS  76  -0.208 -13.422  -8.653
  540   2HZ   LYS  76          2HZ       LYS  76  -1.567 -14.427  -8.706
  541   3HZ   LYS  76          3HZ       LYS  76  -1.581 -13.037  -7.742
  542    H    ASN  77           H        ASN  77  -3.524  -9.956  -7.762
  543    HA   ASN  77           HA       ASN  77  -4.768  -8.328  -5.701
  544   1HB   ASN  77          2HB       ASN  77  -4.847 -11.294  -5.768
  545   2HB   ASN  77          1HB       ASN  77  -4.447 -10.553  -4.221
  546   1HD2  ASN  77          1HD2      ASN  77  -6.016  -9.648  -3.034
  547   2HD2  ASN  77          2HD2      ASN  77  -7.675  -9.552  -3.510
  548    H    THR  78           H        THR  78  -2.633  -7.303  -6.255
  549    HA   THR  78           HA       THR  78  -0.686  -8.113  -4.292
  550    HB   THR  78           HB       THR  78   0.607  -7.826  -6.930
  551    HG1  THR  78           1HG      THR  78  -0.968  -9.241  -7.597
  552   1HG2  THR  78          1HG2      THR  78   2.133  -9.434  -6.027
  553   2HG2  THR  78          2HG2      THR  78   1.011  -9.851  -4.732
  554   3HG2  THR  78          3HG2      THR  78   1.778  -8.264  -4.758
  555    H    LEU  79           H        LEU  79   0.846  -6.534  -3.826
  556    HA   LEU  79           HA       LEU  79   0.503  -3.940  -5.178
  557   1HB   LEU  79          2HB       LEU  79  -0.581  -4.088  -2.894
  558   2HB   LEU  79          1HB       LEU  79   1.025  -4.303  -2.227
  559    HG   LEU  79           HG       LEU  79   1.658  -2.079  -3.163
  560   1HD1  LEU  79          1HD1      LEU  79  -0.038  -0.568  -3.947
  561   2HD1  LEU  79          2HD1      LEU  79  -1.290  -1.788  -3.706
  562   3HD1  LEU  79          3HD1      LEU  79  -0.055  -2.023  -4.944
  563   1HD2  LEU  79          1HD2      LEU  79   1.017  -1.067  -1.259
  564   2HD2  LEU  79          2HD2      LEU  79   0.406  -2.668  -0.842
  565   3HD2  LEU  79          3HD2      LEU  79  -0.686  -1.453  -1.505
  566    H    TYR  80           H        TYR  80   2.364  -3.147  -5.968
  567    HA   TYR  80           HA       TYR  80   4.876  -4.302  -4.952
  568   1HB   TYR  80          2HB       TYR  80   4.216  -3.213  -7.693
  569   2HB   TYR  80          1HB       TYR  80   5.821  -3.731  -7.189
  570    HD1  TYR  80           1HD      TYR  80   2.324  -4.987  -7.508
  571    HD2  TYR  80           2HD      TYR  80   6.471  -5.935  -7.519
  572    HE1  TYR  80           1HE      TYR  80   1.790  -7.284  -8.199
  573    HE2  TYR  80           2HE      TYR  80   5.950  -8.235  -8.210
  574    HH   TYR  80           HH       TYR  80   2.591  -9.307  -8.649
  575    H    LEU  81           H        LEU  81   6.740  -2.992  -4.860
  576    HA   LEU  81           HA       LEU  81   6.309  -0.091  -4.884
  577   1HB   LEU  81          2HB       LEU  81   6.152  -1.136  -2.532
  578   2HB   LEU  81          1HB       LEU  81   7.873  -1.424  -2.684
  579    HG   LEU  81           HG       LEU  81   7.242   0.632  -1.395
  580   1HD1  LEU  81          1HD1      LEU  81   8.761   1.776  -3.596
  581   2HD1  LEU  81          2HD1      LEU  81   9.360   0.208  -3.054
  582   3HD1  LEU  81          3HD1      LEU  81   9.207   1.539  -1.906
  583   1HD2  LEU  81          1HD2      LEU  81   5.444   1.126  -3.315
  584   2HD2  LEU  81          2HD2      LEU  81   6.774   2.138  -3.878
  585   3HD2  LEU  81          3HD2      LEU  81   6.111   2.373  -2.259
  586    H    GLN  82           H        GLN  82   8.055   1.086  -5.526
  587    HA   GLN  82           HA       GLN  82  10.363  -0.468  -6.488
  588   1HB   GLN  82          2HB       GLN  82   9.010   0.710  -8.217
  589   2HB   GLN  82          1HB       GLN  82   9.399   2.236  -7.438
  590   1HG   GLN  82          2HG       GLN  82  10.936   2.166  -9.139
  591   2HG   GLN  82          1HG       GLN  82  11.858   1.497  -7.794
  592   1HE2  GLN  82          1HE2      GLN  82  12.369  -0.682  -7.781
  593   2HE2  GLN  82          2HE2      GLN  82  12.226  -1.676  -9.188
  594    H    MET  83           H        MET  83  11.887  -0.375  -4.966
  595    HA   MET  83           HA       MET  83  12.323   2.065  -3.454
  596   1HB   MET  83          2HB       MET  83  14.202  -0.159  -3.060
  597   2HB   MET  83          1HB       MET  83  13.277   0.761  -1.880
  598   1HG   MET  83          2HG       MET  83  11.258  -0.563  -2.671
  599   2HG   MET  83          1HG       MET  83  12.412  -1.621  -3.479
  600   1HE   MET  83          1HE       MET  83  10.895  -0.310  -0.282
  601   2HE   MET  83          2HE       MET  83  11.159  -1.656   0.827
  602   3HE   MET  83          3HE       MET  83  10.197  -1.892  -0.631
  603    H    ASN  84           H        ASN  84  13.092   3.413  -5.124
  604    HA   ASN  84           HA       ASN  84  15.817   2.772  -6.047
  605   1HB   ASN  84          2HB       ASN  84  13.581   4.290  -7.371
  606   2HB   ASN  84          1HB       ASN  84  15.256   4.528  -7.859
  607   1HD2  ASN  84          1HD2      ASN  84  15.015   3.677  -9.883
  608   2HD2  ASN  84          2HD2      ASN  84  14.720   2.001 -10.177
  609    H    SER  85           H        SER  85  17.125   4.825  -6.514
  610    HA   SER  85           HA       SER  85  18.227   6.620  -5.646
  611   1HB   SER  85          2HB       SER  85  15.467   7.362  -5.894
  612   2HB   SER  85          1HB       SER  85  16.140   8.134  -4.459
  613    HG   SER  85           HG       SER  85  16.428   9.363  -6.399
  614    H    LEU  86           H        LEU  86  17.614   4.279  -3.944
  615    HA   LEU  86           HA       LEU  86  16.979   4.931  -1.326
  616   1HB   LEU  86          2HB       LEU  86  19.099   2.908  -1.957
  617   2HB   LEU  86          1HB       LEU  86  17.870   2.861  -0.707
  618    HG   LEU  86           HG       LEU  86  16.311   2.848  -2.928
  619   1HD1  LEU  86          1HD1      LEU  86  17.881   2.677  -4.614
  620   2HD1  LEU  86          2HD1      LEU  86  17.466   0.989  -4.319
  621   3HD1  LEU  86          3HD1      LEU  86  18.955   1.660  -3.654
  622   1HD2  LEU  86          1HD2      LEU  86  15.805   1.281  -1.331
  623   2HD2  LEU  86          2HD2      LEU  86  17.467   0.704  -1.210
  624   3HD2  LEU  86          3HD2      LEU  86  16.476   0.254  -2.599
  625    H    LYS  87           H        LYS  87  18.205   5.428   0.510
  626    HA   LYS  87           HA       LYS  87  21.012   6.014   0.306
  627   1HB   LYS  87          2HB       LYS  87  20.269   8.464   1.236
  628   2HB   LYS  87          1HB       LYS  87  20.726   8.125  -0.427
  629   1HG   LYS  87          2HG       LYS  87  18.725   9.381  -0.501
  630   2HG   LYS  87          1HG       LYS  87  18.295   7.718  -0.906
  631   1HD   LYS  87          2HD       LYS  87  17.463   7.344   1.330
  632   2HD   LYS  87          1HD       LYS  87  18.016   8.941   1.838
  633   1HE   LYS  87          2HE       LYS  87  16.420   9.408  -0.396
  634   2HE   LYS  87          1HE       LYS  87  15.563   8.169   0.521
  635   1HZ   LYS  87          1HZ       LYS  87  14.952  10.445   1.166
  636   2HZ   LYS  87          2HZ       LYS  87  16.545  10.729   1.659
  637   3HZ   LYS  87          3HZ       LYS  87  15.610   9.567   2.454
  638    H    SER  88           H        SER  88  20.286   4.231   1.946
  639    HA   SER  88           HA       SER  88  20.312   3.531   4.104
  640   1HB   SER  88          2HB       SER  88  22.069   5.502   4.116
  641   2HB   SER  88          1HB       SER  88  20.856   6.285   5.126
  642    HG   SER  88           HG       SER  88  22.367   5.080   6.359
  643    H    GLU  89           H        GLU  89  18.033   5.516   2.912
  644    HA   GLU  89           HA       GLU  89  16.560   5.815   5.426
  645   1HB   GLU  89          2HB       GLU  89  16.058   7.790   4.483
  646   2HB   GLU  89          1HB       GLU  89  16.660   7.274   2.917
  647   1HG   GLU  89          2HG       GLU  89  14.607   6.804   2.135
  648   2HG   GLU  89          1HG       GLU  89  14.041   6.169   3.679
  649    H    ASP  90           H        ASP  90  16.692   3.957   2.540
  650    HA   ASP  90           HA       ASP  90  14.006   2.928   2.716
  651   1HB   ASP  90          2HB       ASP  90  14.810   2.958   0.521
  652   2HB   ASP  90          1HB       ASP  90  16.398   2.361   0.993
  653    H    THR  91           H        THR  91  17.074   2.179   4.065
  654    HA   THR  91           HA       THR  91  16.864  -0.574   4.491
  655    HB   THR  91           HB       THR  91  18.169   1.416   6.352
  656    HG1  THR  91           1HG      THR  91  19.890   1.378   5.009
  657   1HG2  THR  91          1HG2      THR  91  17.891  -1.384   6.494
  658   2HG2  THR  91          2HG2      THR  91  18.904  -0.346   7.496
  659   3HG2  THR  91          3HG2      THR  91  19.561  -1.066   6.027
  660    H    ALA  92           H        ALA  92  14.769  -1.137   5.099
  661    HA   ALA  92           HA       ALA  92  14.242  -1.316   7.846
  662   1HB   ALA  92          1HB       ALA  92  13.408   0.715   8.269
  663   2HB   ALA  92          2HB       ALA  92  11.992   0.185   7.362
  664   3HB   ALA  92          3HB       ALA  92  13.261   1.106   6.556
  665    H    VAL  93           H        VAL  93  11.737  -1.867   8.155
  666    HA   VAL  93           HA       VAL  93  11.200  -3.959   6.199
  667    HB   VAL  93           HB       VAL  93   9.616  -3.348   8.697
  668   1HG1  VAL  93          1HG1      VAL  93   9.728  -5.612   6.750
  669   2HG1  VAL  93          2HG1      VAL  93   8.326  -4.789   7.434
  670   3HG1  VAL  93          3HG1      VAL  93   9.259  -5.914   8.423
  671   1HG2  VAL  93          1HG2      VAL  93  11.217  -5.602   9.134
  672   2HG2  VAL  93          2HG2      VAL  93  11.360  -4.020   9.901
  673   3HG2  VAL  93          3HG2      VAL  93  12.289  -4.382   8.446
  674    H    TYR  94           H        TYR  94   9.297  -4.109   4.977
  675    HA   TYR  94           HA       TYR  94   7.651  -1.668   4.938
  676   1HB   TYR  94          2HB       TYR  94   8.759  -3.227   2.604
  677   2HB   TYR  94          1HB       TYR  94   7.446  -2.066   2.439
  678    HD1  TYR  94           1HD      TYR  94   7.981   0.120   1.906
  679    HD2  TYR  94           2HD      TYR  94  10.907  -2.288   3.839
  680    HE1  TYR  94           1HE      TYR  94   9.618   1.946   1.698
  681    HE2  TYR  94           2HE      TYR  94  12.547  -0.470   3.636
  682    HH   TYR  94           HH       TYR  94  11.850   2.586   3.121
  683    H    TYR  95           H        TYR  95   5.539  -1.953   5.083
  684    HA   TYR  95           HA       TYR  95   4.444  -4.643   4.593
  685   1HB   TYR  95          2HB       TYR  95   3.133  -2.753   6.512
  686   2HB   TYR  95          1HB       TYR  95   3.063  -4.510   6.457
  687    HD1  TYR  95           1HD      TYR  95   4.785  -5.855   7.498
  688    HD2  TYR  95           2HD      TYR  95   4.980  -1.606   7.606
  689    HE1  TYR  95           1HE      TYR  95   6.478  -5.983   9.277
  690    HE2  TYR  95           2HE      TYR  95   6.680  -1.725   9.380
  691    HH   TYR  95           HH       TYR  95   7.721  -4.839  10.725
  692    H    CYS  96           H        CYS  96   2.664  -4.788   3.332
  693    HA   CYS  96           HA       CYS  96   1.576  -2.289   2.248
  694   1HB   CYS  96          2HB       CYS  96   1.839  -3.298   0.258
  695   2HB   CYS  96          1HB       CYS  96   2.351  -4.787   1.042
  696    H    ALA  97           H        ALA  97  -0.620  -1.914   2.363
  697    HA   ALA  97           HA       ALA  97  -2.454  -3.930   3.273
  698   1HB   ALA  97          1HB       ALA  97  -1.264  -2.037   5.180
  699   2HB   ALA  97          2HB       ALA  97  -1.985  -3.629   5.443
  700   3HB   ALA  97          3HB       ALA  97  -3.020  -2.214   5.265
  701    H    LYS  98           H        LYS  98  -4.653  -3.039   3.692
  702    HA   LYS  98           HA       LYS  98  -5.306  -1.187   1.568
  703   1HB   LYS  98          2HB       LYS  98  -6.812  -2.951   1.624
  704   2HB   LYS  98          1HB       LYS  98  -6.858  -2.993   3.379
  705   1HG   LYS  98          2HG       LYS  98  -7.976  -0.622   3.051
  706   2HG   LYS  98          1HG       LYS  98  -8.388  -1.309   1.478
  707   1HD   LYS  98          2HD       LYS  98  -9.436  -3.220   2.585
  708   2HD   LYS  98          1HD       LYS  98  -9.008  -2.548   4.160
  709   1HE   LYS  98          2HE       LYS  98 -10.356  -0.526   2.714
  710   2HE   LYS  98          1HE       LYS  98 -11.294  -2.009   2.537
  711   1HZ   LYS  98          1HZ       LYS  98 -10.385  -0.874   5.128
  712   2HZ   LYS  98          2HZ       LYS  98 -11.366  -2.237   4.921
  713   3HZ   LYS  98          3HZ       LYS  98 -11.944  -0.708   4.491
  714    H    TYR  99           H        TYR  99  -6.110   0.843   1.764
  715    HA   TYR  99           HA       TYR  99  -5.650   2.196   4.275
  716   1HB   TYR  99          2HB       TYR  99  -5.534   2.913   1.577
  717   2HB   TYR  99          1HB       TYR  99  -6.902   3.815   2.217
  718    HD1  TYR  99           1HD      TYR  99  -6.503   5.873   3.179
  719    HD2  TYR  99           2HD      TYR  99  -3.350   3.020   3.066
  720    HE1  TYR  99           1HE      TYR  99  -4.965   7.546   4.115
  721    HE2  TYR  99           2HE      TYR  99  -1.803   4.685   4.005
  722    HH   TYR  99           HH       TYR  99  -2.195   6.905   5.539
  723    H    SER 100           H        SER 100  -7.158   3.268   5.519
  724    HA   SER 100           HA       SER 100  -9.991   2.843   4.860
  725   1HB   SER 100          2HB       SER 100  -8.645   1.461   6.860
  726   2HB   SER 100          1HB       SER 100  -9.465   2.759   7.726
  727    HG   SER 100           HG       SER 100 -10.824   0.964   7.538
  728    H    GLY 101           H        GLY 101  -7.530   4.746   6.462
  729   1HA   GLY 101          2HA       GLY 101  -9.330   7.052   6.377
  730   2HA   GLY 101          1HA       GLY 101  -8.643   6.622   7.937
  731    H    GLY 102           H        GLY 102  -6.489   7.046   8.362
  732   1HA   GLY 102          2HA       GLY 102  -5.008   8.457   6.234
  733   2HA   GLY 102          1HA       GLY 102  -5.124   9.127   7.856
  734    H    ALA 103           H        ALA 103  -5.001   6.111   8.689
  735    HA   ALA 103           HA       ALA 103  -2.077   5.846   8.440
  736   1HB   ALA 103          1HB       ALA 103  -1.855   6.031  10.640
  737   2HB   ALA 103          2HB       ALA 103  -2.923   4.646  10.866
  738   3HB   ALA 103          3HB       ALA 103  -3.594   6.275  10.805
  739    H    LEU 104           H        LEU 104  -1.401   3.926   7.695
  740    HA   LEU 104           HA       LEU 104  -3.320   1.921   7.011
  741   1HB   LEU 104          2HB       LEU 104  -1.114   2.588   5.792
  742   2HB   LEU 104          1HB       LEU 104  -0.362   1.461   6.907
  743    HG   LEU 104           HG       LEU 104  -1.692  -0.368   6.055
  744   1HD1  LEU 104          1HD1      LEU 104  -3.652   1.269   5.550
  745   2HD1  LEU 104          2HD1      LEU 104  -3.440  -0.185   4.573
  746   3HD1  LEU 104          3HD1      LEU 104  -2.896   1.379   3.961
  747   1HD2  LEU 104          1HD2      LEU 104  -0.205   1.317   4.097
  748   2HD2  LEU 104          2HD2      LEU 104  -1.057  -0.120   3.529
  749   3HD2  LEU 104          3HD2      LEU 104   0.199  -0.268   4.759
  750    H    ASP 105           H        ASP 105  -3.437  -0.214   7.736
  751    HA   ASP 105           HA       ASP 105  -2.732  -0.531  10.540
  752   1HB   ASP 105          2HB       ASP 105  -4.912  -1.322   8.967
  753   2HB   ASP 105          1HB       ASP 105  -4.068  -2.815   9.364
  754    H    ALA 106           H        ALA 106  -1.991  -1.933   7.413
  755    HA   ALA 106           HA       ALA 106  -0.337  -3.317   6.700
  756   1HB   ALA 106          1HB       ALA 106   1.205  -1.846   7.731
  757   2HB   ALA 106          2HB       ALA 106   1.708  -3.489   8.136
  758   3HB   ALA 106          3HB       ALA 106   0.864  -2.504   9.332
  759    H    TRP 107           H        TRP 107  -1.613  -5.174   6.636
  760    HA   TRP 107           HA       TRP 107  -1.507  -6.941   8.960
  761   1HB   TRP 107          2HB       TRP 107  -3.054  -7.585   6.472
  762   2HB   TRP 107          1HB       TRP 107  -3.365  -8.092   8.128
  763    HD1  TRP 107           HD       TRP 107  -3.623  -5.465   9.658
  764    HE1  TRP 107           1HE      TRP 107  -5.497  -3.774   9.167
  765    HE3  TRP 107           3HE      TRP 107  -4.767  -6.909   4.906
  766    HZ2  TRP 107           2HZ      TRP 107  -7.227  -3.133   7.028
  767    HZ3  TRP 107           3HZ      TRP 107  -6.531  -5.703   3.699
  768    HH2  TRP 107           HH       TRP 107  -7.731  -3.859   4.738
  769    H    GLY 108           H        GLY 108  -0.090  -6.418   5.970
  770   1HA   GLY 108          2HA       GLY 108   0.582  -8.928   5.017
  771   2HA   GLY 108          1HA       GLY 108   1.596  -7.506   4.844
  772    H    GLN 109           H        GLN 109   2.849  -9.856   4.995
  773    HA   GLN 109           HA       GLN 109   3.505 -10.662   7.653
  774   1HB   GLN 109          2HB       GLN 109   3.845 -11.744   5.146
  775   2HB   GLN 109          1HB       GLN 109   5.484 -11.282   5.584
  776   1HG   GLN 109          2HG       GLN 109   4.157 -12.600   7.777
  777   2HG   GLN 109          1HG       GLN 109   4.133 -13.593   6.320
  778   1HE2  GLN 109          1HE2      GLN 109   6.482 -12.982   5.132
  779   2HE2  GLN 109          2HE2      GLN 109   7.806 -13.458   6.133
  780    H    GLY 110           H        GLY 110   4.952  -8.470   5.304
  781   1HA   GLY 110          2HA       GLY 110   6.227  -6.578   5.994
  782   2HA   GLY 110          1HA       GLY 110   6.690  -7.456   7.443
  783    H    THR 111           H        THR 111   7.643  -6.484   4.381
  784    HA   THR 111           HA       THR 111   9.604  -8.603   4.015
  785    HB   THR 111           HB       THR 111   8.546  -7.845   1.996
  786    HG1  THR 111           1HG      THR 111  11.005  -8.102   2.181
  787   1HG2  THR 111          1HG2      THR 111   9.595  -5.077   2.583
  788   2HG2  THR 111          2HG2      THR 111   7.927  -5.580   2.854
  789   3HG2  THR 111          3HG2      THR 111   8.593  -5.570   1.220
  790    H    GLN 112           H        GLN 112  11.688  -8.465   4.588
  791    HA   GLN 112           HA       GLN 112  12.582  -6.055   5.945
  792   1HB   GLN 112          2HB       GLN 112  12.930  -8.272   6.985
  793   2HB   GLN 112          1HB       GLN 112  13.959  -8.728   5.635
  794   1HG   GLN 112          2HG       GLN 112  15.570  -8.084   7.074
  795   2HG   GLN 112          1HG       GLN 112  15.226  -6.509   6.362
  796   1HE2  GLN 112          1HE2      GLN 112  15.323  -5.029   7.885
  797   2HE2  GLN 112          2HE2      GLN 112  14.641  -5.146   9.468
  798    H    VAL 113           H        VAL 113  13.307  -4.504   4.621
  799    HA   VAL 113           HA       VAL 113  15.109  -5.264   2.418
  800    HB   VAL 113           HB       VAL 113  13.543  -2.708   2.809
  801   1HG1  VAL 113          1HG1      VAL 113  15.301  -1.936   1.583
  802   2HG1  VAL 113          2HG1      VAL 113  14.304  -2.567   0.272
  803   3HG1  VAL 113          3HG1      VAL 113  15.655  -3.517   0.887
  804   1HG2  VAL 113          1HG2      VAL 113  12.584  -5.120   1.974
  805   2HG2  VAL 113          2HG2      VAL 113  13.043  -4.367   0.446
  806   3HG2  VAL 113          3HG2      VAL 113  11.908  -3.554   1.524
  807    H    THR 114           H        THR 114  17.162  -4.448   2.308
  808    HA   THR 114           HA       THR 114  17.953  -2.471   4.329
  809    HB   THR 114           HB       THR 114  19.623  -4.924   3.793
  810    HG1  THR 114           1HG      THR 114  17.498  -5.294   4.876
  811   1HG2  THR 114          1HG2      THR 114  20.168  -2.471   5.037
  812   2HG2  THR 114          2HG2      THR 114  21.155  -3.933   5.076
  813   3HG2  THR 114          3HG2      THR 114  19.966  -3.636   6.346
  814    H    VAL 115           H        VAL 115  19.824  -1.284   3.876
  815    HA   VAL 115           HA       VAL 115  20.810  -1.457   1.104
  816    HB   VAL 115           HB       VAL 115  20.517   1.149   2.579
  817   1HG1  VAL 115          1HG1      VAL 115  21.897   1.612   0.837
  818   2HG1  VAL 115          2HG1      VAL 115  20.352   1.795   0.007
  819   3HG1  VAL 115          3HG1      VAL 115  21.269   0.298  -0.157
  820   1HG2  VAL 115          1HG2      VAL 115  18.519  -0.125   0.715
  821   2HG2  VAL 115          2HG2      VAL 115  18.458   1.544   1.281
  822   3HG2  VAL 115          3HG2      VAL 115  18.289   0.216   2.430
  823    H    SER 116           H        SER 116  22.853  -2.134   1.265
  824    HA   SER 116           HA       SER 116  24.557  -0.902   3.324
  825   1HB   SER 116          2HB       SER 116  24.251  -3.232   3.866
  826   2HB   SER 116          1HB       SER 116  24.651  -3.718   2.219
  827    HG   SER 116           HG       SER 116  26.661  -3.712   2.791
  828    H    SER 117           H        SER 117  26.034  -3.033   1.073
  829    HA   SER 117           HA       SER 117  26.597  -1.232  -1.024
  830   1HB   SER 117          2HB       SER 117  29.061  -0.913  -0.443
  831   2HB   SER 117          1HB       SER 117  27.915   0.045   0.494
  832    HG   SER 117           HG       SER 117  29.739  -1.468   1.476
  833    H    GLN 118           H        GLN 118  25.808  -3.645  -1.392
  834    HA   GLN 118           HA       GLN 118  26.231  -5.609  -2.451
  835   1HB   GLN 118          2HB       GLN 118  29.039  -4.540  -2.780
  836   2HB   GLN 118          1HB       GLN 118  28.326  -5.877  -3.671
  837   1HG   GLN 118          2HG       GLN 118  26.800  -3.390  -3.830
  838   2HG   GLN 118          1HG       GLN 118  28.422  -3.292  -4.512
  839   1HE2  GLN 118          1HE2      GLN 118  28.780  -4.117  -6.470
  840   2HE2  GLN 118          2HE2      GLN 118  27.644  -5.046  -7.380
  841    H    SER 119           H        SER 119  27.296  -7.689  -2.196
  842    HA   SER 119           HA       SER 119  29.038  -7.991   0.114
  843   1HB   SER 119          2HB       SER 119  27.619  -9.249   1.432
  844   2HB   SER 119          1HB       SER 119  26.467  -8.124   0.713
  845    HG   SER 119           HG       SER 119  26.143 -10.598   0.666
  846    H    GLU 120           H        GLU 120  27.478  -9.271  -2.718
  847    HA   GLU 120           HA       GLU 120  28.024 -10.915  -4.185
  848   1HB   GLU 120          2HB       GLU 120  30.728 -10.734  -2.841
  849   2HB   GLU 120          1HB       GLU 120  30.401 -11.563  -4.357
  850   1HG   GLU 120          2HG       GLU 120  29.610  -9.357  -5.268
  851   2HG   GLU 120          1HG       GLU 120  30.247  -8.615  -3.800
  852    H    GLN 121           H        GLN 121  30.256 -12.104  -1.726
  853    HA   GLN 121           HA       GLN 121  29.336 -14.744  -1.850
  854   1HB   GLN 121          2HB       GLN 121  30.582 -13.767   0.676
  855   2HB   GLN 121          1HB       GLN 121  30.905 -15.232  -0.238
  856   1HG   GLN 121          2HG       GLN 121  32.642 -14.287  -1.220
  857   2HG   GLN 121          1HG       GLN 121  31.638 -12.964  -1.810
  858   1HE2  GLN 121          1HE2      GLN 121  30.892 -11.771   0.544
  859   2HE2  GLN 121          2HE2      GLN 121  32.281 -11.104   1.323
  860    H    LYS 122           H        LYS 122  27.869 -15.909  -0.698
  861    HA   LYS 122           HA       LYS 122  26.261 -14.434   1.282
  862   1HB   LYS 122          2HB       LYS 122  25.388 -15.384  -1.175
  863   2HB   LYS 122          1HB       LYS 122  24.845 -16.610  -0.039
  864   1HG   LYS 122          2HG       LYS 122  23.086 -15.045  -0.269
  865   2HG   LYS 122          1HG       LYS 122  23.815 -14.766   1.313
  866   1HD   LYS 122          2HD       LYS 122  25.108 -12.900   0.373
  867   2HD   LYS 122          1HD       LYS 122  24.347 -13.174  -1.194
  868   1HE   LYS 122          2HE       LYS 122  22.909 -12.444   1.354
  869   2HE   LYS 122          1HE       LYS 122  23.287 -11.334   0.037
  870   1HZ   LYS 122          1HZ       LYS 122  21.240 -11.897  -0.649
  871   2HZ   LYS 122          2HZ       LYS 122  21.210 -13.345   0.224
  872   3HZ   LYS 122          3HZ       LYS 122  22.001 -13.275  -1.270
  873    H    LEU 123           H        LEU 123  26.472 -15.255   3.237
  874    HA   LEU 123           HA       LEU 123  26.833 -16.690   4.962
  875   1HB   LEU 123          2HB       LEU 123  24.673 -17.565   3.937
  876   2HB   LEU 123          1HB       LEU 123  25.649 -18.817   3.191
  877    HG   LEU 123           HG       LEU 123  26.224 -18.714   6.001
  878   1HD1  LEU 123          1HD1      LEU 123  23.912 -17.717   6.041
  879   2HD1  LEU 123          2HD1      LEU 123  24.120 -19.205   6.964
  880   3HD1  LEU 123          3HD1      LEU 123  23.329 -19.247   5.387
  881   1HD2  LEU 123          1HD2      LEU 123  26.319 -20.921   5.688
  882   2HD2  LEU 123          2HD2      LEU 123  26.056 -20.573   3.980
  883   3HD2  LEU 123          3HD2      LEU 123  24.691 -20.983   5.017
  884    H    ILE 124           H        ILE 124  29.150 -16.456   4.487
  885    HA   ILE 124           HA       ILE 124  30.469 -18.943   4.529
  886    HB   ILE 124           HB       ILE 124  29.971 -18.919   2.111
  887   1HG1  ILE 124          2HG1      ILE 124  32.922 -18.462   2.332
  888   2HG1  ILE 124          1HG1      ILE 124  32.188 -19.775   3.247
  889   1HG2  ILE 124          1HG2      ILE 124  30.458 -16.234   2.253
  890   2HG2  ILE 124          2HG2      ILE 124  30.329 -17.170   0.764
  891   3HG2  ILE 124          3HG2      ILE 124  31.914 -16.837   1.461
  892   1HD1  ILE 124          1HD1      ILE 124  31.465 -19.630   0.398
  893   2HD1  ILE 124          2HD1      ILE 124  31.828 -21.024   1.415
  894   3HD1  ILE 124          3HD1      ILE 124  33.141 -20.044   0.762
  895    H    SER 125           H        SER 125  32.656 -18.759   5.059
  896    HA   SER 125           HA       SER 125  33.557 -16.009   5.615
  897   1HB   SER 125          2HB       SER 125  33.153 -17.966   7.457
  898   2HB   SER 125          1HB       SER 125  34.853 -18.234   7.070
  899    HG   SER 125           HG       SER 125  34.400 -16.690   8.801
  900    H    GLU 126           H        GLU 126  35.174 -19.176   5.426
  901    HA   GLU 126           HA       GLU 126  37.495 -18.050   4.204
  902   1HB   GLU 126          2HB       GLU 126  38.096 -20.527   3.890
  903   2HB   GLU 126          1HB       GLU 126  37.919 -19.933   5.536
  904   1HG   GLU 126          2HG       GLU 126  35.383 -20.848   4.692
  905   2HG   GLU 126          1HG       GLU 126  36.569 -22.077   4.252
  906    H    GLU 127           H        GLU 127  38.334 -19.538   2.201
  907    HA   GLU 127           HA       GLU 127  38.240 -19.750  -0.062
  908   1HB   GLU 127          2HB       GLU 127  36.330 -21.379   0.952
  909   2HB   GLU 127          1HB       GLU 127  35.344 -20.359  -0.088
  910   1HG   GLU 127          2HG       GLU 127  37.521 -21.018  -1.664
  911   2HG   GLU 127          1HG       GLU 127  37.167 -22.498  -0.774
  912    H    ASP 128           H        ASP 128  36.153 -19.290  -1.893
  913    HA   ASP 128           HA       ASP 128  35.194 -17.637  -3.120
  914   1HB   ASP 128          2HB       ASP 128  34.389 -17.135  -0.422
  915   2HB   ASP 128          1HB       ASP 128  34.684 -15.590  -1.214
  916    H    LEU 129           H        LEU 129  36.482 -16.579  -4.457
  917    HA   LEU 129           HA       LEU 129  38.040 -15.151  -5.292
  918   1HB   LEU 129          2HB       LEU 129  36.815 -13.732  -3.037
  919   2HB   LEU 129          1HB       LEU 129  38.417 -13.150  -3.444
  920    HG   LEU 129           HG       LEU 129  37.278 -13.240  -5.908
  921   1HD1  LEU 129          1HD1      LEU 129  35.080 -12.164  -4.185
  922   2HD1  LEU 129          2HD1      LEU 129  35.110 -13.862  -4.661
  923   3HD1  LEU 129          3HD1      LEU 129  35.046 -12.602  -5.893
  924   1HD2  LEU 129          1HD2      LEU 129  37.180 -10.862  -5.780
  925   2HD2  LEU 129          2HD2      LEU 129  38.535 -11.391  -4.781
  926   3HD2  LEU 129          3HD2      LEU 129  37.018 -10.906  -4.025
  927    H    ASN 130           H        ASN 130  39.820 -13.493  -3.513
  928    HA   ASN 130           HA       ASN 130  41.894 -13.627  -2.594
  929   1HB   ASN 130          2HB       ASN 130  40.376 -15.072  -0.949
  930   2HB   ASN 130          1HB       ASN 130  41.413 -16.370  -1.532
  931   1HD2  ASN 130          1HD2      ASN 130  41.207 -15.222   1.125
  932   2HD2  ASN 130          2HD2      ASN 130  42.785 -14.647   1.528
  933    H    HIS 131           H        HIS 131  41.069 -15.127  -5.186
  934    HA   HIS 131           HA       HIS 131  42.144 -16.195  -6.875
  935   1HB   HIS 131          2HB       HIS 131  44.204 -14.891  -5.402
  936   2HB   HIS 131          1HB       HIS 131  44.807 -16.472  -5.888
  937    HD1  HIS 131           1HD      HIS 131  45.568 -13.512  -7.029
  938    HD2  HIS 131           2HD      HIS 131  43.322 -16.473  -8.889
  939    HE1  HIS 131           1HE      HIS 131  45.727 -13.030  -9.491
  940    HE2  HIS 131           2HE      HIS 131  44.286 -14.781 -10.590
  941    H    HIS 132           H        HIS 132  41.990 -18.277  -7.353
  942    HA   HIS 132           HA       HIS 132  41.795 -20.284  -5.400
  943   1HB   HIS 132          2HB       HIS 132  41.256 -20.080  -8.117
  944   2HB   HIS 132          1HB       HIS 132  42.525 -21.297  -8.033
  945    HD1  HIS 132           1HD      HIS 132  38.941 -20.844  -7.607
  946    HD2  HIS 132           2HD      HIS 132  41.817 -23.534  -6.281
  947    HE1  HIS 132           1HE      HIS 132  37.662 -22.856  -6.809
  948    HE2  HIS 132           2HE      HIS 132  39.419 -24.451  -5.962
  949    H    HIS 133           H        HIS 133  44.354 -19.773  -7.834
  950    HA   HIS 133           HA       HIS 133  46.183 -21.279  -6.083
  951   1HB   HIS 133          2HB       HIS 133  45.572 -21.650  -8.805
  952   2HB   HIS 133          1HB       HIS 133  47.187 -20.950  -8.767
  953    HD1  HIS 133           1HD      HIS 133  49.037 -22.329  -7.496
  954    HD2  HIS 133           2HD      HIS 133  45.405 -24.286  -7.991
  955    HE1  HIS 133           1HE      HIS 133  49.510 -24.752  -7.020
  956    HE2  HIS 133           2HE      HIS 133  47.304 -25.923  -7.354
  957    H    HIS 134           H        HIS 134  48.081 -20.378  -5.465
  958    HA   HIS 134           HA       HIS 134  48.402 -17.531  -5.975
  959   1HB   HIS 134          2HB       HIS 134  49.552 -19.463  -3.986
  960   2HB   HIS 134          1HB       HIS 134  50.332 -17.907  -4.258
  961    HD1  HIS 134           1HD      HIS 134  48.675 -15.768  -3.885
  962    HD2  HIS 134           2HD      HIS 134  47.513 -19.382  -2.196
  963    HE1  HIS 134           1HE      HIS 134  46.962 -15.176  -2.142
  964    HE2  HIS 134           2HE      HIS 134  46.224 -17.384  -1.178
  965    H    HIS 135           H        HIS 135  50.331 -20.504  -6.219
  966    HA   HIS 135           HA       HIS 135  52.158 -21.051  -7.452
  967   1HB   HIS 135          2HB       HIS 135  50.434 -19.537  -9.161
  968   2HB   HIS 135          1HB       HIS 135  52.104 -19.140  -9.554
  969    HD1  HIS 135           1HD      HIS 135  52.037 -20.382 -11.796
  970    HD2  HIS 135           2HD      HIS 135  51.184 -22.797  -8.524
  971    HE1  HIS 135           1HE      HIS 135  52.110 -22.741 -12.664
  972    HE2  HIS 135           2HE      HIS 135  51.681 -24.188 -10.647
  Start of MODEL    5
    1   1H    ASP   1          1HT       ASP   1 -12.078 -10.057  10.138
    2   2H    ASP   1          2HT       ASP   1 -10.675  -9.321  10.730
    3   3H    ASP   1          3HT       ASP   1 -10.561 -10.710   9.773
    4    HA   ASP   1           HA       ASP   1 -12.014  -8.874   8.297
    5   1HB   ASP   1          2HB       ASP   1 -10.008  -7.668  10.059
    6   2HB   ASP   1          1HB       ASP   1  -9.755  -7.283   8.360
    7    H    VAL   2           H        VAL   2  -9.854  -7.845   6.752
    8    HA   VAL   2           HA       VAL   2  -8.973 -10.331   5.509
    9    HB   VAL   2           HB       VAL   2  -9.191  -9.288   3.549
   10   1HG1  VAL   2          1HG1      VAL   2 -10.009  -6.753   4.930
   11   2HG1  VAL   2          2HG1      VAL   2 -11.027  -8.194   4.945
   12   3HG1  VAL   2          3HG1      VAL   2 -10.602  -7.429   3.413
   13   1HG2  VAL   2          1HG2      VAL   2  -7.496  -7.085   4.707
   14   2HG2  VAL   2          2HG2      VAL   2  -8.084  -7.090   3.044
   15   3HG2  VAL   2          3HG2      VAL   2  -7.003  -8.367   3.600
   16    H    GLN   3           H        GLN   3  -6.884 -10.948   5.290
   17    HA   GLN   3           HA       GLN   3  -4.833  -9.198   6.472
   18   1HB   GLN   3          2HB       GLN   3  -5.656 -11.551   7.584
   19   2HB   GLN   3          1HB       GLN   3  -4.314 -12.094   6.585
   20   1HG   GLN   3          2HG       GLN   3  -3.491  -9.749   7.944
   21   2HG   GLN   3          1HG       GLN   3  -4.243 -10.827   9.120
   22   1HE2  GLN   3          1HE2      GLN   3  -1.395 -10.006   7.800
   23   2HE2  GLN   3          2HE2      GLN   3  -0.525 -11.486   7.991
   24    H    LEU   4           H        LEU   4  -2.893  -9.052   5.407
   25    HA   LEU   4           HA       LEU   4  -2.784 -10.422   2.800
   26   1HB   LEU   4          2HB       LEU   4  -1.115  -8.041   3.077
   27   2HB   LEU   4          1HB       LEU   4  -2.220  -8.497   1.795
   28    HG   LEU   4           HG       LEU   4  -3.047  -7.233   4.411
   29   1HD1  LEU   4          1HD1      LEU   4  -2.576  -6.079   1.680
   30   2HD1  LEU   4          2HD1      LEU   4  -1.888  -5.572   3.222
   31   3HD1  LEU   4          3HD1      LEU   4  -3.595  -5.289   2.884
   32   1HD2  LEU   4          1HD2      LEU   4  -4.555  -8.720   2.609
   33   2HD2  LEU   4          2HD2      LEU   4  -4.905  -7.038   2.209
   34   3HD2  LEU   4          3HD2      LEU   4  -5.163  -7.625   3.852
   35    H    GLN   5           H        GLN   5  -0.378 -10.301   1.933
   36    HA   GLN   5           HA       GLN   5   1.526 -10.956   4.053
   37   1HB   GLN   5          2HB       GLN   5   0.655 -13.115   3.557
   38   2HB   GLN   5          1HB       GLN   5   0.695 -12.811   1.826
   39   1HG   GLN   5          2HG       GLN   5   2.865 -13.360   1.642
   40   2HG   GLN   5          1HG       GLN   5   3.291 -12.641   3.193
   41   1HE2  GLN   5          1HE2      GLN   5   0.756 -15.007   2.724
   42   2HE2  GLN   5          2HE2      GLN   5   1.524 -16.288   3.592
   43    H    ALA   6           H        ALA   6   3.342  -9.883   3.690
   44    HA   ALA   6           HA       ALA   6   3.942  -8.985   0.965
   45   1HB   ALA   6          1HB       ALA   6   4.166  -7.780   3.564
   46   2HB   ALA   6          2HB       ALA   6   4.295  -7.038   1.970
   47   3HB   ALA   6          3HB       ALA   6   5.720  -7.751   2.730
   48    H    SER   7           H        SER   7   5.697  -9.645  -0.122
   49    HA   SER   7           HA       SER   7   7.759 -11.163   1.322
   50   1HB   SER   7          2HB       SER   7   6.434 -12.869   0.321
   51   2HB   SER   7          1HB       SER   7   6.308 -11.980  -1.196
   52    HG   SER   7           HG       SER   7   7.991 -13.085  -1.771
   53    H    GLY   8           H        GLY   8   9.790 -11.381   0.108
   54   1HA   GLY   8          2HA       GLY   8  10.982 -10.569  -1.954
   55   2HA   GLY   8          1HA       GLY   8  10.250  -9.011  -1.597
   56    H    GLY   9           H        GLY   9  11.579  -7.618  -0.664
   57   1HA   GLY   9          2HA       GLY   9  13.164  -6.754   0.765
   58   2HA   GLY   9          1HA       GLY   9  13.129  -8.283   1.632
   59    H    GLY  10           H        GLY  10  14.804  -6.322  -0.618
   60   1HA   GLY  10          2HA       GLY  10  16.770  -8.490  -1.026
   61   2HA   GLY  10          1HA       GLY  10  16.463  -7.227  -2.205
   62    H    LEU  11           H        LEU  11  18.925  -7.306  -1.862
   63    HA   LEU  11           HA       LEU  11  19.645  -5.353   0.227
   64   1HB   LEU  11          2HB       LEU  11  20.681  -7.922  -0.207
   65   2HB   LEU  11          1HB       LEU  11  21.896  -6.828  -0.838
   66    HG   LEU  11           HG       LEU  11  22.511  -7.245   1.394
   67   1HD1  LEU  11          1HD1      LEU  11  22.704  -4.907   0.818
   68   2HD1  LEU  11          2HD1      LEU  11  22.246  -5.068   2.514
   69   3HD1  LEU  11          3HD1      LEU  11  21.035  -4.619   1.313
   70   1HD2  LEU  11          1HD2      LEU  11  20.195  -8.131   1.979
   71   2HD2  LEU  11          2HD2      LEU  11  19.791  -6.464   2.390
   72   3HD2  LEU  11          3HD2      LEU  11  21.087  -7.296   3.251
   73    H    VAL  12           H        VAL  12  19.794  -3.421  -0.765
   74    HA   VAL  12           HA       VAL  12  21.312  -3.312  -3.297
   75    HB   VAL  12           HB       VAL  12  19.950  -1.616  -4.161
   76   1HG1  VAL  12          1HG1      VAL  12  17.933  -2.675  -4.472
   77   2HG1  VAL  12          2HG1      VAL  12  17.828  -3.203  -2.791
   78   3HG1  VAL  12          3HG1      VAL  12  18.945  -4.001  -3.899
   79   1HG2  VAL  12          1HG2      VAL  12  18.420  -1.390  -1.582
   80   2HG2  VAL  12          2HG2      VAL  12  18.385  -0.308  -2.976
   81   3HG2  VAL  12          3HG2      VAL  12  19.819  -0.382  -1.952
   82    H    GLN  13           H        GLN  13  22.286  -1.209  -3.743
   83    HA   GLN  13           HA       GLN  13  23.363  -0.027  -1.271
   84   1HB   GLN  13          2HB       GLN  13  25.364   0.457  -2.430
   85   2HB   GLN  13          1HB       GLN  13  24.936  -1.176  -2.919
   86   1HG   GLN  13          2HG       GLN  13  24.092   1.160  -4.577
   87   2HG   GLN  13          1HG       GLN  13  25.735   0.531  -4.690
   88   1HE2  GLN  13          1HE2      GLN  13  25.384  -2.137  -4.479
   89   2HE2  GLN  13          2HE2      GLN  13  24.444  -2.730  -5.801
   90    HA   PRO  14           HA       PRO  14  21.546   3.923  -1.991
   91   1HB   PRO  14          2HB       PRO  14  24.295   5.079  -1.942
   92   2HB   PRO  14          1HB       PRO  14  22.864   5.542  -1.014
   93   1HG   PRO  14          2HG       PRO  14  24.815   4.165   0.142
   94   2HG   PRO  14          1HG       PRO  14  23.118   3.792   0.497
   95   1HD   PRO  14          2HD       PRO  14  25.057   2.325  -1.239
   96   2HD   PRO  14          1HD       PRO  14  23.792   1.687  -0.167
   97    H    GLY  15           H        GLY  15  20.928   3.490  -4.171
   98   1HA   GLY  15          2HA       GLY  15  21.176   5.142  -6.133
   99   2HA   GLY  15          1HA       GLY  15  22.792   4.465  -6.236
  100    H    GLY  16           H        GLY  16  21.138   1.902  -5.271
  101   1HA   GLY  16          2HA       GLY  16  20.942   0.826  -7.949
  102   2HA   GLY  16          1HA       GLY  16  20.740  -0.060  -6.448
  103    H    SER  17           H        SER  17  18.819  -1.009  -6.534
  104    HA   SER  17           HA       SER  17  16.428   0.469  -6.378
  105   1HB   SER  17          2HB       SER  17  17.289   0.161  -9.017
  106   2HB   SER  17          1HB       SER  17  16.056  -1.082  -8.808
  107    HG   SER  17           HG       SER  17  15.649   1.597  -8.000
  108    H    LEU  18           H        LEU  18  14.628  -0.834  -5.889
  109    HA   LEU  18           HA       LEU  18  15.104  -3.730  -5.769
  110   1HB   LEU  18          2HB       LEU  18  15.348  -2.135  -3.553
  111   2HB   LEU  18          1HB       LEU  18  13.672  -2.639  -3.452
  112    HG   LEU  18           HG       LEU  18  15.924  -4.613  -3.775
  113   1HD1  LEU  18          1HD1      LEU  18  16.000  -3.063  -1.689
  114   2HD1  LEU  18          2HD1      LEU  18  16.181  -4.806  -1.491
  115   3HD1  LEU  18          3HD1      LEU  18  14.632  -4.036  -1.147
  116   1HD2  LEU  18          1HD2      LEU  18  14.158  -5.948  -4.104
  117   2HD2  LEU  18          2HD2      LEU  18  13.019  -4.744  -3.501
  118   3HD2  LEU  18          3HD2      LEU  18  13.886  -5.781  -2.369
  119    H    ARG  19           H        ARG  19  13.232  -5.017  -5.774
  120    HA   ARG  19           HA       ARG  19  10.709  -3.597  -6.294
  121   1HB   ARG  19          2HB       ARG  19  11.748  -4.430  -8.412
  122   2HB   ARG  19          1HB       ARG  19  11.643  -6.064  -7.771
  123   1HG   ARG  19          2HG       ARG  19   9.216  -5.891  -7.680
  124   2HG   ARG  19          1HG       ARG  19   9.306  -4.233  -8.278
  125   1HD   ARG  19          2HD       ARG  19  10.419  -6.582  -9.793
  126   2HD   ARG  19          1HD       ARG  19   8.760  -6.019  -9.988
  127    HE   ARG  19           HE       ARG  19  11.122  -4.345 -10.559
  128   1HH1  ARG  19          1HH1      ARG  19   7.893  -5.443 -11.278
  129   2HH1  ARG  19          2HH1      ARG  19   7.713  -4.414 -12.660
  130   1HH2  ARG  19          1HH2      ARG  19  10.892  -2.989 -12.377
  131   2HH2  ARG  19          2HH2      ARG  19   9.417  -3.020 -13.285
  132    H    VAL  20           H        VAL  20   9.561  -4.039  -4.505
  133    HA   VAL  20           HA       VAL  20   9.569  -6.806  -3.507
  134    HB   VAL  20           HB       VAL  20   8.796  -5.983  -1.394
  135   1HG1  VAL  20          1HG1      VAL  20  10.627  -4.105  -1.047
  136   2HG1  VAL  20          2HG1      VAL  20  11.140  -4.657  -2.641
  137   3HG1  VAL  20          3HG1      VAL  20  11.062  -5.794  -1.297
  138   1HG2  VAL  20          1HG2      VAL  20   7.573  -3.989  -2.794
  139   2HG2  VAL  20          2HG2      VAL  20   8.907  -3.124  -2.030
  140   3HG2  VAL  20          3HG2      VAL  20   7.757  -4.023  -1.041
  141    H    SER  21           H        SER  21   7.479  -7.649  -2.688
  142    HA   SER  21           HA       SER  21   5.138  -6.501  -4.027
  143   1HB   SER  21          2HB       SER  21   4.493  -8.609  -5.003
  144   2HB   SER  21          1HB       SER  21   6.144  -8.254  -5.508
  145    HG   SER  21           HG       SER  21   5.405 -10.453  -4.484
  146    H    CYS  22           H        CYS  22   3.090  -7.560  -3.316
  147    HA   CYS  22           HA       CYS  22   3.165  -8.979  -0.802
  148   1HB   CYS  22          2HB       CYS  22   3.414  -6.578  -0.159
  149   2HB   CYS  22          1HB       CYS  22   1.860  -6.258  -0.918
  150    H    ALA  23           H        ALA  23   1.863 -10.593  -1.392
  151    HA   ALA  23           HA       ALA  23  -0.487 -10.101  -3.004
  152   1HB   ALA  23          1HB       ALA  23   0.246 -12.728  -1.750
  153   2HB   ALA  23          2HB       ALA  23   1.048 -12.129  -3.202
  154   3HB   ALA  23          3HB       ALA  23  -0.690 -12.427  -3.214
  155    H    ALA  24           H        ALA  24  -2.178  -9.219  -2.000
  156    HA   ALA  24           HA       ALA  24  -2.749  -9.806   0.779
  157   1HB   ALA  24          1HB       ALA  24  -3.917  -7.925  -1.242
  158   2HB   ALA  24          2HB       ALA  24  -3.071  -7.556   0.261
  159   3HB   ALA  24          3HB       ALA  24  -4.706  -8.217   0.309
  160    H    SER  25           H        SER  25  -4.600 -10.804   1.564
  161    HA   SER  25           HA       SER  25  -6.174 -12.309  -0.421
  162   1HB   SER  25          2HB       SER  25  -4.488 -13.628   1.026
  163   2HB   SER  25          1HB       SER  25  -5.616 -13.342   2.352
  164    HG   SER  25           HG       SER  25  -5.917 -14.906   0.053
  165    H    GLY  26           H        GLY  26  -8.265 -11.828  -0.403
  166   1HA   GLY  26          2HA       GLY  26 -10.137 -11.907   1.446
  167   2HA   GLY  26          1HA       GLY  26  -9.366 -10.394   1.897
  168    H    PHE  27           H        PHE  27  -8.836  -9.229  -0.508
  169    HA   PHE  27           HA       PHE  27 -11.428  -9.114  -1.885
  170   1HB   PHE  27          2HB       PHE  27 -11.413  -6.703  -1.874
  171   2HB   PHE  27          1HB       PHE  27 -11.242  -7.266  -0.216
  172    HD1  PHE  27           1HD      PHE  27  -9.581  -5.624  -3.023
  173    HD2  PHE  27           2HD      PHE  27  -9.187  -6.917   1.012
  174    HE1  PHE  27           1HE      PHE  27  -7.564  -4.242  -2.783
  175    HE2  PHE  27           2HE      PHE  27  -7.167  -5.534   1.260
  176    HZ   PHE  27           HZ       PHE  27  -6.354  -4.198  -0.643
  177    H    THR  28           H        THR  28 -10.939  -7.229  -3.762
  178    HA   THR  28           HA       THR  28  -8.598  -8.285  -5.211
  179    HB   THR  28           HB       THR  28 -11.114  -7.260  -6.523
  180    HG1  THR  28           1HG      THR  28 -10.551  -9.995  -6.479
  181   1HG2  THR  28          1HG2      THR  28  -9.327  -7.204  -8.057
  182   2HG2  THR  28          2HG2      THR  28 -10.175  -8.712  -8.403
  183   3HG2  THR  28          3HG2      THR  28  -8.673  -8.736  -7.477
  184    H    PHE  29           H        PHE  29  -7.298  -6.874  -6.313
  185    HA   PHE  29           HA       PHE  29  -7.333  -4.148  -5.440
  186   1HB   PHE  29          2HB       PHE  29  -5.532  -5.790  -7.189
  187   2HB   PHE  29          1HB       PHE  29  -5.359  -4.040  -7.147
  188    HD1  PHE  29           1HD      PHE  29  -6.003  -6.613  -4.518
  189    HD2  PHE  29           2HD      PHE  29  -3.525  -3.448  -5.913
  190    HE1  PHE  29           1HE      PHE  29  -4.626  -6.801  -2.487
  191    HE2  PHE  29           2HE      PHE  29  -2.144  -3.630  -3.887
  192    HZ   PHE  29           HZ       PHE  29  -2.693  -5.308  -2.171
  193    H    SER  30           H        SER  30  -6.458  -2.677  -7.533
  194    HA   SER  30           HA       SER  30  -7.191  -1.356  -9.229
  195   1HB   SER  30          2HB       SER  30  -6.867  -3.656 -10.384
  196   2HB   SER  30          1HB       SER  30  -8.629  -3.732 -10.389
  197    HG   SER  30           HG       SER  30  -7.319  -2.678 -12.235
  198    H    SER  31           H        SER  31  -8.989  -2.056  -6.857
  199    HA   SER  31           HA       SER  31 -11.287  -0.577  -7.824
  200   1HB   SER  31          2HB       SER  31 -12.015  -2.856  -8.246
  201   2HB   SER  31          1HB       SER  31 -11.566  -3.338  -6.611
  202    HG   SER  31           HG       SER  31 -13.892  -2.586  -7.300
  203    H    TYR  32           H        TYR  32  -9.257  -1.776  -5.329
  204    HA   TYR  32           HA       TYR  32 -10.702  -0.204  -3.306
  205   1HB   TYR  32          2HB       TYR  32  -8.985  -2.636  -3.182
  206   2HB   TYR  32          1HB       TYR  32  -8.948  -1.537  -1.807
  207    HD1  TYR  32           1HD      TYR  32 -10.624  -1.639  -0.173
  208    HD2  TYR  32           2HD      TYR  32 -11.272  -3.507  -3.941
  209    HE1  TYR  32           1HE      TYR  32 -12.687  -2.660   0.693
  210    HE2  TYR  32           2HE      TYR  32 -13.336  -4.532  -3.085
  211    HH   TYR  32           HH       TYR  32 -14.332  -4.120   0.289
  212    H    HIS  33           H        HIS  33  -8.951   0.491  -1.517
  213    HA   HIS  33           HA       HIS  33  -6.856   1.967  -2.972
  214   1HB   HIS  33          2HB       HIS  33  -7.989   2.946  -0.376
  215   2HB   HIS  33          1HB       HIS  33  -7.218   3.860  -1.667
  216    HD1  HIS  33           1HD      HIS  33  -8.706   4.775  -3.509
  217    HD2  HIS  33           2HD      HIS  33 -10.729   2.316  -0.838
  218    HE1  HIS  33           1HE      HIS  33 -11.147   5.072  -4.037
  219    HE2  HIS  33           2HE      HIS  33 -12.355   3.620  -2.370
  220    H    MET  34           H        MET  34  -5.029   0.836  -2.586
  221    HA   MET  34           HA       MET  34  -4.480   0.031   0.188
  222   1HB   MET  34          2HB       MET  34  -3.409  -1.023  -2.426
  223   2HB   MET  34          1HB       MET  34  -2.709  -1.439  -0.868
  224   1HG   MET  34          2HG       MET  34  -5.623  -1.833  -1.187
  225   2HG   MET  34          1HG       MET  34  -4.558  -2.925  -2.068
  226   1HE   MET  34          1HE       MET  34  -2.431  -3.655  -1.006
  227   2HE   MET  34          2HE       MET  34  -2.710  -4.916   0.196
  228   3HE   MET  34          3HE       MET  34  -2.040  -3.361   0.689
  229    H    ALA  35           H        ALA  35  -1.910  -0.132   0.450
  230    HA   ALA  35           HA       ALA  35  -0.447   2.013  -0.768
  231   1HB   ALA  35          1HB       ALA  35  -0.199   3.429   1.140
  232   2HB   ALA  35          2HB       ALA  35  -1.123   2.318   2.151
  233   3HB   ALA  35          3HB       ALA  35  -1.924   3.203   0.851
  234    H    TRP  36           H        TRP  36   1.744   2.187   0.035
  235    HA   TRP  36           HA       TRP  36   2.685  -0.334   1.209
  236   1HB   TRP  36          2HB       TRP  36   3.755   1.499  -0.848
  237   2HB   TRP  36          1HB       TRP  36   4.944   0.855   0.280
  238    HD1  TRP  36           HD       TRP  36   3.193   0.010  -2.855
  239    HE1  TRP  36           1HE      TRP  36   3.609  -2.441  -3.499
  240    HE3  TRP  36           3HE      TRP  36   5.183  -1.663   1.550
  241    HZ2  TRP  36           2HZ      TRP  36   4.637  -4.779  -2.303
  242    HZ3  TRP  36           3HZ      TRP  36   5.853  -4.025   1.715
  243    HH2  TRP  36           HH       TRP  36   5.586  -5.550  -0.175
  244    H    VAL  37           H        VAL  37   3.939  -0.344   3.009
  245    HA   VAL  37           HA       VAL  37   4.488   2.248   4.293
  246    HB   VAL  37           HB       VAL  37   4.057   1.019   6.492
  247   1HG1  VAL  37          1HG1      VAL  37   1.891   1.737   4.545
  248   2HG1  VAL  37          2HG1      VAL  37   2.537   2.692   5.881
  249   3HG1  VAL  37          3HG1      VAL  37   1.538   1.276   6.211
  250   1HG2  VAL  37          1HG2      VAL  37   2.867  -0.968   6.540
  251   2HG2  VAL  37          2HG2      VAL  37   4.005  -1.233   5.219
  252   3HG2  VAL  37          3HG2      VAL  37   2.332  -0.803   4.867
  253    H    ARG  38           H        ARG  38   6.143   2.070   6.068
  254    HA   ARG  38           HA       ARG  38   8.091  -0.083   5.678
  255   1HB   ARG  38          2HB       ARG  38   8.988   1.433   4.159
  256   2HB   ARG  38          1HB       ARG  38   8.479   2.827   5.097
  257   1HG   ARG  38          2HG       ARG  38  10.204   2.047   6.822
  258   2HG   ARG  38          1HG       ARG  38  10.840   1.043   5.516
  259   1HD   ARG  38          2HD       ARG  38  12.087   2.913   5.167
  260   2HD   ARG  38          1HD       ARG  38  10.681   3.331   4.189
  261    HE   ARG  38           HE       ARG  38  10.407   4.222   6.883
  262   1HH1  ARG  38          1HH1      ARG  38  11.907   4.976   3.829
  263   2HH1  ARG  38          2HH1      ARG  38  12.003   6.674   4.150
  264   1HH2  ARG  38          1HH2      ARG  38  10.530   6.457   7.313
  265   2HH2  ARG  38          2HH2      ARG  38  11.221   7.516   6.130
  266    H    GLN  39           H        GLN  39   9.532  -0.392   7.462
  267    HA   GLN  39           HA       GLN  39   9.177   1.348   9.782
  268   1HB   GLN  39          2HB       GLN  39   7.426  -0.279  10.072
  269   2HB   GLN  39          1HB       GLN  39   8.552  -1.604   9.804
  270   1HG   GLN  39          2HG       GLN  39   9.684  -1.134  11.862
  271   2HG   GLN  39          1HG       GLN  39   8.738   0.335  12.099
  272   1HE2  GLN  39          1HE2      GLN  39   6.219  -0.513  11.500
  273   2HE2  GLN  39          2HE2      GLN  39   5.708  -1.702  12.645
  274    H    ALA  40           H        ALA  40  11.069   1.805  10.597
  275    HA   ALA  40           HA       ALA  40  12.879   0.225  11.753
  276   1HB   ALA  40          1HB       ALA  40  14.135   0.714   9.094
  277   2HB   ALA  40          2HB       ALA  40  13.247  -0.771   9.444
  278   3HB   ALA  40          3HB       ALA  40  14.662  -0.344  10.401
  279    HA   PRO  41           HA       PRO  41  15.139   4.413  10.739
  280   1HB   PRO  41          2HB       PRO  41  13.049   5.874   9.241
  281   2HB   PRO  41          1HB       PRO  41  14.783   5.763   8.924
  282   1HG   PRO  41          2HG       PRO  41  13.013   4.510   7.361
  283   2HG   PRO  41          1HG       PRO  41  14.577   3.772   7.756
  284   1HD   PRO  41          2HD       PRO  41  11.872   3.215   8.923
  285   2HD   PRO  41          1HD       PRO  41  13.151   2.079   8.450
  286    H    GLY  42           H        GLY  42  11.776   5.460  10.395
  287   1HA   GLY  42          2HA       GLY  42  11.904   6.748  13.014
  288   2HA   GLY  42          1HA       GLY  42  10.617   6.928  11.822
  289    H    LYS  43           H        LYS  43  11.191   3.808  11.757
  290    HA   LYS  43           HA       LYS  43   9.977   1.994  12.329
  291   1HB   LYS  43          2HB       LYS  43  10.317   1.263  14.506
  292   2HB   LYS  43          1HB       LYS  43  11.644   2.377  14.222
  293   1HG   LYS  43          2HG       LYS  43  10.547   4.092  15.506
  294   2HG   LYS  43          1HG       LYS  43   9.106   3.086  15.682
  295   1HD   LYS  43          2HD       LYS  43  11.837   2.329  16.712
  296   2HD   LYS  43          1HD       LYS  43  10.594   3.113  17.687
  297   1HE   LYS  43          2HE       LYS  43   9.519   0.819  16.316
  298   2HE   LYS  43          1HE       LYS  43  10.942   0.370  17.256
  299   1HZ   LYS  43          1HZ       LYS  43   9.217   0.155  18.759
  300   2HZ   LYS  43          2HZ       LYS  43   8.396   1.523  18.196
  301   3HZ   LYS  43          3HZ       LYS  43   9.804   1.702  19.116
  302    H    GLY  44           H        GLY  44   8.212   1.368  14.348
  303   1HA   GLY  44          2HA       GLY  44   5.964   1.492  14.834
  304   2HA   GLY  44          1HA       GLY  44   6.156   3.243  14.780
  305    H    LEU  45           H        LEU  45   7.132   1.552  12.011
  306    HA   LEU  45           HA       LEU  45   6.353   1.339   9.907
  307   1HB   LEU  45          2HB       LEU  45   4.159   0.684  11.480
  308   2HB   LEU  45          1HB       LEU  45   3.532   1.869  10.356
  309    HG   LEU  45           HG       LEU  45   3.276   0.259   8.848
  310   1HD1  LEU  45          1HD1      LEU  45   6.033   0.736   8.715
  311   2HD1  LEU  45          2HD1      LEU  45   4.998   0.021   7.484
  312   3HD1  LEU  45          3HD1      LEU  45   5.830  -1.009   8.644
  313   1HD2  LEU  45          1HD2      LEU  45   4.543  -1.396  10.988
  314   2HD2  LEU  45          2HD2      LEU  45   4.125  -2.106   9.429
  315   3HD2  LEU  45          3HD2      LEU  45   2.870  -1.377  10.431
  316    H    GLU  46           H        GLU  46   5.418   2.564   8.130
  317    HA   GLU  46           HA       GLU  46   4.555   5.263   8.585
  318   1HB   GLU  46          2HB       GLU  46   6.572   6.241   8.601
  319   2HB   GLU  46          1HB       GLU  46   7.370   4.713   8.271
  320   1HG   GLU  46          2HG       GLU  46   7.602   5.154   6.067
  321   2HG   GLU  46          1HG       GLU  46   6.077   6.034   5.966
  322    H    TRP  47           H        TRP  47   3.201   5.773   6.995
  323    HA   TRP  47           HA       TRP  47   2.924   4.047   4.729
  324   1HB   TRP  47          2HB       TRP  47   0.870   4.913   5.410
  325   2HB   TRP  47          1HB       TRP  47   1.529   6.523   5.693
  326    HD1  TRP  47           HD       TRP  47   0.788   4.203   2.676
  327    HE1  TRP  47           1HE      TRP  47   0.112   5.680   0.687
  328    HE3  TRP  47           3HE      TRP  47   1.401   8.799   4.831
  329    HZ2  TRP  47           2HZ      TRP  47  -0.138   8.429   0.104
  330    HZ3  TRP  47           3HZ      TRP  47   0.923  10.804   3.487
  331    HH2  TRP  47           HH       TRP  47   0.169  10.621   1.172
  332    H    VAL  48           H        VAL  48   4.354   4.131   3.097
  333    HA   VAL  48           HA       VAL  48   5.743   6.599   2.503
  334    HB   VAL  48           HB       VAL  48   6.696   5.164   0.573
  335   1HG1  VAL  48          1HG1      VAL  48   8.484   5.063   1.890
  336   2HG1  VAL  48          2HG1      VAL  48   7.711   3.870   2.936
  337   3HG1  VAL  48          3HG1      VAL  48   7.451   5.592   3.218
  338   1HG2  VAL  48          1HG2      VAL  48   6.758   2.718   1.269
  339   2HG2  VAL  48          2HG2      VAL  48   5.299   3.309   0.475
  340   3HG2  VAL  48          3HG2      VAL  48   5.323   3.086   2.227
  341    H    SER  49           H        SER  49   3.806   4.308   0.587
  342    HA   SER  49           HA       SER  49   2.899   6.618  -1.020
  343   1HB   SER  49          2HB       SER  49   3.191   4.019  -2.414
  344   2HB   SER  49          1HB       SER  49   3.482   5.660  -3.000
  345    HG   SER  49           HG       SER  49   5.426   4.488  -2.770
  346    H    THR  50           H        THR  50   0.910   6.390  -2.136
  347    HA   THR  50           HA       THR  50  -0.851   4.192  -1.322
  348    HB   THR  50           HB       THR  50  -1.205   7.045  -0.593
  349    HG1  THR  50           1HG      THR  50  -2.072   6.114   1.194
  350   1HG2  THR  50          1HG2      THR  50  -2.991   7.119  -2.089
  351   2HG2  THR  50          2HG2      THR  50  -3.760   6.604  -0.587
  352   3HG2  THR  50          3HG2      THR  50  -3.396   5.420  -1.842
  353    H    ILE  51           H        ILE  51  -2.143   3.502  -2.962
  354    HA   ILE  51           HA       ILE  51  -2.245   5.202  -5.374
  355    HB   ILE  51           HB       ILE  51  -0.811   3.159  -5.593
  356   1HG1  ILE  51          2HG1      ILE  51  -2.973   2.639  -7.518
  357   2HG1  ILE  51          1HG1      ILE  51  -2.508   4.335  -7.395
  358   1HG2  ILE  51          1HG2      ILE  51  -1.652   1.342  -4.582
  359   2HG2  ILE  51          2HG2      ILE  51  -2.517   1.117  -6.102
  360   3HG2  ILE  51          3HG2      ILE  51  -3.319   1.899  -4.740
  361   1HD1  ILE  51          1HD1      ILE  51  -0.351   2.318  -7.658
  362   2HD1  ILE  51          2HD1      ILE  51  -0.438   3.972  -8.260
  363   3HD1  ILE  51          3HD1      ILE  51  -1.331   2.689  -9.077
  364    H    ASN  52           H        ASN  52  -4.134   5.183  -6.617
  365    HA   ASN  52           HA       ASN  52  -6.529   4.398  -5.122
  366   1HB   ASN  52          2HB       ASN  52  -6.429   6.153  -7.576
  367   2HB   ASN  52          1HB       ASN  52  -7.720   6.029  -6.384
  368   1HD2  ASN  52          1HD2      ASN  52  -6.318   8.385  -7.284
  369   2HD2  ASN  52          2HD2      ASN  52  -5.580   9.084  -5.888
  370    HA   PRO  53           HA       PRO  53  -7.830   1.082  -7.698
  371   1HB   PRO  53          2HB       PRO  53 -10.296   2.644  -8.315
  372   2HB   PRO  53          1HB       PRO  53 -10.131   0.988  -7.721
  373   1HG   PRO  53          2HG       PRO  53 -10.857   2.949  -6.077
  374   2HG   PRO  53          1HG       PRO  53  -9.757   1.667  -5.536
  375   1HD   PRO  53          2HD       PRO  53  -9.159   4.495  -6.267
  376   2HD   PRO  53          1HD       PRO  53  -8.407   3.463  -5.034
  377    H    GLY  54           H        GLY  54  -9.687   3.490  -9.471
  378   1HA   GLY  54          2HA       GLY  54  -7.965   2.957 -11.812
  379   2HA   GLY  54          1HA       GLY  54  -9.693   3.254 -11.905
  380    H    ASP  55           H        ASP  55  -8.601   5.333  -9.623
  381    HA   ASP  55           HA       ASP  55  -8.980   7.625 -11.196
  382   1HB   ASP  55          2HB       ASP  55  -8.761   7.114  -8.500
  383   2HB   ASP  55          1HB       ASP  55  -7.295   8.031  -8.832
  384    H    GLY  56           H        GLY  56  -5.952   6.343  -9.803
  385   1HA   GLY  56          2HA       GLY  56  -3.968   6.148 -11.164
  386   2HA   GLY  56          1HA       GLY  56  -4.524   7.533 -12.090
  387    H    SER  57           H        SER  57  -5.303   8.879  -9.507
  388    HA   SER  57           HA       SER  57  -2.975  10.411  -9.163
  389   1HB   SER  57          2HB       SER  57  -4.587  10.647  -6.827
  390   2HB   SER  57          1HB       SER  57  -4.476  11.760  -8.192
  391    HG   SER  57           HG       SER  57  -6.519  11.201  -8.365
  392    H    THR  58           H        THR  58  -1.465  10.505  -7.492
  393    HA   THR  58           HA       THR  58  -1.423   8.211  -5.651
  394    HB   THR  58           HB       THR  58   1.263   8.916  -6.279
  395    HG1  THR  58           1HG      THR  58   0.403   9.661  -8.290
  396   1HG2  THR  58          1HG2      THR  58   0.407   6.741  -5.447
  397   2HG2  THR  58          2HG2      THR  58   1.450   6.583  -6.860
  398   3HG2  THR  58          3HG2      THR  58  -0.301   6.449  -7.036
  399    H    TYR  59           H        TYR  59  -0.500   8.557  -3.652
  400    HA   TYR  59           HA       TYR  59   0.381  11.293  -3.038
  401   1HB   TYR  59          2HB       TYR  59  -1.355   9.681  -1.170
  402   2HB   TYR  59          1HB       TYR  59  -0.941  11.387  -1.061
  403    HD1  TYR  59           1HD      TYR  59  -3.125   8.916  -2.616
  404    HD2  TYR  59           2HD      TYR  59  -2.043  13.029  -2.511
  405    HE1  TYR  59           1HE      TYR  59  -5.194   9.484  -3.816
  406    HE2  TYR  59           2HE      TYR  59  -4.110  13.609  -3.711
  407    HH   TYR  59           HH       TYR  59  -6.147  11.205  -5.133
  408    H    TYR  60           H        TYR  60   2.048  11.460  -1.590
  409    HA   TYR  60           HA       TYR  60   3.075   8.948  -0.448
  410   1HB   TYR  60          2HB       TYR  60   4.566  11.120  -1.908
  411   2HB   TYR  60          1HB       TYR  60   5.385  10.052  -0.773
  412    HD1  TYR  60           1HD      TYR  60   6.459   8.235  -1.682
  413    HD2  TYR  60           2HD      TYR  60   3.007   9.753  -3.651
  414    HE1  TYR  60           1HE      TYR  60   6.742   6.560  -3.461
  415    HE2  TYR  60           2HE      TYR  60   3.280   8.083  -5.434
  416    HH   TYR  60           HH       TYR  60   5.460   6.719  -6.361
  417    H    ALA  61           H        ALA  61   4.729   9.408   1.311
  418    HA   ALA  61           HA       ALA  61   3.492  11.076   3.279
  419   1HB   ALA  61          1HB       ALA  61   4.546   9.724   4.689
  420   2HB   ALA  61          2HB       ALA  61   6.118  10.202   4.050
  421   3HB   ALA  61          3HB       ALA  61   5.226   8.880   3.297
  422    H    ASP  62           H        ASP  62   5.045  12.114   0.759
  423    HA   ASP  62           HA       ASP  62   6.013  14.098   0.220
  424   1HB   ASP  62          2HB       ASP  62   4.768  14.828   2.423
  425   2HB   ASP  62          1HB       ASP  62   6.402  14.884   3.078
  426    H    SER  63           H        SER  63   7.427  12.157   2.760
  427    HA   SER  63           HA       SER  63  10.103  13.124   2.093
  428   1HB   SER  63          2HB       SER  63   9.212  11.199   4.257
  429   2HB   SER  63          1HB       SER  63  10.846  11.829   4.046
  430    HG   SER  63           HG       SER  63  10.242  13.505   5.138
  431    H    VAL  64           H        VAL  64   8.129  11.129   0.661
  432    HA   VAL  64           HA       VAL  64  10.265   9.283  -0.133
  433    HB   VAL  64           HB       VAL  64   8.428   7.489  -0.324
  434   1HG1  VAL  64          1HG1      VAL  64  10.256   8.144   1.685
  435   2HG1  VAL  64          2HG1      VAL  64   9.498   6.578   1.394
  436   3HG1  VAL  64          3HG1      VAL  64   8.763   7.718   2.524
  437   1HG2  VAL  64          1HG2      VAL  64   7.090   8.664   2.005
  438   2HG2  VAL  64          2HG2      VAL  64   6.421   7.783   0.632
  439   3HG2  VAL  64          3HG2      VAL  64   6.790   9.501   0.481
  440    H    LYS  65           H        LYS  65   7.992  11.518  -1.017
  441    HA   LYS  65           HA       LYS  65   6.854  10.470  -3.355
  442   1HB   LYS  65          2HB       LYS  65   6.174  12.608  -2.250
  443   2HB   LYS  65          1HB       LYS  65   7.644  13.349  -2.867
  444   1HG   LYS  65          2HG       LYS  65   6.022  14.001  -4.389
  445   2HG   LYS  65          1HG       LYS  65   6.798  12.628  -5.181
  446   1HD   LYS  65          2HD       LYS  65   4.872  11.509  -5.246
  447   2HD   LYS  65          1HD       LYS  65   4.633  11.729  -3.512
  448   1HE   LYS  65          2HE       LYS  65   2.827  12.668  -5.013
  449   2HE   LYS  65          1HE       LYS  65   3.508  13.780  -3.826
  450   1HZ   LYS  65          1HZ       LYS  65   4.681  14.921  -5.453
  451   2HZ   LYS  65          2HZ       LYS  65   3.204  14.599  -6.211
  452   3HZ   LYS  65          3HZ       LYS  65   4.564  13.664  -6.581
  453    H    GLY  66           H        GLY  66   7.752   9.863  -5.210
  454   1HA   GLY  66          2HA       GLY  66   9.157  10.005  -7.077
  455   2HA   GLY  66          1HA       GLY  66  10.073  11.269  -6.263
  456    H    ARG  67           H        ARG  67  10.176   9.549  -3.819
  457    HA   ARG  67           HA       ARG  67  12.687   8.327  -4.301
  458   1HB   ARG  67          2HB       ARG  67  11.578   9.243  -2.086
  459   2HB   ARG  67          1HB       ARG  67  10.990   7.592  -1.947
  460   1HG   ARG  67          2HG       ARG  67  13.021   7.835  -0.692
  461   2HG   ARG  67          1HG       ARG  67  13.312   6.783  -2.081
  462   1HD   ARG  67          2HD       ARG  67  15.151   8.182  -2.136
  463   2HD   ARG  67          1HD       ARG  67  14.043   8.967  -3.262
  464    HE   ARG  67           HE       ARG  67  13.647  10.018  -0.684
  465   1HH1  ARG  67          1HH1      ARG  67  16.006  10.032  -3.254
  466   2HH1  ARG  67          2HH1      ARG  67  16.623  11.600  -2.850
  467   1HH2  ARG  67          1HH2      ARG  67  14.454  12.076  -0.149
  468   2HH2  ARG  67          2HH2      ARG  67  15.740  12.762  -1.084
  469    H    PHE  68           H        PHE  68   9.515   6.970  -3.462
  470    HA   PHE  68           HA       PHE  68  10.380   4.412  -4.645
  471   1HB   PHE  68          2HB       PHE  68   8.347   4.966  -2.478
  472   2HB   PHE  68          1HB       PHE  68   8.629   3.382  -3.189
  473    HD1  PHE  68           1HD      PHE  68   8.791   3.815  -0.305
  474    HD2  PHE  68           2HD      PHE  68  11.778   4.267  -3.310
  475    HE1  PHE  68           1HE      PHE  68  10.544   3.398   1.371
  476    HE2  PHE  68           2HE      PHE  68  13.531   3.847  -1.636
  477    HZ   PHE  68           HZ       PHE  68  12.914   3.413   0.706
  478    H    THR  69           H        THR  69   8.578   3.101  -5.561
  479    HA   THR  69           HA       THR  69   6.527   4.798  -6.825
  480    HB   THR  69           HB       THR  69   8.188   2.627  -8.116
  481    HG1  THR  69           1HG      THR  69   9.204   4.345  -8.804
  482   1HG2  THR  69          1HG2      THR  69   5.759   4.008  -9.271
  483   2HG2  THR  69          2HG2      THR  69   5.797   2.339  -8.703
  484   3HG2  THR  69          3HG2      THR  69   6.780   2.824 -10.085
  485    H    ILE  70           H        ILE  70   4.570   4.177  -6.322
  486    HA   ILE  70           HA       ILE  70   4.140   1.448  -5.358
  487    HB   ILE  70           HB       ILE  70   3.541   3.363  -3.891
  488   1HG1  ILE  70          2HG1      ILE  70   1.687   1.198  -4.701
  489   2HG1  ILE  70          1HG1      ILE  70   2.422   1.536  -3.139
  490   1HG2  ILE  70          1HG2      ILE  70   1.123   3.884  -5.542
  491   2HG2  ILE  70          2HG2      ILE  70   2.645   4.662  -5.976
  492   3HG2  ILE  70          3HG2      ILE  70   1.944   4.924  -4.378
  493   1HD1  ILE  70          1HD1      ILE  70   0.800   3.223  -2.670
  494   2HD1  ILE  70          2HD1      ILE  70  -0.030   1.740  -3.147
  495   3HD1  ILE  70          3HD1      ILE  70   0.120   3.077  -4.290
  496    H    SER  71           H        SER  71   3.268   0.044  -6.674
  497    HA   SER  71           HA       SER  71   1.061   0.775  -8.405
  498   1HB   SER  71          2HB       SER  71   3.149   1.173  -9.752
  499   2HB   SER  71          1HB       SER  71   3.518  -0.543  -9.581
  500    HG   SER  71           HG       SER  71   2.423  -0.448 -11.448
  501    H    ARG  72           H        ARG  72  -0.006  -1.122  -9.317
  502    HA   ARG  72           HA       ARG  72   0.726  -3.675  -8.100
  503   1HB   ARG  72          2HB       ARG  72  -1.442  -4.058  -7.149
  504   2HB   ARG  72          1HB       ARG  72  -0.848  -2.518  -6.545
  505   1HG   ARG  72          2HG       ARG  72  -2.469  -2.321  -8.978
  506   2HG   ARG  72          1HG       ARG  72  -3.325  -2.938  -7.563
  507   1HD   ARG  72          2HD       ARG  72  -3.476  -0.886  -6.737
  508   2HD   ARG  72          1HD       ARG  72  -1.720  -0.741  -6.745
  509    HE   ARG  72           HE       ARG  72  -1.843   0.456  -8.723
  510   1HH1  ARG  72          1HH1      ARG  72  -4.977  -0.794  -7.856
  511   2HH1  ARG  72          2HH1      ARG  72  -5.827   0.177  -9.012
  512   1HH2  ARG  72          1HH2      ARG  72  -2.954   1.738 -10.248
  513   2HH2  ARG  72          2HH2      ARG  72  -4.677   1.615 -10.371
  514    H    ASP  73           H        ASP  73  -0.753  -5.458  -8.910
  515    HA   ASP  73           HA       ASP  73  -1.072  -5.106 -11.794
  516   1HB   ASP  73          2HB       ASP  73  -0.171  -7.235 -10.110
  517   2HB   ASP  73          1HB       ASP  73  -1.575  -7.793 -11.014
  518    H    ASN  74           H        ASN  74  -2.974  -5.531 -12.885
  519    HA   ASN  74           HA       ASN  74  -5.387  -5.434 -11.238
  520   1HB   ASN  74          2HB       ASN  74  -6.243  -5.217 -13.838
  521   2HB   ASN  74          1HB       ASN  74  -5.864  -3.862 -12.780
  522   1HD2  ASN  74          1HD2      ASN  74  -3.911  -2.777 -13.029
  523   2HD2  ASN  74          2HD2      ASN  74  -2.957  -2.925 -14.461
  524    H    ALA  75           H        ALA  75  -3.582  -7.834 -12.176
  525    HA   ALA  75           HA       ALA  75  -5.818  -9.531 -13.076
  526   1HB   ALA  75          1HB       ALA  75  -3.638 -11.011 -13.679
  527   2HB   ALA  75          2HB       ALA  75  -2.998  -9.383 -13.900
  528   3HB   ALA  75          3HB       ALA  75  -4.421  -9.901 -14.803
  529    H    LYS  76           H        LYS  76  -4.190  -8.742 -10.391
  530    HA   LYS  76           HA       LYS  76  -4.939 -11.128  -9.009
  531   1HB   LYS  76          2HB       LYS  76  -2.541 -11.483  -8.132
  532   2HB   LYS  76          1HB       LYS  76  -2.942 -12.110  -9.725
  533   1HG   LYS  76          2HG       LYS  76  -1.939 -10.065 -10.718
  534   2HG   LYS  76          1HG       LYS  76  -1.420  -9.591  -9.100
  535   1HD   LYS  76          2HD       LYS  76   0.382 -10.878  -9.279
  536   2HD   LYS  76          1HD       LYS  76  -0.633 -12.293  -9.563
  537   1HE   LYS  76          2HE       LYS  76  -0.793 -11.380 -11.984
  538   2HE   LYS  76          1HE       LYS  76   0.634 -10.441 -11.545
  539   1HZ   LYS  76          1HZ       LYS  76   1.207 -12.971 -10.700
  540   2HZ   LYS  76          2HZ       LYS  76   1.790 -12.238 -12.107
  541   3HZ   LYS  76          3HZ       LYS  76   0.414 -13.220 -12.174
  542    H    ASN  77           H        ASN  77  -4.618 -10.963  -6.696
  543    HA   ASN  77           HA       ASN  77  -4.835  -8.220  -5.796
  544   1HB   ASN  77          2HB       ASN  77  -5.197  -9.394  -3.537
  545   2HB   ASN  77          1HB       ASN  77  -6.411  -9.649  -4.786
  546   1HD2  ASN  77          1HD2      ASN  77  -6.963 -11.531  -3.520
  547   2HD2  ASN  77          2HD2      ASN  77  -6.070 -12.993  -3.742
  548    H    THR  78           H        THR  78  -2.562  -7.746  -6.391
  549    HA   THR  78           HA       THR  78  -0.807  -8.324  -4.112
  550    HB   THR  78           HB       THR  78   0.527  -8.188  -6.751
  551    HG1  THR  78           1HG      THR  78  -0.491 -10.692  -5.971
  552   1HG2  THR  78          1HG2      THR  78   1.512 -10.330  -5.353
  553   2HG2  THR  78          2HG2      THR  78   1.000  -9.241  -4.064
  554   3HG2  THR  78          3HG2      THR  78   2.149  -8.686  -5.280
  555    H    LEU  79           H        LEU  79   0.830  -6.778  -3.735
  556    HA   LEU  79           HA       LEU  79   0.480  -4.218  -5.146
  557   1HB   LEU  79          2HB       LEU  79  -0.493  -4.333  -2.790
  558   2HB   LEU  79          1HB       LEU  79   1.157  -4.468  -2.220
  559    HG   LEU  79           HG       LEU  79   1.672  -2.270  -3.233
  560   1HD1  LEU  79          1HD1      LEU  79  -1.223  -1.717  -3.595
  561   2HD1  LEU  79          2HD1      LEU  79  -0.370  -2.587  -4.870
  562   3HD1  LEU  79          3HD1      LEU  79   0.179  -0.984  -4.375
  563   1HD2  LEU  79          1HD2      LEU  79  -0.665  -2.281  -1.330
  564   2HD2  LEU  79          2HD2      LEU  79   0.423  -0.922  -1.616
  565   3HD2  LEU  79          3HD2      LEU  79   1.038  -2.408  -0.892
  566    H    TYR  80           H        TYR  80   2.284  -3.487  -6.047
  567    HA   TYR  80           HA       TYR  80   4.862  -4.558  -5.102
  568   1HB   TYR  80          2HB       TYR  80   4.054  -3.640  -7.868
  569   2HB   TYR  80          1HB       TYR  80   5.681  -4.130  -7.413
  570    HD1  TYR  80           1HD      TYR  80   2.177  -5.385  -7.582
  571    HD2  TYR  80           2HD      TYR  80   6.317  -6.365  -7.581
  572    HE1  TYR  80           1HE      TYR  80   1.619  -7.715  -8.138
  573    HE2  TYR  80           2HE      TYR  80   5.774  -8.695  -8.134
  574    HH   TYR  80           HH       TYR  80   4.076 -10.039  -8.985
  575    H    LEU  81           H        LEU  81   6.741  -3.139  -5.429
  576    HA   LEU  81           HA       LEU  81   6.288  -0.325  -5.784
  577   1HB   LEU  81          2HB       LEU  81   5.674  -0.608  -3.412
  578   2HB   LEU  81          1HB       LEU  81   7.254  -1.300  -3.095
  579    HG   LEU  81           HG       LEU  81   7.756   1.174  -4.328
  580   1HD1  LEU  81          1HD1      LEU  81   6.171   1.943  -1.994
  581   2HD1  LEU  81          2HD1      LEU  81   5.214   1.371  -3.365
  582   3HD1  LEU  81          3HD1      LEU  81   6.334   2.720  -3.571
  583   1HD2  LEU  81          1HD2      LEU  81   8.947   1.643  -2.405
  584   2HD2  LEU  81          2HD2      LEU  81   8.922  -0.121  -2.438
  585   3HD2  LEU  81          3HD2      LEU  81   7.827   0.758  -1.371
  586    H    GLN  82           H        GLN  82   8.057   0.689  -6.508
  587    HA   GLN  82           HA       GLN  82  10.522  -0.897  -6.679
  588   1HB   GLN  82          2HB       GLN  82   9.195   0.129  -8.730
  589   2HB   GLN  82          1HB       GLN  82  10.088   1.580  -8.294
  590   1HG   GLN  82          2HG       GLN  82  11.725   0.801  -9.567
  591   2HG   GLN  82          1HG       GLN  82  12.021  -0.384  -8.295
  592   1HE2  GLN  82          1HE2      GLN  82  12.446  -2.234  -9.277
  593   2HE2  GLN  82          2HE2      GLN  82  11.501  -2.955 -10.530
  594    H    MET  83           H        MET  83  11.932  -0.394  -5.145
  595    HA   MET  83           HA       MET  83  11.967   2.226  -3.928
  596   1HB   MET  83          2HB       MET  83  13.589  -0.275  -3.454
  597   2HB   MET  83          1HB       MET  83  13.829   1.217  -2.555
  598   1HG   MET  83          2HG       MET  83  12.075   0.836  -1.241
  599   2HG   MET  83          1HG       MET  83  11.057   0.337  -2.591
  600   1HE   MET  83          1HE       MET  83   9.910  -1.535  -0.859
  601   2HE   MET  83          2HE       MET  83  10.981  -0.806   0.337
  602   3HE   MET  83          3HE       MET  83  10.934  -2.558   0.148
  603    H    ASN  84           H        ASN  84  12.799   3.751  -5.221
  604    HA   ASN  84           HA       ASN  84  15.320   3.208  -6.625
  605   1HB   ASN  84          2HB       ASN  84  13.419   5.545  -6.923
  606   2HB   ASN  84          1HB       ASN  84  14.833   5.225  -7.923
  607   1HD2  ASN  84          1HD2      ASN  84  14.827   3.277  -9.205
  608   2HD2  ASN  84          2HD2      ASN  84  13.328   2.649  -9.792
  609    H    SER  85           H        SER  85  16.866   5.067  -6.725
  610    HA   SER  85           HA       SER  85  18.271   6.571  -5.773
  611   1HB   SER  85          2HB       SER  85  16.005   7.738  -5.253
  612   2HB   SER  85          1HB       SER  85  16.273   7.166  -3.606
  613    HG   SER  85           HG       SER  85  18.102   8.382  -3.478
  614    H    LEU  86           H        LEU  86  16.498   5.416  -2.924
  615    HA   LEU  86           HA       LEU  86  17.145   4.325  -1.044
  616   1HB   LEU  86          2HB       LEU  86  19.355   3.219  -2.777
  617   2HB   LEU  86          1HB       LEU  86  18.825   2.569  -1.240
  618    HG   LEU  86           HG       LEU  86  17.724   1.131  -2.607
  619   1HD1  LEU  86          1HD1      LEU  86  15.803   3.450  -2.723
  620   2HD1  LEU  86          2HD1      LEU  86  15.983   2.337  -1.368
  621   3HD1  LEU  86          3HD1      LEU  86  15.403   1.744  -2.923
  622   1HD2  LEU  86          1HD2      LEU  86  16.991   3.077  -4.726
  623   2HD2  LEU  86          2HD2      LEU  86  17.400   1.366  -4.849
  624   3HD2  LEU  86          3HD2      LEU  86  18.674   2.561  -4.609
  625    H    LYS  87           H        LYS  87  18.656   4.359   0.698
  626    HA   LYS  87           HA       LYS  87  21.188   5.606   0.536
  627   1HB   LYS  87          2HB       LYS  87  20.384   7.625   2.012
  628   2HB   LYS  87          1HB       LYS  87  20.296   7.713   0.258
  629   1HG   LYS  87          2HG       LYS  87  18.036   7.696   0.230
  630   2HG   LYS  87          1HG       LYS  87  17.915   6.650   1.646
  631   1HD   LYS  87          2HD       LYS  87  17.505   8.426   2.916
  632   2HD   LYS  87          1HD       LYS  87  19.074   9.102   2.476
  633   1HE   LYS  87          2HE       LYS  87  16.867   9.373   0.513
  634   2HE   LYS  87          1HE       LYS  87  16.774  10.355   1.974
  635   1HZ   LYS  87          1HZ       LYS  87  18.919  11.291   1.479
  636   2HZ   LYS  87          2HZ       LYS  87  17.910  11.485   0.135
  637   3HZ   LYS  87          3HZ       LYS  87  19.101  10.285   0.129
  638    H    SER  88           H        SER  88  18.535   5.808   2.900
  639    HA   SER  88           HA       SER  88  19.861   3.895   4.642
  640   1HB   SER  88          2HB       SER  88  19.254   6.708   5.588
  641   2HB   SER  88          1HB       SER  88  19.940   5.402   6.555
  642    HG   SER  88           HG       SER  88  21.839   5.706   5.651
  643    H    GLU  89           H        GLU  89  17.259   6.237   4.238
  644    HA   GLU  89           HA       GLU  89  15.484   5.227   6.130
  645   1HB   GLU  89          2HB       GLU  89  13.870   6.605   5.144
  646   2HB   GLU  89          1HB       GLU  89  15.389   7.418   4.819
  647   1HG   GLU  89          2HG       GLU  89  15.388   6.414   2.554
  648   2HG   GLU  89          1HG       GLU  89  13.792   5.745   2.893
  649    H    ASP  90           H        ASP  90  16.206   4.150   2.884
  650    HA   ASP  90           HA       ASP  90  13.916   2.575   2.445
  651   1HB   ASP  90          2HB       ASP  90  15.498   3.181   0.656
  652   2HB   ASP  90          1HB       ASP  90  16.721   2.148   1.391
  653    H    THR  91           H        THR  91  16.805   2.027   4.306
  654    HA   THR  91           HA       THR  91  16.609  -0.792   4.521
  655    HB   THR  91           HB       THR  91  17.816   0.992   6.629
  656    HG1  THR  91           1HG      THR  91  19.766   0.739   5.266
  657   1HG2  THR  91          1HG2      THR  91  18.321  -1.017   7.477
  658   2HG2  THR  91          2HG2      THR  91  19.467  -1.169   6.144
  659   3HG2  THR  91          3HG2      THR  91  17.847  -1.849   5.996
  660    H    ALA  92           H        ALA  92  14.464  -1.317   5.000
  661    HA   ALA  92           HA       ALA  92  13.824  -1.504   7.752
  662   1HB   ALA  92          1HB       ALA  92  13.170   0.958   6.780
  663   2HB   ALA  92          2HB       ALA  92  12.383   0.173   8.157
  664   3HB   ALA  92          3HB       ALA  92  11.668   0.065   6.543
  665    H    VAL  93           H        VAL  93  11.521  -2.341   8.047
  666    HA   VAL  93           HA       VAL  93  11.053  -4.365   6.013
  667    HB   VAL  93           HB       VAL  93   9.458  -4.017   8.547
  668   1HG1  VAL  93          1HG1      VAL  93   9.576  -6.639   8.168
  669   2HG1  VAL  93          2HG1      VAL  93   9.846  -6.137   6.499
  670   3HG1  VAL  93          3HG1      VAL  93   8.381  -5.635   7.346
  671   1HG2  VAL  93          1HG2      VAL  93  11.152  -5.913   9.293
  672   2HG2  VAL  93          2HG2      VAL  93  11.494  -4.203   9.560
  673   3HG2  VAL  93          3HG2      VAL  93  12.224  -5.044   8.193
  674    H    TYR  94           H        TYR  94   9.537  -4.186   4.493
  675    HA   TYR  94           HA       TYR  94   7.591  -2.010   4.758
  676   1HB   TYR  94          2HB       TYR  94   8.681  -3.437   2.333
  677   2HB   TYR  94          1HB       TYR  94   7.340  -2.300   2.261
  678    HD1  TYR  94           1HD      TYR  94   7.854  -0.124   1.688
  679    HD2  TYR  94           2HD      TYR  94  10.802  -2.463   3.672
  680    HE1  TYR  94           1HE      TYR  94   9.444   1.746   1.521
  681    HE2  TYR  94           2HE      TYR  94  12.397  -0.599   3.510
  682    HH   TYR  94           HH       TYR  94  12.664   1.551   2.982
  683    H    TYR  95           H        TYR  95   5.427  -2.303   4.233
  684    HA   TYR  95           HA       TYR  95   4.455  -5.040   3.899
  685   1HB   TYR  95          2HB       TYR  95   3.094  -3.294   5.920
  686   2HB   TYR  95          1HB       TYR  95   3.043  -5.042   5.755
  687    HD1  TYR  95           1HD      TYR  95   4.546  -6.421   6.948
  688    HD2  TYR  95           2HD      TYR  95   5.141  -2.205   6.903
  689    HE1  TYR  95           1HE      TYR  95   6.215  -6.642   8.739
  690    HE2  TYR  95           2HE      TYR  95   6.813  -2.421   8.689
  691    HH   TYR  95           HH       TYR  95   7.945  -3.806  10.000
  692    H    CYS  96           H        CYS  96   2.139  -5.090   3.337
  693    HA   CYS  96           HA       CYS  96   1.317  -2.636   1.947
  694   1HB   CYS  96          2HB       CYS  96   0.294  -3.939   0.252
  695   2HB   CYS  96          1HB       CYS  96   1.864  -4.686   0.517
  696    H    ALA  97           H        ALA  97  -0.777  -1.934   2.262
  697    HA   ALA  97           HA       ALA  97  -2.594  -3.531   3.866
  698   1HB   ALA  97          1HB       ALA  97  -2.071  -2.619   5.814
  699   2HB   ALA  97          2HB       ALA  97  -2.577  -1.050   5.184
  700   3HB   ALA  97          3HB       ALA  97  -0.891  -1.558   5.040
  701    H    LYS  98           H        LYS  98  -4.664  -2.414   4.268
  702    HA   LYS  98           HA       LYS  98  -5.471  -0.964   1.873
  703   1HB   LYS  98          2HB       LYS  98  -7.062  -2.573   2.162
  704   2HB   LYS  98          1HB       LYS  98  -6.808  -2.663   3.897
  705   1HG   LYS  98          2HG       LYS  98  -7.966  -0.151   3.403
  706   2HG   LYS  98          1HG       LYS  98  -8.863  -1.323   2.434
  707   1HD   LYS  98          2HD       LYS  98  -8.914  -2.746   4.570
  708   2HD   LYS  98          1HD       LYS  98  -8.447  -1.263   5.406
  709   1HE   LYS  98          2HE       LYS  98 -10.788  -1.315   5.536
  710   2HE   LYS  98          1HE       LYS  98 -10.431  -0.175   4.239
  711   1HZ   LYS  98          1HZ       LYS  98 -12.201  -2.083   3.959
  712   2HZ   LYS  98          2HZ       LYS  98 -10.837  -2.975   3.508
  713   3HZ   LYS  98          3HZ       LYS  98 -11.244  -1.568   2.663
  714    H    TYR  99           H        TYR  99  -6.689   0.997   1.992
  715    HA   TYR  99           HA       TYR  99  -5.776   2.729   4.118
  716   1HB   TYR  99          2HB       TYR  99  -6.300   3.097   1.423
  717   2HB   TYR  99          1HB       TYR  99  -7.646   3.913   2.215
  718    HD1  TYR  99           1HD      TYR  99  -3.984   3.593   2.914
  719    HD2  TYR  99           2HD      TYR  99  -7.311   6.188   2.369
  720    HE1  TYR  99           1HE      TYR  99  -2.536   5.526   3.355
  721    HE2  TYR  99           2HE      TYR  99  -5.871   8.133   2.806
  722    HH   TYR  99           HH       TYR  99  -2.387   7.771   3.285
  723    H    SER 100           H        SER 100  -6.853   2.927   5.940
  724    HA   SER 100           HA       SER 100  -9.724   2.379   6.005
  725   1HB   SER 100          2HB       SER 100  -8.952   2.859   8.610
  726   2HB   SER 100          1HB       SER 100  -9.049   1.271   7.850
  727    HG   SER 100           HG       SER 100  -6.737   2.909   7.781
  728    H    GLY 101           H        GLY 101  -7.494   4.779   7.429
  729   1HA   GLY 101          2HA       GLY 101  -9.584   6.816   6.995
  730   2HA   GLY 101          1HA       GLY 101  -8.740   6.703   8.532
  731    H    GLY 102           H        GLY 102  -6.428   7.109   8.550
  732   1HA   GLY 102          2HA       GLY 102  -5.249   8.351   6.212
  733   2HA   GLY 102          1HA       GLY 102  -5.605   9.461   7.528
  734    H    ALA 103           H        ALA 103  -4.882   6.371   8.660
  735    HA   ALA 103           HA       ALA 103  -2.039   7.046   9.014
  736   1HB   ALA 103          1HB       ALA 103  -2.072   6.647  11.293
  737   2HB   ALA 103          2HB       ALA 103  -3.567   5.715  11.213
  738   3HB   ALA 103          3HB       ALA 103  -3.612   7.470  11.038
  739    H    LEU 104           H        LEU 104  -4.336   4.829   8.028
  740    HA   LEU 104           HA       LEU 104  -4.262   2.679   7.305
  741   1HB   LEU 104          2HB       LEU 104  -1.995   3.715   6.412
  742   2HB   LEU 104          1HB       LEU 104  -1.293   2.586   7.554
  743    HG   LEU 104           HG       LEU 104  -2.843   0.848   6.330
  744   1HD1  LEU 104          1HD1      LEU 104  -2.284   2.431   3.916
  745   2HD1  LEU 104          2HD1      LEU 104  -3.615   3.002   4.923
  746   3HD1  LEU 104          3HD1      LEU 104  -3.633   1.356   4.287
  747   1HD2  LEU 104          1HD2      LEU 104  -0.914   0.819   4.493
  748   2HD2  LEU 104          2HD2      LEU 104  -0.655   0.291   6.157
  749   3HD2  LEU 104          3HD2      LEU 104  -0.168   1.912   5.660
  750    H    ASP 105           H        ASP 105  -3.404   0.428   7.880
  751    HA   ASP 105           HA       ASP 105  -3.119   0.255  10.809
  752   1HB   ASP 105          2HB       ASP 105  -5.157  -0.764   9.216
  753   2HB   ASP 105          1HB       ASP 105  -4.127  -2.159   9.528
  754    H    ALA 106           H        ALA 106  -2.083  -0.967   7.702
  755    HA   ALA 106           HA       ALA 106  -0.234  -2.084   7.022
  756   1HB   ALA 106          1HB       ALA 106   0.685  -1.208   9.732
  757   2HB   ALA 106          2HB       ALA 106   1.161  -0.599   8.146
  758   3HB   ALA 106          3HB       ALA 106   1.700  -2.194   8.679
  759    H    TRP 107           H        TRP 107  -0.331  -4.151   6.633
  760    HA   TRP 107           HA       TRP 107  -0.397  -6.043   8.879
  761   1HB   TRP 107          2HB       TRP 107  -1.902  -6.464   6.292
  762   2HB   TRP 107          1HB       TRP 107  -1.987  -7.442   7.753
  763    HD1  TRP 107           HD       TRP 107  -2.657  -5.453   9.968
  764    HE1  TRP 107           1HE      TRP 107  -4.840  -4.088   9.974
  765    HE3  TRP 107           3HE      TRP 107  -3.776  -5.715   4.999
  766    HZ2  TRP 107           2HZ      TRP 107  -6.783  -3.237   8.105
  767    HZ3  TRP 107           3HZ      TRP 107  -5.815  -4.606   4.181
  768    HH2  TRP 107           HH       TRP 107  -7.286  -3.394   5.704
  769    H    GLY 108           H        GLY 108  -0.628  -8.007   6.425
  770   1HA   GLY 108          2HA       GLY 108   0.807  -9.141   5.020
  771   2HA   GLY 108          1HA       GLY 108   1.901  -7.773   5.117
  772    H    GLN 109           H        GLN 109   3.162 -10.022   5.012
  773    HA   GLN 109           HA       GLN 109   3.552 -11.258   7.583
  774   1HB   GLN 109          2HB       GLN 109   4.025 -11.994   4.938
  775   2HB   GLN 109          1HB       GLN 109   5.631 -11.791   5.624
  776   1HG   GLN 109          2HG       GLN 109   3.640 -13.350   7.175
  777   2HG   GLN 109          1HG       GLN 109   4.339 -14.087   5.735
  778   1HE2  GLN 109          1HE2      GLN 109   5.326 -12.294   8.632
  779   2HE2  GLN 109          2HE2      GLN 109   6.756 -13.218   8.926
  780    H    GLY 110           H        GLY 110   5.566  -9.266   5.411
  781   1HA   GLY 110          2HA       GLY 110   6.719  -7.381   6.622
  782   2HA   GLY 110          1HA       GLY 110   7.241  -8.616   7.756
  783    H    THR 111           H        THR 111   7.838  -7.073   4.737
  784    HA   THR 111           HA       THR 111   9.947  -8.999   4.077
  785    HB   THR 111           HB       THR 111   8.484  -8.351   2.227
  786    HG1  THR 111           1HG      THR 111  11.170  -8.100   2.265
  787   1HG2  THR 111          1HG2      THR 111   9.558  -5.555   2.619
  788   2HG2  THR 111          2HG2      THR 111   7.917  -6.079   3.000
  789   3HG2  THR 111          3HG2      THR 111   8.481  -6.092   1.330
  790    H    GLN 112           H        GLN 112  11.960  -8.642   4.719
  791    HA   GLN 112           HA       GLN 112  12.685  -6.083   5.847
  792   1HB   GLN 112          2HB       GLN 112  13.346  -8.172   6.959
  793   2HB   GLN 112          1HB       GLN 112  14.308  -8.612   5.555
  794   1HG   GLN 112          2HG       GLN 112  15.995  -7.691   6.688
  795   2HG   GLN 112          1HG       GLN 112  15.316  -6.163   6.132
  796   1HE2  GLN 112          1HE2      GLN 112  15.760  -4.862   7.806
  797   2HE2  GLN 112          2HE2      GLN 112  15.199  -5.107   9.421
  798    H    VAL 113           H        VAL 113  13.454  -4.496   4.680
  799    HA   VAL 113           HA       VAL 113  14.993  -5.101   2.242
  800    HB   VAL 113           HB       VAL 113  13.509  -2.576   2.998
  801   1HG1  VAL 113          1HG1      VAL 113  15.417  -3.210   0.815
  802   2HG1  VAL 113          2HG1      VAL 113  15.143  -1.697   1.678
  803   3HG1  VAL 113          3HG1      VAL 113  14.018  -2.211   0.422
  804   1HG2  VAL 113          1HG2      VAL 113  11.796  -3.213   1.632
  805   2HG2  VAL 113          2HG2      VAL 113  12.327  -4.801   2.188
  806   3HG2  VAL 113          3HG2      VAL 113  12.834  -4.205   0.606
  807    H    THR 114           H        THR 114  17.134  -4.851   2.438
  808    HA   THR 114           HA       THR 114  18.107  -2.884   4.410
  809    HB   THR 114           HB       THR 114  20.149  -4.773   3.718
  810    HG1  THR 114           1HG      THR 114  18.291  -6.145   3.309
  811   1HG2  THR 114          1HG2      THR 114  20.202  -5.120   6.128
  812   2HG2  THR 114          2HG2      THR 114  18.639  -4.321   6.295
  813   3HG2  THR 114          3HG2      THR 114  20.047  -3.402   5.762
  814    H    VAL 115           H        VAL 115  19.895  -1.630   3.932
  815    HA   VAL 115           HA       VAL 115  20.757  -1.592   1.118
  816    HB   VAL 115           HB       VAL 115  20.151   0.828   2.827
  817   1HG1  VAL 115          1HG1      VAL 115  22.080   0.729   0.963
  818   2HG1  VAL 115          2HG1      VAL 115  21.111   2.168   1.281
  819   3HG1  VAL 115          3HG1      VAL 115  20.695   1.103  -0.062
  820   1HG2  VAL 115          1HG2      VAL 115  18.674   0.942   0.476
  821   2HG2  VAL 115          2HG2      VAL 115  18.067   0.566   2.089
  822   3HG2  VAL 115          3HG2      VAL 115  18.544  -0.737   1.001
  823    H    SER 116           H        SER 116  22.910  -1.455   0.806
  824    HA   SER 116           HA       SER 116  24.653  -0.401   2.865
  825   1HB   SER 116          2HB       SER 116  24.189  -2.912   3.320
  826   2HB   SER 116          1HB       SER 116  25.225  -3.199   1.922
  827    HG   SER 116           HG       SER 116  25.935  -1.738   4.251
  828    H    SER 117           H        SER 117  26.410   0.538   2.016
  829    HA   SER 117           HA       SER 117  26.802   0.318  -0.874
  830   1HB   SER 117          2HB       SER 117  26.534   2.563   0.293
  831   2HB   SER 117          1HB       SER 117  28.129   2.287   0.994
  832    HG   SER 117           HG       SER 117  28.848   3.094  -0.800
  833    H    GLN 118           H        GLN 118  27.697  -1.737   1.051
  834    HA   GLN 118           HA       GLN 118  29.467  -3.121   1.383
  835   1HB   GLN 118          2HB       GLN 118  30.580  -1.604  -0.982
  836   2HB   GLN 118          1HB       GLN 118  31.290  -3.067  -0.314
  837   1HG   GLN 118          2HG       GLN 118  29.261  -4.306  -0.845
  838   2HG   GLN 118          1HG       GLN 118  28.532  -2.839  -1.496
  839   1HE2  GLN 118          1HE2      GLN 118  29.402  -1.938  -3.412
  840   2HE2  GLN 118          2HE2      GLN 118  30.293  -2.912  -4.525
  841    H    SER 119           H        SER 119  32.062  -3.020   1.561
  842    HA   SER 119           HA       SER 119  32.557  -0.851   3.460
  843   1HB   SER 119          2HB       SER 119  33.080  -2.841   4.530
  844   2HB   SER 119          1HB       SER 119  33.700  -3.590   3.060
  845    HG   SER 119           HG       SER 119  35.589  -3.001   3.735
  846    H    GLU 120           H        GLU 120  33.256   0.899   2.362
  847    HA   GLU 120           HA       GLU 120  35.868   0.744   1.125
  848   1HB   GLU 120          2HB       GLU 120  34.897   2.145  -0.860
  849   2HB   GLU 120          1HB       GLU 120  34.800   0.390  -0.893
  850   1HG   GLU 120          2HG       GLU 120  32.472   1.025   0.348
  851   2HG   GLU 120          1HG       GLU 120  32.675   2.399  -0.739
  852    H    GLN 121           H        GLN 121  36.463   3.071   0.303
  853    HA   GLN 121           HA       GLN 121  35.287   5.102   2.060
  854   1HB   GLN 121          2HB       GLN 121  37.235   4.251   3.249
  855   2HB   GLN 121          1HB       GLN 121  38.242   4.505   1.829
  856   1HG   GLN 121          2HG       GLN 121  37.519   6.976   2.053
  857   2HG   GLN 121          1HG       GLN 121  37.067   6.521   3.695
  858   1HE2  GLN 121          1HE2      GLN 121  39.750   5.196   1.866
  859   2HE2  GLN 121          2HE2      GLN 121  40.999   5.837   2.872
  860    H    LYS 122           H        LYS 122  35.369   7.195   1.290
  861    HA   LYS 122           HA       LYS 122  35.763   7.445  -1.560
  862   1HB   LYS 122          2HB       LYS 122  33.923   8.510   0.036
  863   2HB   LYS 122          1HB       LYS 122  35.116   9.799   0.148
  864   1HG   LYS 122          2HG       LYS 122  34.315  10.628  -1.739
  865   2HG   LYS 122          1HG       LYS 122  34.908   9.192  -2.576
  866   1HD   LYS 122          2HD       LYS 122  32.629   8.209  -1.547
  867   2HD   LYS 122          1HD       LYS 122  32.168   9.904  -1.724
  868   1HE   LYS 122          2HE       LYS 122  31.693   8.359  -3.693
  869   2HE   LYS 122          1HE       LYS 122  32.527   9.873  -4.042
  870   1HZ   LYS 122          1HZ       LYS 122  33.351   7.435  -4.839
  871   2HZ   LYS 122          2HZ       LYS 122  34.289   7.671  -3.452
  872   3HZ   LYS 122          3HZ       LYS 122  34.348   8.797  -4.714
  873    H    LEU 123           H        LEU 123  37.032   9.085   1.338
  874    HA   LEU 123           HA       LEU 123  38.927  10.657  -0.038
  875   1HB   LEU 123          2HB       LEU 123  38.007  10.540   2.525
  876   2HB   LEU 123          1HB       LEU 123  39.612   9.861   2.711
  877    HG   LEU 123           HG       LEU 123  40.343  11.992   1.353
  878   1HD1  LEU 123          1HD1      LEU 123  37.671  12.772   2.497
  879   2HD1  LEU 123          2HD1      LEU 123  38.205  12.880   0.819
  880   3HD1  LEU 123          3HD1      LEU 123  38.915  13.936   2.041
  881   1HD2  LEU 123          1HD2      LEU 123  40.350  13.240   3.621
  882   2HD2  LEU 123          2HD2      LEU 123  41.249  11.730   3.468
  883   3HD2  LEU 123          3HD2      LEU 123  39.672  11.741   4.258
  884    H    ILE 124           H        ILE 124  41.278  10.467   0.084
  885    HA   ILE 124           HA       ILE 124  42.116   7.786  -0.595
  886    HB   ILE 124           HB       ILE 124  42.913   9.657  -1.942
  887   1HG1  ILE 124          2HG1      ILE 124  45.465   8.913  -0.692
  888   2HG1  ILE 124          1HG1      ILE 124  44.413   7.544  -1.039
  889   1HG2  ILE 124          1HG2      ILE 124  44.105  11.460  -1.160
  890   2HG2  ILE 124          2HG2      ILE 124  44.677  10.599   0.269
  891   3HG2  ILE 124          3HG2      ILE 124  43.008  11.165   0.189
  892   1HD1  ILE 124          1HD1      ILE 124  45.028   9.613  -3.114
  893   2HD1  ILE 124          2HD1      ILE 124  44.432   7.967  -3.331
  894   3HD1  ILE 124          3HD1      ILE 124  46.097   8.242  -2.818
  895    H    SER 125           H        SER 125  43.429   6.464   0.553
  896    HA   SER 125           HA       SER 125  44.969   7.343   2.794
  897   1HB   SER 125          2HB       SER 125  42.467   7.138   3.569
  898   2HB   SER 125          1HB       SER 125  42.813   5.409   3.566
  899    HG   SER 125           HG       SER 125  44.820   6.672   4.776
  900    H    GLU 126           H        GLU 126  46.498   5.857   3.391
  901    HA   GLU 126           HA       GLU 126  47.912   4.096   3.136
  902   1HB   GLU 126          2HB       GLU 126  45.476   2.407   2.598
  903   2HB   GLU 126          1HB       GLU 126  46.989   1.921   3.348
  904   1HG   GLU 126          2HG       GLU 126  45.201   3.963   4.614
  905   2HG   GLU 126          1HG       GLU 126  44.945   2.235   4.844
  906    H    GLU 127           H        GLU 127  47.077   5.629   0.748
  907    HA   GLU 127           HA       GLU 127  47.810   3.623  -1.279
  908   1HB   GLU 127          2HB       GLU 127  45.855   5.907  -1.585
  909   2HB   GLU 127          1HB       GLU 127  46.447   4.921  -2.915
  910   1HG   GLU 127          2HG       GLU 127  45.488   2.929  -1.793
  911   2HG   GLU 127          1HG       GLU 127  44.794   4.001  -0.577
  912    H    ASP 128           H        ASP 128  49.051   5.979   0.403
  913    HA   ASP 128           HA       ASP 128  50.817   6.832  -1.744
  914   1HB   ASP 128          2HB       ASP 128  50.618   9.242  -0.757
  915   2HB   ASP 128          1HB       ASP 128  49.423   8.681  -1.922
  916    H    LEU 129           H        LEU 129  52.369   5.574  -0.667
  917    HA   LEU 129           HA       LEU 129  53.436   6.842   1.761
  918   1HB   LEU 129          2HB       LEU 129  52.225   4.407   1.806
  919   2HB   LEU 129          1HB       LEU 129  53.887   3.941   1.498
  920    HG   LEU 129           HG       LEU 129  53.311   3.902   3.895
  921   1HD1  LEU 129          1HD1      LEU 129  55.469   4.272   4.214
  922   2HD1  LEU 129          2HD1      LEU 129  55.188   6.012   4.153
  923   3HD1  LEU 129          3HD1      LEU 129  55.555   5.127   2.674
  924   1HD2  LEU 129          1HD2      LEU 129  52.924   6.868   3.522
  925   2HD2  LEU 129          2HD2      LEU 129  53.017   6.048   5.080
  926   3HD2  LEU 129          3HD2      LEU 129  51.692   5.691   3.973
  927    H    ASN 130           H        ASN 130  54.663   3.979   0.123
  928    HA   ASN 130           HA       ASN 130  56.648   5.431  -1.369
  929   1HB   ASN 130          2HB       ASN 130  57.406   5.230   1.137
  930   2HB   ASN 130          1HB       ASN 130  57.777   3.568   0.689
  931   1HD2  ASN 130          1HD2      ASN 130  59.928   4.525   1.385
  932   2HD2  ASN 130          2HD2      ASN 130  60.909   5.189   0.128
  933    H    HIS 131           H        HIS 131  57.327   4.274  -3.079
  934    HA   HIS 131           HA       HIS 131  57.532   1.436  -3.094
  935   1HB   HIS 131          2HB       HIS 131  55.774   1.169  -4.951
  936   2HB   HIS 131          1HB       HIS 131  55.194   1.308  -3.295
  937    HD1  HIS 131           1HD      HIS 131  56.251   4.316  -5.278
  938    HD2  HIS 131           2HD      HIS 131  52.764   2.441  -4.016
  939    HE1  HIS 131           1HE      HIS 131  54.395   5.938  -5.779
  940    HE2  HIS 131           2HE      HIS 131  52.310   4.826  -4.905
  941    H    HIS 132           H        HIS 132  58.732   4.152  -3.934
  942    HA   HIS 132           HA       HIS 132  59.640   3.231  -6.577
  943   1HB   HIS 132          2HB       HIS 132  58.128   5.519  -6.138
  944   2HB   HIS 132          1HB       HIS 132  59.777   6.123  -6.249
  945    HD1  HIS 132           1HD      HIS 132  61.096   5.130  -8.493
  946    HD2  HIS 132           2HD      HIS 132  56.942   5.258  -8.551
  947    HE1  HIS 132           1HE      HIS 132  60.453   5.007 -10.921
  948    HE2  HIS 132           2HE      HIS 132  57.934   5.005 -10.926
  949    H    HIS 133           H        HIS 133  60.561   6.025  -4.594
  950    HA   HIS 133           HA       HIS 133  63.029   4.799  -3.757
  951   1HB   HIS 133          2HB       HIS 133  64.526   6.324  -4.898
  952   2HB   HIS 133          1HB       HIS 133  63.535   5.489  -6.090
  953    HD1  HIS 133           1HD      HIS 133  61.012   7.419  -5.618
  954    HD2  HIS 133           2HD      HIS 133  64.907   8.568  -6.494
  955    HE1  HIS 133           1HE      HIS 133  60.823   9.704  -6.649
  956    HE2  HIS 133           2HE      HIS 133  63.199  10.419  -7.081
  957    H    HIS 134           H        HIS 134  60.567   7.018  -3.454
  958    HA   HIS 134           HA       HIS 134  60.029   8.593  -1.909
  959   1HB   HIS 134          2HB       HIS 134  60.908   6.787  -0.370
  960   2HB   HIS 134          1HB       HIS 134  62.438   7.656  -0.346
  961    HD1  HIS 134           1HD      HIS 134  62.636   9.573   1.263
  962    HD2  HIS 134           2HD      HIS 134  58.718   8.265   0.813
  963    HE1  HIS 134           1HE      HIS 134  61.311  10.804   3.010
  964    HE2  HIS 134           2HE      HIS 134  58.950   9.963   2.750
  965    H    HIS 135           H        HIS 135  63.453   8.783  -1.100
  966    HA   HIS 135           HA       HIS 135  63.625  11.337  -2.546
  967   1HB   HIS 135          2HB       HIS 135  63.874  10.857   0.339
  968   2HB   HIS 135          1HB       HIS 135  65.216  11.765  -0.348
  969    HD1  HIS 135           1HD      HIS 135  64.860  14.204  -0.438
  970    HD2  HIS 135           2HD      HIS 135  61.264  12.120  -0.446
  971    HE1  HIS 135           1HE      HIS 135  63.063  15.963  -0.390
  972    HE2  HIS 135           2HE      HIS 135  60.897  14.680  -0.491
  Start of MODEL    6
    1   1H    ASP   1          1HT       ASP   1 -10.422  -8.619   9.713
    2   2H    ASP   1          2HT       ASP   1 -10.971  -7.394   8.684
    3   3H    ASP   1          3HT       ASP   1  -9.458  -8.104   8.421
    4    HA   ASP   1           HA       ASP   1 -11.238 -10.199   8.431
    5   1HB   ASP   1          2HB       ASP   1 -12.435  -7.691   7.517
    6   2HB   ASP   1          1HB       ASP   1 -12.504  -8.964   6.301
    7    H    VAL   2           H        VAL   2  -9.140  -7.947   6.921
    8    HA   VAL   2           HA       VAL   2  -8.523  -9.919   4.818
    9    HB   VAL   2           HB       VAL   2  -7.493  -7.754   3.692
   10   1HG1  VAL   2          1HG1      VAL   2 -10.238  -8.887   3.625
   11   2HG1  VAL   2          2HG1      VAL   2  -8.997  -8.848   2.372
   12   3HG1  VAL   2          3HG1      VAL   2  -9.932  -7.396   2.733
   13   1HG2  VAL   2          1HG2      VAL   2  -9.822  -6.594   5.212
   14   2HG2  VAL   2          2HG2      VAL   2  -8.756  -5.760   4.080
   15   3HG2  VAL   2          3HG2      VAL   2  -8.130  -6.320   5.631
   16    H    GLN   3           H        GLN   3  -6.530 -10.716   4.802
   17    HA   GLN   3           HA       GLN   3  -4.408  -9.258   6.231
   18   1HB   GLN   3          2HB       GLN   3  -5.349 -11.310   7.443
   19   2HB   GLN   3          1HB       GLN   3  -4.603 -12.264   6.168
   20   1HG   GLN   3          2HG       GLN   3  -2.640 -10.478   7.116
   21   2HG   GLN   3          1HG       GLN   3  -3.427 -11.188   8.525
   22   1HE2  GLN   3          1HE2      GLN   3  -0.816 -11.518   6.784
   23   2HE2  GLN   3          2HE2      GLN   3  -0.610 -13.232   6.777
   24    H    LEU   4           H        LEU   4  -2.607  -8.927   5.070
   25    HA   LEU   4           HA       LEU   4  -2.328 -10.437   2.555
   26   1HB   LEU   4          2HB       LEU   4  -0.755  -8.018   2.651
   27   2HB   LEU   4          1HB       LEU   4  -1.930  -8.540   1.462
   28    HG   LEU   4           HG       LEU   4  -2.672  -7.194   4.059
   29   1HD1  LEU   4          1HD1      LEU   4  -1.440  -5.576   2.882
   30   2HD1  LEU   4          2HD1      LEU   4  -3.130  -5.231   2.519
   31   3HD1  LEU   4          3HD1      LEU   4  -2.126  -6.063   1.332
   32   1HD2  LEU   4          1HD2      LEU   4  -4.829  -7.242   3.366
   33   2HD2  LEU   4          2HD2      LEU   4  -4.269  -8.684   2.519
   34   3HD2  LEU   4          3HD2      LEU   4  -4.400  -7.150   1.659
   35    H    GLN   5           H        GLN   5   0.147 -10.014   1.775
   36    HA   GLN   5           HA       GLN   5   1.998 -10.516   3.965
   37   1HB   GLN   5          2HB       GLN   5   1.031 -12.730   3.232
   38   2HB   GLN   5          1HB       GLN   5   1.783 -12.459   1.666
   39   1HG   GLN   5          2HG       GLN   5   3.952 -12.579   2.573
   40   2HG   GLN   5          1HG       GLN   5   3.348 -12.464   4.225
   41   1HE2  GLN   5          1HE2      GLN   5   4.423 -14.524   1.853
   42   2HE2  GLN   5          2HE2      GLN   5   3.852 -16.018   2.508
   43    H    ALA   6           H        ALA   6   3.542  -9.068   3.601
   44    HA   ALA   6           HA       ALA   6   4.230  -8.328   0.865
   45   1HB   ALA   6          1HB       ALA   6   3.829  -6.750   2.958
   46   2HB   ALA   6          2HB       ALA   6   4.962  -6.335   1.672
   47   3HB   ALA   6          3HB       ALA   6   5.557  -7.035   3.178
   48    H    SER   7           H        SER   7   5.817  -9.351  -0.135
   49    HA   SER   7           HA       SER   7   8.263  -9.988   1.328
   50   1HB   SER   7          2HB       SER   7   6.936 -12.058   1.375
   51   2HB   SER   7          1HB       SER   7   6.781 -12.003  -0.382
   52    HG   SER   7           HG       SER   7   9.346 -11.927   0.730
   53    H    GLY   8           H        GLY   8  10.125 -10.020   0.059
   54   1HA   GLY   8          2HA       GLY   8  10.801 -10.228  -2.425
   55   2HA   GLY   8          1HA       GLY   8   9.768  -8.818  -2.603
   56    H    GLY   9           H        GLY   9  10.995  -8.388   0.343
   57   1HA   GLY   9          2HA       GLY   9  12.690  -6.276  -0.366
   58   2HA   GLY   9          1HA       GLY   9  12.630  -7.037   1.217
   59    H    GLY  10           H        GLY  10  14.828  -6.063  -0.682
   60   1HA   GLY  10          2HA       GLY  10  16.500  -8.472  -0.372
   61   2HA   GLY  10          1HA       GLY  10  16.519  -7.567  -1.875
   62    H    LEU  11           H        LEU  11  18.869  -7.719  -1.151
   63    HA   LEU  11           HA       LEU  11  19.569  -5.469   0.614
   64   1HB   LEU  11          2HB       LEU  11  20.538  -8.129   0.429
   65   2HB   LEU  11          1HB       LEU  11  21.827  -7.075  -0.116
   66    HG   LEU  11           HG       LEU  11  22.072  -7.529   2.245
   67   1HD1  LEU  11          1HD1      LEU  11  21.177  -4.714   1.663
   68   2HD1  LEU  11          2HD1      LEU  11  22.810  -5.364   1.528
   69   3HD1  LEU  11          3HD1      LEU  11  22.052  -5.207   3.112
   70   1HD2  LEU  11          1HD2      LEU  11  19.299  -6.376   2.517
   71   2HD2  LEU  11          2HD2      LEU  11  20.375  -6.760   3.861
   72   3HD2  LEU  11          3HD2      LEU  11  19.781  -8.047   2.812
   73    H    VAL  12           H        VAL  12  19.910  -3.659  -0.562
   74    HA   VAL  12           HA       VAL  12  21.478  -3.940  -3.047
   75    HB   VAL  12           HB       VAL  12  20.266  -2.269  -4.127
   76   1HG1  VAL  12          1HG1      VAL  12  18.814  -4.389  -2.881
   77   2HG1  VAL  12          2HG1      VAL  12  18.570  -3.653  -4.465
   78   3HG1  VAL  12          3HG1      VAL  12  17.768  -2.979  -3.046
   79   1HG2  VAL  12          1HG2      VAL  12  19.897  -1.226  -1.480
   80   2HG2  VAL  12          2HG2      VAL  12  18.352  -1.273  -2.330
   81   3HG2  VAL  12          3HG2      VAL  12  19.721  -0.413  -3.034
   82    H    GLN  13           H        GLN  13  22.167  -1.489  -3.664
   83    HA   GLN  13           HA       GLN  13  23.777  -0.586  -1.378
   84   1HB   GLN  13          2HB       GLN  13  24.147  -0.227  -4.360
   85   2HB   GLN  13          1HB       GLN  13  25.175   0.524  -3.146
   86   1HG   GLN  13          2HG       GLN  13  26.454  -1.282  -3.429
   87   2HG   GLN  13          1HG       GLN  13  25.280  -2.070  -2.376
   88   1HE2  GLN  13          1HE2      GLN  13  23.554  -3.263  -3.382
   89   2HE2  GLN  13          2HE2      GLN  13  23.803  -3.994  -4.927
   90    HA   PRO  14           HA       PRO  14  21.740   3.330  -1.208
   91   1HB   PRO  14          2HB       PRO  14  24.247   4.851  -1.340
   92   2HB   PRO  14          1HB       PRO  14  23.114   4.674   0.001
   93   1HG   PRO  14          2HG       PRO  14  25.543   3.528   0.049
   94   2HG   PRO  14          1HG       PRO  14  24.125   2.748   0.778
   95   1HD   PRO  14          2HD       PRO  14  25.422   2.213  -1.875
   96   2HD   PRO  14          1HD       PRO  14  24.834   1.059  -0.658
   97    H    GLY  15           H        GLY  15  22.378   2.306  -3.951
   98   1HA   GLY  15          2HA       GLY  15  21.536   4.586  -5.410
   99   2HA   GLY  15          1HA       GLY  15  23.244   4.279  -5.695
  100    H    GLY  16           H        GLY  16  20.897   1.738  -5.082
  101   1HA   GLY  16          2HA       GLY  16  21.313   0.818  -7.857
  102   2HA   GLY  16          1HA       GLY  16  21.053  -0.250  -6.486
  103    H    SER  17           H        SER  17  19.199  -1.270  -6.918
  104    HA   SER  17           HA       SER  17  16.756   0.259  -6.944
  105   1HB   SER  17          2HB       SER  17  17.593   0.085  -9.381
  106   2HB   SER  17          1HB       SER  17  17.162  -1.621  -9.262
  107    HG   SER  17           HG       SER  17  15.063  -1.094  -9.053
  108    H    LEU  18           H        LEU  18  14.948  -0.962  -6.363
  109    HA   LEU  18           HA       LEU  18  15.327  -3.829  -5.946
  110   1HB   LEU  18          2HB       LEU  18  15.955  -2.406  -3.879
  111   2HB   LEU  18          1HB       LEU  18  14.231  -2.140  -3.720
  112    HG   LEU  18           HG       LEU  18  13.809  -4.423  -3.265
  113   1HD1  LEU  18          1HD1      LEU  18  14.925  -5.957  -4.431
  114   2HD1  LEU  18          2HD1      LEU  18  16.227  -5.775  -3.256
  115   3HD1  LEU  18          3HD1      LEU  18  16.256  -4.846  -4.755
  116   1HD2  LEU  18          1HD2      LEU  18  15.804  -2.981  -1.779
  117   2HD2  LEU  18          2HD2      LEU  18  16.064  -4.720  -1.643
  118   3HD2  LEU  18          3HD2      LEU  18  14.506  -4.023  -1.197
  119    H    ARG  19           H        ARG  19  13.406  -5.025  -5.790
  120    HA   ARG  19           HA       ARG  19  10.930  -3.544  -6.373
  121   1HB   ARG  19          2HB       ARG  19  11.825  -4.512  -8.453
  122   2HB   ARG  19          1HB       ARG  19  11.836  -6.103  -7.705
  123   1HG   ARG  19          2HG       ARG  19   9.460  -6.165  -7.607
  124   2HG   ARG  19          1HG       ARG  19   9.339  -4.465  -8.070
  125   1HD   ARG  19          2HD       ARG  19  10.774  -6.299  -9.910
  126   2HD   ARG  19          1HD       ARG  19   9.020  -6.443  -9.818
  127    HE   ARG  19           HE       ARG  19  10.515  -4.075 -10.703
  128   1HH1  ARG  19          1HH1      ARG  19   7.517  -5.815 -10.361
  129   2HH1  ARG  19          2HH1      ARG  19   6.635  -4.758 -11.411
  130   1HH2  ARG  19          1HH2      ARG  19   9.366  -2.681 -12.092
  131   2HH2  ARG  19          2HH2      ARG  19   7.686  -2.975 -12.398
  132    H    VAL  20           H        VAL  20   9.710  -3.833  -4.617
  133    HA   VAL  20           HA       VAL  20   9.677  -6.489  -3.353
  134    HB   VAL  20           HB       VAL  20   8.766  -5.422  -1.378
  135   1HG1  VAL  20          1HG1      VAL  20  10.697  -4.341  -0.653
  136   2HG1  VAL  20          2HG1      VAL  20  11.042  -3.690  -2.255
  137   3HG1  VAL  20          3HG1      VAL  20  11.256  -5.412  -1.938
  138   1HG2  VAL  20          1HG2      VAL  20   7.585  -3.614  -2.857
  139   2HG2  VAL  20          2HG2      VAL  20   9.075  -2.709  -2.590
  140   3HG2  VAL  20          3HG2      VAL  20   8.094  -3.216  -1.216
  141    H    SER  21           H        SER  21   7.733  -7.544  -2.885
  142    HA   SER  21           HA       SER  21   5.336  -6.476  -4.223
  143   1HB   SER  21          2HB       SER  21   4.859  -8.527  -5.255
  144   2HB   SER  21          1HB       SER  21   6.603  -8.362  -5.459
  145    HG   SER  21           HG       SER  21   6.217 -10.411  -4.706
  146    H    CYS  22           H        CYS  22   3.302  -7.616  -3.519
  147    HA   CYS  22           HA       CYS  22   3.397  -8.757  -0.841
  148   1HB   CYS  22          2HB       CYS  22   3.188  -6.506  -0.179
  149   2HB   CYS  22          1HB       CYS  22   2.110  -6.124  -1.515
  150    H    ALA  23           H        ALA  23   2.381 -10.629  -1.281
  151    HA   ALA  23           HA       ALA  23   0.097 -10.682  -3.059
  152   1HB   ALA  23          1HB       ALA  23   1.487 -12.538  -3.346
  153   2HB   ALA  23          2HB       ALA  23   0.119 -13.161  -2.424
  154   3HB   ALA  23          3HB       ALA  23   1.642 -12.804  -1.609
  155    H    ALA  24           H        ALA  24  -1.659  -9.755  -2.152
  156    HA   ALA  24           HA       ALA  24  -2.362 -10.263   0.611
  157   1HB   ALA  24          1HB       ALA  24  -4.049  -8.626   0.341
  158   2HB   ALA  24          2HB       ALA  24  -3.993  -8.753  -1.417
  159   3HB   ALA  24          3HB       ALA  24  -2.639  -8.035  -0.540
  160    H    SER  25           H        SER  25  -4.847 -10.646   0.956
  161    HA   SER  25           HA       SER  25  -6.131 -12.394  -0.916
  162   1HB   SER  25          2HB       SER  25  -4.518 -13.519   1.284
  163   2HB   SER  25          1HB       SER  25  -6.152 -14.170   1.153
  164    HG   SER  25           HG       SER  25  -4.310 -15.134  -0.147
  165    H    GLY  26           H        GLY  26  -8.038 -11.359  -0.756
  166   1HA   GLY  26          2HA       GLY  26  -9.893 -11.862   1.178
  167   2HA   GLY  26          1HA       GLY  26  -9.072 -10.421   1.759
  168    H    PHE  27           H        PHE  27  -8.584  -9.243  -0.787
  169    HA   PHE  27           HA       PHE  27 -11.260  -8.816  -1.887
  170   1HB   PHE  27          2HB       PHE  27 -11.130  -6.430  -1.691
  171   2HB   PHE  27          1HB       PHE  27 -10.812  -7.109  -0.100
  172    HD1  PHE  27           1HD      PHE  27  -8.668  -6.891   0.944
  173    HD2  PHE  27           2HD      PHE  27  -9.345  -5.379  -2.977
  174    HE1  PHE  27           1HE      PHE  27  -6.579  -5.599   1.084
  175    HE2  PHE  27           2HE      PHE  27  -7.256  -4.090  -2.845
  176    HZ   PHE  27           HZ       PHE  27  -5.870  -4.201  -0.817
  177    H    THR  28           H        THR  28 -10.853  -6.932  -3.728
  178    HA   THR  28           HA       THR  28  -9.055  -8.255  -5.573
  179    HB   THR  28           HB       THR  28 -10.741  -5.821  -6.146
  180    HG1  THR  28           1HG      THR  28 -12.347  -7.283  -6.794
  181   1HG2  THR  28          1HG2      THR  28 -10.141  -6.078  -8.297
  182   2HG2  THR  28          2HG2      THR  28 -10.281  -7.835  -8.222
  183   3HG2  THR  28          3HG2      THR  28  -8.808  -7.041  -7.657
  184    H    PHE  29           H        PHE  29  -9.399  -4.907  -6.186
  185    HA   PHE  29           HA       PHE  29  -7.166  -3.894  -4.793
  186   1HB   PHE  29          2HB       PHE  29  -6.585  -5.393  -7.202
  187   2HB   PHE  29          1HB       PHE  29  -6.077  -3.719  -7.369
  188    HD1  PHE  29           1HD      PHE  29  -3.879  -5.140  -7.624
  189    HD2  PHE  29           2HD      PHE  29  -5.960  -4.540  -3.963
  190    HE1  PHE  29           1HE      PHE  29  -1.826  -5.652  -6.372
  191    HE2  PHE  29           2HE      PHE  29  -3.913  -5.053  -2.709
  192    HZ   PHE  29           HZ       PHE  29  -1.839  -5.607  -3.912
  193    H    SER  30           H        SER  30  -8.433  -3.602  -8.118
  194    HA   SER  30           HA       SER  30  -8.279  -0.799  -8.203
  195   1HB   SER  30          2HB       SER  30  -8.425  -2.194 -10.223
  196   2HB   SER  30          1HB       SER  30 -10.077  -2.641  -9.798
  197    HG   SER  30           HG       SER  30  -9.635  -0.779 -11.332
  198    H    SER  31           H        SER  31 -10.374  -2.759  -6.462
  199    HA   SER  31           HA       SER  31 -12.539  -0.789  -6.471
  200   1HB   SER  31          2HB       SER  31 -12.385  -3.652  -6.045
  201   2HB   SER  31          1HB       SER  31 -13.217  -2.857  -4.707
  202    HG   SER  31           HG       SER  31 -14.771  -3.221  -6.197
  203    H    TYR  32           H        TYR  32  -9.821  -1.754  -4.659
  204    HA   TYR  32           HA       TYR  32 -10.770  -0.220  -2.328
  205   1HB   TYR  32          2HB       TYR  32  -8.990  -2.633  -2.532
  206   2HB   TYR  32          1HB       TYR  32  -8.887  -1.563  -1.139
  207    HD1  TYR  32           1HD      TYR  32 -10.226  -2.008   0.695
  208    HD2  TYR  32           2HD      TYR  32 -11.413  -3.476  -3.116
  209    HE1  TYR  32           1HE      TYR  32 -12.096  -3.210   1.748
  210    HE2  TYR  32           2HE      TYR  32 -13.288  -4.679  -2.078
  211    HH   TYR  32           HH       TYR  32 -14.267  -5.267  -0.164
  212    H    HIS  33           H        HIS  33  -8.898   0.717  -1.042
  213    HA   HIS  33           HA       HIS  33  -6.961   1.932  -2.903
  214   1HB   HIS  33          2HB       HIS  33  -8.422   2.993  -0.511
  215   2HB   HIS  33          1HB       HIS  33  -6.841   3.656  -0.909
  216    HD1  HIS  33           1HD      HIS  33 -10.312   3.302  -2.350
  217    HD2  HIS  33           2HD      HIS  33  -6.821   5.464  -2.977
  218    HE1  HIS  33           1HE      HIS  33 -10.905   5.054  -4.052
  219    HE2  HIS  33           2HE      HIS  33  -8.800   6.408  -4.348
  220    H    MET  34           H        MET  34  -5.271   0.492  -2.705
  221    HA   MET  34           HA       MET  34  -4.428  -0.362  -0.069
  222   1HB   MET  34          2HB       MET  34  -3.947  -1.225  -2.822
  223   2HB   MET  34          1HB       MET  34  -2.521  -1.310  -1.794
  224   1HG   MET  34          2HG       MET  34  -5.063  -2.388  -0.722
  225   2HG   MET  34          1HG       MET  34  -4.246  -3.303  -1.990
  226   1HE   MET  34          1HE       MET  34  -2.458  -4.666  -1.820
  227   2HE   MET  34          2HE       MET  34  -3.310  -5.551  -0.554
  228   3HE   MET  34          3HE       MET  34  -1.600  -5.162  -0.362
  229    H    ALA  35           H        ALA  35  -2.077  -0.335   0.460
  230    HA   ALA  35           HA       ALA  35  -0.515   1.835  -0.617
  231   1HB   ALA  35          1HB       ALA  35  -0.889   3.419   0.906
  232   2HB   ALA  35          2HB       ALA  35  -0.826   2.267   2.241
  233   3HB   ALA  35          3HB       ALA  35  -2.327   2.496   1.341
  234    H    TRP  36           H        TRP  36   1.619   1.949   0.248
  235    HA   TRP  36           HA       TRP  36   2.463  -0.534   1.558
  236   1HB   TRP  36          2HB       TRP  36   3.770   1.275  -0.429
  237   2HB   TRP  36          1HB       TRP  36   4.786   0.340   0.670
  238    HD1  TRP  36           HD       TRP  36   2.107  -0.187  -2.055
  239    HE1  TRP  36           1HE      TRP  36   2.404  -2.545  -3.045
  240    HE3  TRP  36           3HE      TRP  36   5.794  -1.903   1.043
  241    HZ2  TRP  36           2HZ      TRP  36   4.011  -4.822  -2.584
  242    HZ3  TRP  36           3HZ      TRP  36   6.658  -4.180   0.700
  243    HH2  TRP  36           HH       TRP  36   5.782  -5.610  -1.076
  244    H    VAL  37           H        VAL  37   3.908  -0.485   3.255
  245    HA   VAL  37           HA       VAL  37   4.152   2.082   4.678
  246    HB   VAL  37           HB       VAL  37   4.042  -0.482   6.208
  247   1HG1  VAL  37          1HG1      VAL  37   4.430   1.621   7.339
  248   2HG1  VAL  37          2HG1      VAL  37   2.920   0.854   7.831
  249   3HG1  VAL  37          3HG1      VAL  37   2.890   2.230   6.724
  250   1HG2  VAL  37          1HG2      VAL  37   2.209  -0.797   4.674
  251   2HG2  VAL  37          2HG2      VAL  37   1.631   0.845   4.973
  252   3HG2  VAL  37          3HG2      VAL  37   1.568  -0.363   6.259
  253    H    ARG  38           H        ARG  38   5.915   2.074   6.349
  254    HA   ARG  38           HA       ARG  38   8.074   0.195   6.014
  255   1HB   ARG  38          2HB       ARG  38   8.528   1.613   4.109
  256   2HB   ARG  38          1HB       ARG  38   8.393   3.057   5.104
  257   1HG   ARG  38          2HG       ARG  38  10.338   1.866   6.448
  258   2HG   ARG  38          1HG       ARG  38  10.612   1.105   4.879
  259   1HD   ARG  38          2HD       ARG  38  11.927   3.188   5.247
  260   2HD   ARG  38          1HD       ARG  38  10.889   3.233   3.823
  261    HE   ARG  38           HE       ARG  38   9.703   4.355   6.200
  262   1HH1  ARG  38          1HH1      ARG  38  11.629   4.971   3.362
  263   2HH1  ARG  38          2HH1      ARG  38  11.289   6.669   3.343
  264   1HH2  ARG  38          1HH2      ARG  38   9.253   6.588   6.184
  265   2HH2  ARG  38          2HH2      ARG  38   9.940   7.588   4.949
  266    H    GLN  39           H        GLN  39   9.365   0.106   7.786
  267    HA   GLN  39           HA       GLN  39   9.054   2.216   9.814
  268   1HB   GLN  39          2HB       GLN  39   7.785   0.461  10.711
  269   2HB   GLN  39          1HB       GLN  39   8.902  -0.768  10.133
  270   1HG   GLN  39          2HG       GLN  39  10.571   0.102  11.778
  271   2HG   GLN  39          1HG       GLN  39   9.301   1.140  12.425
  272   1HE2  GLN  39          1HE2      GLN  39   8.336   0.362  14.143
  273   2HE2  GLN  39          2HE2      GLN  39   8.108  -1.307  14.524
  274    H    ALA  40           H        ALA  40  10.929   3.194  10.099
  275    HA   ALA  40           HA       ALA  40  13.431   1.965   9.401
  276   1HB   ALA  40          1HB       ALA  40  14.242   4.062   9.409
  277   2HB   ALA  40          2HB       ALA  40  13.534   4.433  10.981
  278   3HB   ALA  40          3HB       ALA  40  12.550   4.546   9.522
  279    HA   PRO  41           HA       PRO  41  14.922   0.205  13.164
  280   1HB   PRO  41          2HB       PRO  41  17.097   1.891  13.762
  281   2HB   PRO  41          1HB       PRO  41  17.150   0.400  12.819
  282   1HG   PRO  41          2HG       PRO  41  17.012   3.227  11.894
  283   2HG   PRO  41          1HG       PRO  41  17.838   1.840  11.161
  284   1HD   PRO  41          2HD       PRO  41  15.561   2.783  10.135
  285   2HD   PRO  41          1HD       PRO  41  15.886   1.036  10.184
  286    H    GLY  42           H        GLY  42  14.175   3.576  13.026
  287   1HA   GLY  42          2HA       GLY  42  13.483   3.499  15.884
  288   2HA   GLY  42          1HA       GLY  42  14.435   4.841  15.265
  289    H    LYS  43           H        LYS  43  11.376   3.117  14.671
  290    HA   LYS  43           HA       LYS  43   9.855   5.524  14.752
  291   1HB   LYS  43          2HB       LYS  43  11.018   4.892  12.253
  292   2HB   LYS  43          1HB       LYS  43   9.308   4.504  12.121
  293   1HG   LYS  43          2HG       LYS  43   8.681   6.659  12.183
  294   2HG   LYS  43          1HG       LYS  43   9.901   7.090  13.383
  295   1HD   LYS  43          2HD       LYS  43  11.469   7.590  11.808
  296   2HD   LYS  43          1HD       LYS  43  10.857   6.395  10.662
  297   1HE   LYS  43          2HE       LYS  43   9.166   7.812   9.906
  298   2HE   LYS  43          1HE       LYS  43   9.264   8.843  11.331
  299   1HZ   LYS  43          1HZ       LYS  43  11.389   8.629   9.268
  300   2HZ   LYS  43          2HZ       LYS  43  11.352   9.703  10.573
  301   3HZ   LYS  43          3HZ       LYS  43  10.227   9.858   9.322
  302    H    GLY  44           H        GLY  44   7.524   5.100  14.145
  303   1HA   GLY  44          2HA       GLY  44   6.847   2.330  14.907
  304   2HA   GLY  44          1HA       GLY  44   5.856   3.736  15.265
  305    H    LEU  45           H        LEU  45   7.395   2.536  12.301
  306    HA   LEU  45           HA       LEU  45   6.595   2.015  10.252
  307   1HB   LEU  45          2HB       LEU  45   4.817   0.823  11.927
  308   2HB   LEU  45          1HB       LEU  45   3.754   1.885  11.029
  309    HG   LEU  45           HG       LEU  45   3.860   0.611   9.145
  310   1HD1  LEU  45          1HD1      LEU  45   5.729  -0.047   8.070
  311   2HD1  LEU  45          2HD1      LEU  45   6.566  -0.509   9.550
  312   3HD1  LEU  45          3HD1      LEU  45   6.425   1.192   9.109
  313   1HD2  LEU  45          1HD2      LEU  45   3.887  -0.926  11.432
  314   2HD2  LEU  45          2HD2      LEU  45   5.093  -1.694  10.401
  315   3HD2  LEU  45          3HD2      LEU  45   3.445  -1.467   9.812
  316    H    GLU  46           H        GLU  46   5.645   2.959   8.454
  317    HA   GLU  46           HA       GLU  46   3.987   5.309   8.769
  318   1HB   GLU  46          2HB       GLU  46   5.691   6.772   8.715
  319   2HB   GLU  46          1HB       GLU  46   6.856   5.502   8.360
  320   1HG   GLU  46          2HG       GLU  46   6.755   5.843   6.105
  321   2HG   GLU  46          1HG       GLU  46   5.091   6.429   6.156
  322    H    TRP  47           H        TRP  47   2.676   5.574   7.059
  323    HA   TRP  47           HA       TRP  47   2.720   3.613   4.975
  324   1HB   TRP  47          2HB       TRP  47   0.536   4.233   5.310
  325   2HB   TRP  47          1HB       TRP  47   0.962   5.883   5.758
  326    HD1  TRP  47           HD       TRP  47   0.630   3.694   2.590
  327    HE1  TRP  47           1HE      TRP  47   0.052   5.242   0.618
  328    HE3  TRP  47           3HE      TRP  47   0.908   8.198   4.979
  329    HZ2  TRP  47           2HZ      TRP  47  -0.243   8.012   0.137
  330    HZ3  TRP  47           3HZ      TRP  47   0.476  10.252   3.693
  331    HH2  TRP  47           HH       TRP  47  -0.088  10.158   1.321
  332    H    VAL  48           H        VAL  48   4.207   3.724   3.395
  333    HA   VAL  48           HA       VAL  48   5.501   6.202   2.748
  334    HB   VAL  48           HB       VAL  48   6.492   4.689   0.852
  335   1HG1  VAL  48          1HG1      VAL  48   7.445   5.557   3.152
  336   2HG1  VAL  48          2HG1      VAL  48   8.315   4.353   2.201
  337   3HG1  VAL  48          3HG1      VAL  48   7.332   3.849   3.578
  338   1HG2  VAL  48          1HG2      VAL  48   6.168   2.426   2.655
  339   2HG2  VAL  48          2HG2      VAL  48   6.131   2.497   0.892
  340   3HG2  VAL  48          3HG2      VAL  48   4.691   2.903   1.823
  341    H    SER  49           H        SER  49   3.624   3.881   0.784
  342    HA   SER  49           HA       SER  49   2.857   6.182  -0.909
  343   1HB   SER  49          2HB       SER  49   3.267   3.522  -2.187
  344   2HB   SER  49          1HB       SER  49   3.455   5.139  -2.865
  345    HG   SER  49           HG       SER  49   5.269   3.563  -1.523
  346    H    THR  50           H        THR  50   0.947   6.022  -2.119
  347    HA   THR  50           HA       THR  50  -0.918   3.865  -1.449
  348    HB   THR  50           HB       THR  50  -1.286   6.752  -0.789
  349    HG1  THR  50           1HG      THR  50  -2.674   4.603   0.374
  350   1HG2  THR  50          1HG2      THR  50  -3.549   4.980  -1.721
  351   2HG2  THR  50          2HG2      THR  50  -2.988   6.460  -2.501
  352   3HG2  THR  50          3HG2      THR  50  -3.741   6.535  -0.908
  353    H    ILE  51           H        ILE  51  -2.340   3.375  -3.121
  354    HA   ILE  51           HA       ILE  51  -1.959   4.966  -5.573
  355    HB   ILE  51           HB       ILE  51  -0.939   2.755  -5.754
  356   1HG1  ILE  51          2HG1      ILE  51  -3.079   2.173  -7.580
  357   2HG1  ILE  51          1HG1      ILE  51  -2.818   3.914  -7.523
  358   1HG2  ILE  51          1HG2      ILE  51  -2.012   0.759  -5.386
  359   2HG2  ILE  51          2HG2      ILE  51  -3.612   1.439  -5.680
  360   3HG2  ILE  51          3HG2      ILE  51  -2.776   1.774  -4.163
  361   1HD1  ILE  51          1HD1      ILE  51  -0.934   1.754  -8.358
  362   2HD1  ILE  51          2HD1      ILE  51  -0.332   3.326  -7.830
  363   3HD1  ILE  51          3HD1      ILE  51  -1.414   3.217  -9.219
  364    H    ASN  52           H        ASN  52  -3.697   5.538  -6.780
  365    HA   ASN  52           HA       ASN  52  -6.339   4.960  -5.621
  366   1HB   ASN  52          2HB       ASN  52  -5.935   7.302  -5.506
  367   2HB   ASN  52          1HB       ASN  52  -5.295   7.348  -7.145
  368   1HD2  ASN  52          1HD2      ASN  52  -8.088   7.473  -5.173
  369   2HD2  ASN  52          2HD2      ASN  52  -9.242   7.727  -6.431
  370    HA   PRO  53           HA       PRO  53  -7.095   2.785  -9.439
  371   1HB   PRO  53          2HB       PRO  53  -9.625   2.031  -8.951
  372   2HB   PRO  53          1HB       PRO  53  -8.256   1.313  -8.092
  373   1HG   PRO  53          2HG       PRO  53 -10.155   3.441  -7.187
  374   2HG   PRO  53          1HG       PRO  53  -9.516   2.055  -6.286
  375   1HD   PRO  53          2HD       PRO  53  -8.533   4.604  -6.067
  376   2HD   PRO  53          1HD       PRO  53  -7.574   3.144  -5.752
  377    H    GLY  54           H        GLY  54  -8.250   3.044 -11.370
  378   1HA   GLY  54          2HA       GLY  54  -9.783   4.036 -12.834
  379   2HA   GLY  54          1HA       GLY  54 -10.262   5.138 -11.553
  380    H    ASP  55           H        ASP  55  -9.152   7.066 -11.265
  381    HA   ASP  55           HA       ASP  55  -8.138   8.307 -13.541
  382   1HB   ASP  55          2HB       ASP  55  -8.575   9.003 -10.775
  383   2HB   ASP  55          1HB       ASP  55  -7.054   9.686 -11.343
  384    H    GLY  56           H        GLY  56  -6.414   6.868 -10.793
  385   1HA   GLY  56          2HA       GLY  56  -4.344   5.694 -11.151
  386   2HA   GLY  56          1HA       GLY  56  -4.000   6.794 -12.478
  387    H    SER  57           H        SER  57  -5.305   8.543  -9.980
  388    HA   SER  57           HA       SER  57  -3.022  10.046  -9.474
  389   1HB   SER  57          2HB       SER  57  -5.732   9.926  -8.477
  390   2HB   SER  57          1HB       SER  57  -4.605  10.240  -7.158
  391    HG   SER  57           HG       SER  57  -4.899  12.217  -7.924
  392    H    THR  58           H        THR  58  -1.787  10.259  -7.476
  393    HA   THR  58           HA       THR  58  -1.659   7.854  -5.822
  394    HB   THR  58           HB       THR  58   1.012   8.367  -6.180
  395    HG1  THR  58           1HG      THR  58   1.231   8.384  -8.509
  396   1HG2  THR  58          1HG2      THR  58  -0.701   6.383  -7.678
  397   2HG2  THR  58          2HG2      THR  58  -0.033   6.162  -6.061
  398   3HG2  THR  58          3HG2      THR  58   1.045   6.272  -7.452
  399    H    TYR  59           H        TYR  59  -0.932   8.182  -3.771
  400    HA   TYR  59           HA       TYR  59  -0.066  10.906  -3.066
  401   1HB   TYR  59          2HB       TYR  59  -1.749   9.261  -1.200
  402   2HB   TYR  59          1HB       TYR  59  -1.501  11.003  -1.221
  403    HD1  TYR  59           1HD      TYR  59  -2.757  12.419  -2.762
  404    HD2  TYR  59           2HD      TYR  59  -3.383   8.214  -2.645
  405    HE1  TYR  59           1HE      TYR  59  -4.847  12.702  -4.028
  406    HE2  TYR  59           2HE      TYR  59  -5.474   8.484  -3.911
  407    HH   TYR  59           HH       TYR  59  -6.792   9.904  -5.015
  408    H    TYR  60           H        TYR  60   1.628  11.044  -1.678
  409    HA   TYR  60           HA       TYR  60   2.626   8.534  -0.500
  410   1HB   TYR  60          2HB       TYR  60   4.147  10.680  -1.976
  411   2HB   TYR  60          1HB       TYR  60   4.946   9.552  -0.887
  412    HD1  TYR  60           1HD      TYR  60   2.507   9.425  -3.727
  413    HD2  TYR  60           2HD      TYR  60   5.931   7.718  -1.866
  414    HE1  TYR  60           1HE      TYR  60   2.692   7.803  -5.565
  415    HE2  TYR  60           2HE      TYR  60   6.122   6.092  -3.699
  416    HH   TYR  60           HH       TYR  60   3.658   5.796  -6.158
  417    H    ALA  61           H        ALA  61   4.384   9.052   1.194
  418    HA   ALA  61           HA       ALA  61   3.192  10.748   3.172
  419   1HB   ALA  61          1HB       ALA  61   4.268   9.384   4.557
  420   2HB   ALA  61          2HB       ALA  61   5.823   9.929   3.929
  421   3HB   ALA  61          3HB       ALA  61   4.991   8.574   3.167
  422    H    ASP  62           H        ASP  62   4.515  11.802   0.598
  423    HA   ASP  62           HA       ASP  62   5.397  13.806  -0.006
  424   1HB   ASP  62          2HB       ASP  62   4.929  14.185   2.819
  425   2HB   ASP  62          1HB       ASP  62   6.397  15.015   2.313
  426    H    SER  63           H        SER  63   7.251  12.343   2.672
  427    HA   SER  63           HA       SER  63   9.749  13.122   1.442
  428   1HB   SER  63          2HB       SER  63   8.947  11.815   4.000
  429   2HB   SER  63          1HB       SER  63  10.589  11.549   3.414
  430    HG   SER  63           HG       SER  63   9.443  14.127   3.651
  431    H    VAL  64           H        VAL  64   7.732  11.018   0.343
  432    HA   VAL  64           HA       VAL  64   9.822   9.122  -0.441
  433    HB   VAL  64           HB       VAL  64   7.979   7.308  -0.343
  434   1HG1  VAL  64          1HG1      VAL  64  10.088   7.762   1.178
  435   2HG1  VAL  64          2HG1      VAL  64   8.910   6.513   1.585
  436   3HG1  VAL  64          3HG1      VAL  64   8.849   8.079   2.392
  437   1HG2  VAL  64          1HG2      VAL  64   6.220   9.040   0.241
  438   2HG2  VAL  64          2HG2      VAL  64   6.928   9.065   1.855
  439   3HG2  VAL  64          3HG2      VAL  64   6.239   7.572   1.217
  440    H    LYS  65           H        LYS  65   7.583  11.297  -1.401
  441    HA   LYS  65           HA       LYS  65   6.127  10.135  -3.450
  442   1HB   LYS  65          2HB       LYS  65   6.019  12.537  -2.598
  443   2HB   LYS  65          1HB       LYS  65   7.370  12.872  -3.672
  444   1HG   LYS  65          2HG       LYS  65   5.462  13.510  -4.867
  445   2HG   LYS  65          1HG       LYS  65   5.922  11.946  -5.542
  446   1HD   LYS  65          2HD       LYS  65   3.811  11.310  -5.174
  447   2HD   LYS  65          1HD       LYS  65   4.224  11.292  -3.458
  448   1HE   LYS  65          2HE       LYS  65   2.313  12.626  -3.562
  449   2HE   LYS  65          1HE       LYS  65   3.640  13.785  -3.484
  450   1HZ   LYS  65          1HZ       LYS  65   1.673  13.496  -5.478
  451   2HZ   LYS  65          2HZ       LYS  65   3.192  13.228  -6.171
  452   3HZ   LYS  65          3HZ       LYS  65   2.881  14.674  -5.349
  453    H    GLY  66           H        GLY  66   9.350  11.639  -3.666
  454   1HA   GLY  66          2HA       GLY  66   9.702  10.391  -6.304
  455   2HA   GLY  66          1HA       GLY  66  10.690  11.685  -5.640
  456    H    ARG  67           H        ARG  67   9.812   8.934  -3.723
  457    HA   ARG  67           HA       ARG  67  12.616   8.034  -3.769
  458   1HB   ARG  67          2HB       ARG  67  11.034   8.801  -1.629
  459   2HB   ARG  67          1HB       ARG  67  10.966   7.043  -1.573
  460   1HG   ARG  67          2HG       ARG  67  12.915   7.059  -0.533
  461   2HG   ARG  67          1HG       ARG  67  13.657   7.702  -2.002
  462   1HD   ARG  67          2HD       ARG  67  14.006   9.663  -1.023
  463   2HD   ARG  67          1HD       ARG  67  12.296   9.797  -0.613
  464    HE   ARG  67           HE       ARG  67  13.573   8.052   1.193
  465   1HH1  ARG  67          1HH1      ARG  67  13.384  11.433   0.368
  466   2HH1  ARG  67          2HH1      ARG  67  13.741  11.976   1.974
  467   1HH2  ARG  67          1HH2      ARG  67  14.043   8.759   3.306
  468   2HH2  ARG  67          2HH2      ARG  67  14.116  10.455   3.644
  469    H    PHE  68           H        PHE  68   9.350   6.770  -3.192
  470    HA   PHE  68           HA       PHE  68  10.180   4.240  -4.449
  471   1HB   PHE  68          2HB       PHE  68   8.108   4.749  -2.310
  472   2HB   PHE  68          1HB       PHE  68   8.420   3.182  -3.053
  473    HD1  PHE  68           1HD      PHE  68   9.413   5.545  -0.542
  474    HD2  PHE  68           2HD      PHE  68  10.658   2.117  -2.731
  475    HE1  PHE  68           1HE      PHE  68  11.155   5.107   1.140
  476    HE2  PHE  68           2HE      PHE  68  12.399   1.674  -1.054
  477    HZ   PHE  68           HZ       PHE  68  12.646   3.167   0.880
  478    H    THR  69           H        THR  69   8.382   3.005  -5.435
  479    HA   THR  69           HA       THR  69   6.346   4.767  -6.628
  480    HB   THR  69           HB       THR  69   8.068   2.712  -8.020
  481    HG1  THR  69           1HG      THR  69   8.959   4.464  -8.783
  482   1HG2  THR  69          1HG2      THR  69   6.643   2.632  -9.862
  483   2HG2  THR  69          2HG2      THR  69   5.760   4.075  -9.367
  484   3HG2  THR  69          3HG2      THR  69   5.518   2.556  -8.506
  485    H    ILE  70           H        ILE  70   4.352   4.072  -6.346
  486    HA   ILE  70           HA       ILE  70   3.956   1.317  -5.433
  487    HB   ILE  70           HB       ILE  70   3.178   3.409  -4.094
  488   1HG1  ILE  70          2HG1      ILE  70   1.577   0.915  -4.604
  489   2HG1  ILE  70          1HG1      ILE  70   2.641   1.286  -3.253
  490   1HG2  ILE  70          1HG2      ILE  70   0.772   3.134  -5.876
  491   2HG2  ILE  70          2HG2      ILE  70   2.000   4.380  -6.100
  492   3HG2  ILE  70          3HG2      ILE  70   1.062   4.325  -4.607
  493   1HD1  ILE  70          1HD1      ILE  70   0.499   1.413  -2.366
  494   2HD1  ILE  70          2HD1      ILE  70  -0.132   2.276  -3.769
  495   3HD1  ILE  70          3HD1      ILE  70   0.958   3.093  -2.647
  496    H    SER  71           H        SER  71   2.841  -0.107  -6.603
  497    HA   SER  71           HA       SER  71   0.971   0.725  -8.645
  498   1HB   SER  71          2HB       SER  71   2.383  -0.941 -10.226
  499   2HB   SER  71          1HB       SER  71   2.629   0.806 -10.210
  500    HG   SER  71           HG       SER  71   4.622  -0.007  -9.914
  501    H    ARG  72           H        ARG  72  -0.011  -1.204  -9.740
  502    HA   ARG  72           HA       ARG  72   0.268  -3.764  -8.458
  503   1HB   ARG  72          2HB       ARG  72  -2.143  -3.800  -7.699
  504   2HB   ARG  72          1HB       ARG  72  -1.057  -2.803  -6.741
  505   1HG   ARG  72          2HG       ARG  72  -1.859  -0.818  -7.991
  506   2HG   ARG  72          1HG       ARG  72  -3.030  -1.856  -8.807
  507   1HD   ARG  72          2HD       ARG  72  -3.852  -2.506  -6.502
  508   2HD   ARG  72          1HD       ARG  72  -2.866  -1.183  -5.879
  509    HE   ARG  72           HE       ARG  72  -4.516  -0.221  -7.942
  510   1HH1  ARG  72          1HH1      ARG  72  -4.714  -1.379  -4.659
  511   2HH1  ARG  72          2HH1      ARG  72  -6.128  -0.452  -4.282
  512   1HH2  ARG  72          1HH2      ARG  72  -6.378   1.000  -7.453
  513   2HH2  ARG  72          2HH2      ARG  72  -7.074   0.899  -5.871
  514    H    ASP  73           H        ASP  73  -1.042  -5.412  -9.444
  515    HA   ASP  73           HA       ASP  73  -1.809  -4.704 -12.184
  516   1HB   ASP  73          2HB       ASP  73  -0.113  -6.487 -11.881
  517   2HB   ASP  73          1HB       ASP  73  -1.294  -7.433 -10.983
  518    H    ASN  74           H        ASN  74  -3.867  -4.724 -12.813
  519    HA   ASN  74           HA       ASN  74  -5.986  -5.025 -11.010
  520   1HB   ASN  74          2HB       ASN  74  -5.979  -5.075 -14.034
  521   2HB   ASN  74          1HB       ASN  74  -7.439  -4.997 -13.053
  522   1HD2  ASN  74          1HD2      ASN  74  -6.344  -3.110 -15.006
  523   2HD2  ASN  74          2HD2      ASN  74  -6.175  -1.609 -14.168
  524    H    ALA  75           H        ALA  75  -7.631  -6.600 -10.864
  525    HA   ALA  75           HA       ALA  75  -8.418  -8.716 -10.612
  526   1HB   ALA  75          1HB       ALA  75  -8.463  -8.438 -13.144
  527   2HB   ALA  75          2HB       ALA  75  -8.511 -10.085 -12.517
  528   3HB   ALA  75          3HB       ALA  75  -7.006  -9.432 -13.165
  529    H    LYS  76           H        LYS  76  -5.567  -7.964  -9.804
  530    HA   LYS  76           HA       LYS  76  -4.748 -10.699  -9.148
  531   1HB   LYS  76          2HB       LYS  76  -3.439  -9.411 -11.105
  532   2HB   LYS  76          1HB       LYS  76  -2.568  -8.764  -9.721
  533   1HG   LYS  76          2HG       LYS  76  -2.231 -11.164  -8.985
  534   2HG   LYS  76          1HG       LYS  76  -2.818 -11.629 -10.583
  535   1HD   LYS  76          2HD       LYS  76  -1.026 -10.075 -11.513
  536   2HD   LYS  76          1HD       LYS  76  -0.355 -10.054  -9.882
  537   1HE   LYS  76          2HE       LYS  76   0.801 -11.857 -10.539
  538   2HE   LYS  76          1HE       LYS  76  -0.716 -12.725 -10.310
  539   1HZ   LYS  76          1HZ       LYS  76  -0.332 -11.426 -12.889
  540   2HZ   LYS  76          2HZ       LYS  76  -1.048 -12.914 -12.522
  541   3HZ   LYS  76          3HZ       LYS  76   0.637 -12.778 -12.575
  542    H    ASN  77           H        ASN  77  -4.657 -10.872  -7.019
  543    HA   ASN  77           HA       ASN  77  -4.576  -8.555  -5.320
  544   1HB   ASN  77          2HB       ASN  77  -5.621 -11.078  -5.064
  545   2HB   ASN  77          1HB       ASN  77  -4.187 -11.180  -4.051
  546   1HD2  ASN  77          1HD2      ASN  77  -4.838  -8.045  -3.901
  547   2HD2  ASN  77          2HD2      ASN  77  -5.913  -7.999  -2.551
  548    H    THR  78           H        THR  78  -2.392  -7.912  -6.246
  549    HA   THR  78           HA       THR  78  -0.372  -8.697  -4.333
  550    HB   THR  78           HB       THR  78   0.467  -8.964  -7.195
  551    HG1  THR  78           1HG      THR  78  -0.158 -11.278  -5.756
  552   1HG2  THR  78          1HG2      THR  78   1.471 -10.169  -4.614
  553   2HG2  THR  78          2HG2      THR  78   2.188  -8.797  -5.459
  554   3HG2  THR  78          3HG2      THR  78   2.194 -10.395  -6.206
  555    H    LEU  79           H        LEU  79   0.514  -6.896  -3.679
  556    HA   LEU  79           HA       LEU  79   0.450  -4.487  -5.282
  557   1HB   LEU  79          2HB       LEU  79   0.555  -5.133  -2.492
  558   2HB   LEU  79          1HB       LEU  79   1.906  -4.086  -2.879
  559    HG   LEU  79           HG       LEU  79  -1.000  -3.477  -3.379
  560   1HD1  LEU  79          1HD1      LEU  79   0.318  -1.607  -1.692
  561   2HD1  LEU  79          2HD1      LEU  79   0.554  -3.233  -1.052
  562   3HD1  LEU  79          3HD1      LEU  79  -1.076  -2.628  -1.342
  563   1HD2  LEU  79          1HD2      LEU  79  -0.442  -1.719  -4.620
  564   2HD2  LEU  79          2HD2      LEU  79   1.129  -2.501  -4.794
  565   3HD2  LEU  79          3HD2      LEU  79   0.886  -1.279  -3.547
  566    H    TYR  80           H        TYR  80   2.235  -3.366  -6.031
  567    HA   TYR  80           HA       TYR  80   4.854  -4.647  -5.689
  568   1HB   TYR  80          2HB       TYR  80   3.640  -3.725  -8.298
  569   2HB   TYR  80          1HB       TYR  80   5.336  -4.157  -8.094
  570    HD1  TYR  80           1HD      TYR  80   1.893  -5.478  -7.836
  571    HD2  TYR  80           2HD      TYR  80   6.026  -6.395  -8.200
  572    HE1  TYR  80           1HE      TYR  80   1.322  -7.824  -8.235
  573    HE2  TYR  80           2HE      TYR  80   5.476  -8.755  -8.611
  574    HH   TYR  80           HH       TYR  80   3.073  -9.937  -9.621
  575    H    LEU  81           H        LEU  81   6.441  -3.297  -5.216
  576    HA   LEU  81           HA       LEU  81   6.039  -0.439  -5.755
  577   1HB   LEU  81          2HB       LEU  81   5.682  -0.998  -3.347
  578   2HB   LEU  81          1HB       LEU  81   7.335  -1.577  -3.283
  579    HG   LEU  81           HG       LEU  81   7.004   1.177  -4.292
  580   1HD1  LEU  81          1HD1      LEU  81   6.321   0.408  -1.475
  581   2HD1  LEU  81          2HD1      LEU  81   5.395   1.406  -2.599
  582   3HD1  LEU  81          3HD1      LEU  81   6.903   2.016  -1.912
  583   1HD2  LEU  81          1HD2      LEU  81   9.199   0.717  -4.035
  584   2HD2  LEU  81          2HD2      LEU  81   8.926  -0.423  -2.717
  585   3HD2  LEU  81          3HD2      LEU  81   8.869   1.314  -2.409
  586    H    GLN  82           H        GLN  82   7.739   0.636  -6.564
  587    HA   GLN  82           HA       GLN  82  10.164  -0.931  -7.077
  588   1HB   GLN  82          2HB       GLN  82   8.748   0.168  -8.963
  589   2HB   GLN  82          1HB       GLN  82   9.489   1.669  -8.426
  590   1HG   GLN  82          2HG       GLN  82  10.785   0.886 -10.228
  591   2HG   GLN  82          1HG       GLN  82  11.720   0.568  -8.768
  592   1HE2  GLN  82          1HE2      GLN  82  12.920  -1.051  -9.738
  593   2HE2  GLN  82          2HE2      GLN  82  12.253  -2.599 -10.119
  594    H    MET  83           H        MET  83  11.552  -0.594  -5.460
  595    HA   MET  83           HA       MET  83  11.707   1.971  -4.140
  596   1HB   MET  83          2HB       MET  83  13.829   0.024  -3.567
  597   2HB   MET  83          1HB       MET  83  12.763   0.889  -2.471
  598   1HG   MET  83          2HG       MET  83  10.982  -0.700  -2.919
  599   2HG   MET  83          1HG       MET  83  12.023  -1.558  -4.056
  600   1HE   MET  83          1HE       MET  83  11.116  -0.480  -0.758
  601   2HE   MET  83          2HE       MET  83  12.480  -0.851   0.296
  602   3HE   MET  83          3HE       MET  83  11.191  -2.035   0.072
  603    H    ASN  84           H        ASN  84  12.578   3.526  -5.338
  604    HA   ASN  84           HA       ASN  84  15.170   2.991  -6.640
  605   1HB   ASN  84          2HB       ASN  84  14.192   5.454  -7.571
  606   2HB   ASN  84          1HB       ASN  84  14.257   3.932  -8.452
  607   1HD2  ASN  84          1HD2      ASN  84  12.411   2.640  -8.568
  608   2HD2  ASN  84          2HD2      ASN  84  10.836   3.274  -8.243
  609    H    SER  85           H        SER  85  16.710   4.814  -6.660
  610    HA   SER  85           HA       SER  85  18.077   6.220  -5.501
  611   1HB   SER  85          2HB       SER  85  15.416   7.400  -5.502
  612   2HB   SER  85          1HB       SER  85  16.362   7.920  -4.107
  613    HG   SER  85           HG       SER  85  18.037   8.483  -5.614
  614    H    LEU  86           H        LEU  86  17.663   3.825  -4.215
  615    HA   LEU  86           HA       LEU  86  16.800   3.994  -1.557
  616   1HB   LEU  86          2HB       LEU  86  18.858   2.186  -2.816
  617   2HB   LEU  86          1HB       LEU  86  18.212   1.970  -1.199
  618    HG   LEU  86           HG       LEU  86  15.954   2.130  -2.819
  619   1HD1  LEU  86          1HD1      LEU  86  16.549   1.551  -4.874
  620   2HD1  LEU  86          2HD1      LEU  86  16.996  -0.029  -4.232
  621   3HD1  LEU  86          3HD1      LEU  86  18.210   1.243  -4.372
  622   1HD2  LEU  86          1HD2      LEU  86  15.471   0.113  -1.889
  623   2HD2  LEU  86          2HD2      LEU  86  16.804   0.582  -0.833
  624   3HD2  LEU  86          3HD2      LEU  86  17.088  -0.532  -2.171
  625    H    LYS  87           H        LYS  87  17.683   4.718   0.249
  626    HA   LYS  87           HA       LYS  87  20.526   5.461   0.266
  627   1HB   LYS  87          2HB       LYS  87  19.935   7.515   1.521
  628   2HB   LYS  87          1HB       LYS  87  19.274   7.507  -0.109
  629   1HG   LYS  87          2HG       LYS  87  17.107   6.729   0.855
  630   2HG   LYS  87          1HG       LYS  87  17.801   6.978   2.459
  631   1HD   LYS  87          2HD       LYS  87  16.687   8.972   2.094
  632   2HD   LYS  87          1HD       LYS  87  18.328   9.364   1.572
  633   1HE   LYS  87          2HE       LYS  87  17.656   8.870  -0.758
  634   2HE   LYS  87          1HE       LYS  87  16.007   8.599  -0.198
  635   1HZ   LYS  87          1HZ       LYS  87  15.710  10.759  -0.557
  636   2HZ   LYS  87          2HZ       LYS  87  17.366  11.061  -0.721
  637   3HZ   LYS  87          3HZ       LYS  87  16.659  11.043   0.816
  638    H    SER  88           H        SER  88  20.649   6.445   2.847
  639    HA   SER  88           HA       SER  88  20.798   4.090   4.376
  640   1HB   SER  88          2HB       SER  88  22.007   6.384   4.683
  641   2HB   SER  88          1HB       SER  88  20.591   6.805   5.648
  642    HG   SER  88           HG       SER  88  22.100   4.452   6.096
  643    H    GLU  89           H        GLU  89  18.191   6.114   3.620
  644    HA   GLU  89           HA       GLU  89  16.619   5.556   5.973
  645   1HB   GLU  89          2HB       GLU  89  16.214   7.661   4.979
  646   2HB   GLU  89          1HB       GLU  89  16.076   6.967   3.371
  647   1HG   GLU  89          2HG       GLU  89  13.891   7.482   3.956
  648   2HG   GLU  89          1HG       GLU  89  14.018   5.750   4.260
  649    H    ASP  90           H        ASP  90  16.770   4.446   2.620
  650    HA   ASP  90           HA       ASP  90  14.467   2.926   2.481
  651   1HB   ASP  90          2HB       ASP  90  16.783   3.255   0.924
  652   2HB   ASP  90          1HB       ASP  90  16.647   1.524   1.212
  653    H    THR  91           H        THR  91  17.429   2.290   4.188
  654    HA   THR  91           HA       THR  91  17.132  -0.489   4.577
  655    HB   THR  91           HB       THR  91  18.509   1.561   6.326
  656    HG1  THR  91           1HG      THR  91  19.476   1.426   4.300
  657   1HG2  THR  91          1HG2      THR  91  18.540  -0.139   7.812
  658   2HG2  THR  91          2HG2      THR  91  19.812  -0.778   6.770
  659   3HG2  THR  91          3HG2      THR  91  18.153  -1.349   6.590
  660    H    ALA  92           H        ALA  92  14.988  -0.935   5.108
  661    HA   ALA  92           HA       ALA  92  14.355  -0.871   7.877
  662   1HB   ALA  92          1HB       ALA  92  13.814   1.453   7.384
  663   2HB   ALA  92          2HB       ALA  92  12.354   0.541   7.765
  664   3HB   ALA  92          3HB       ALA  92  12.732   0.938   6.089
  665    H    VAL  93           H        VAL  93  11.843  -1.437   8.088
  666    HA   VAL  93           HA       VAL  93  11.447  -3.745   6.327
  667    HB   VAL  93           HB       VAL  93   9.991  -3.065   8.890
  668   1HG1  VAL  93          1HG1      VAL  93  10.062  -5.500   7.127
  669   2HG1  VAL  93          2HG1      VAL  93   8.663  -4.545   7.621
  670   3HG1  VAL  93          3HG1      VAL  93   9.504  -5.553   8.800
  671   1HG2  VAL  93          1HG2      VAL  93  11.428  -4.846   9.887
  672   2HG2  VAL  93          2HG2      VAL  93  12.310  -3.393   9.418
  673   3HG2  VAL  93          3HG2      VAL  93  12.386  -4.835   8.407
  674    H    TYR  94           H        TYR  94   9.500  -4.074   5.191
  675    HA   TYR  94           HA       TYR  94   7.761  -1.703   5.051
  676   1HB   TYR  94          2HB       TYR  94   8.706  -3.478   2.800
  677   2HB   TYR  94          1HB       TYR  94   7.443  -2.262   2.627
  678    HD1  TYR  94           1HD      TYR  94   8.040  -0.106   1.987
  679    HD2  TYR  94           2HD      TYR  94  10.978  -2.608   3.778
  680    HE1  TYR  94           1HE      TYR  94   9.746   1.622   1.592
  681    HE2  TYR  94           2HE      TYR  94  12.689  -0.889   3.391
  682    HH   TYR  94           HH       TYR  94  13.072   1.022   1.899
  683    H    TYR  95           H        TYR  95   5.580  -1.982   4.702
  684    HA   TYR  95           HA       TYR  95   4.508  -4.713   4.907
  685   1HB   TYR  95          2HB       TYR  95   3.489  -2.351   6.505
  686   2HB   TYR  95          1HB       TYR  95   2.934  -4.020   6.612
  687    HD1  TYR  95           1HD      TYR  95   5.674  -1.721   7.348
  688    HD2  TYR  95           2HD      TYR  95   4.152  -5.638   7.946
  689    HE1  TYR  95           1HE      TYR  95   7.313  -2.069   9.132
  690    HE2  TYR  95           2HE      TYR  95   5.793  -6.010   9.740
  691    HH   TYR  95           HH       TYR  95   7.622  -5.200  10.762
  692    H    CYS  96           H        CYS  96   2.094  -4.724   4.471
  693    HA   CYS  96           HA       CYS  96   1.280  -2.552   2.688
  694   1HB   CYS  96          2HB       CYS  96   0.326  -4.349   1.134
  695   2HB   CYS  96          1HB       CYS  96   2.071  -4.123   1.103
  696    H    ALA  97           H        ALA  97  -0.888  -2.110   2.681
  697    HA   ALA  97           HA       ALA  97  -2.829  -3.895   3.788
  698   1HB   ALA  97          1HB       ALA  97  -2.472  -3.393   5.934
  699   2HB   ALA  97          2HB       ALA  97  -3.299  -1.881   5.560
  700   3HB   ALA  97          3HB       ALA  97  -1.535  -1.951   5.542
  701    H    LYS  98           H        LYS  98  -4.975  -2.863   4.003
  702    HA   LYS  98           HA       LYS  98  -5.431  -1.108   1.742
  703   1HB   LYS  98          2HB       LYS  98  -7.082  -2.679   1.667
  704   2HB   LYS  98          1HB       LYS  98  -7.052  -2.948   3.402
  705   1HG   LYS  98          2HG       LYS  98  -8.090  -0.396   3.148
  706   2HG   LYS  98          1HG       LYS  98  -8.811  -1.292   1.809
  707   1HD   LYS  98          2HD       LYS  98 -10.184  -2.358   3.199
  708   2HD   LYS  98          1HD       LYS  98  -8.825  -2.894   4.191
  709   1HE   LYS  98          2HE       LYS  98  -9.584  -1.558   5.798
  710   2HE   LYS  98          1HE       LYS  98  -9.117  -0.192   4.786
  711   1HZ   LYS  98          1HZ       LYS  98 -11.768  -1.369   5.213
  712   2HZ   LYS  98          2HZ       LYS  98 -11.440  -0.655   3.714
  713   3HZ   LYS  98          3HZ       LYS  98 -11.312   0.259   5.132
  714    H    TYR  99           H        TYR  99  -6.579   0.876   1.883
  715    HA   TYR  99           HA       TYR  99  -5.942   2.373   4.274
  716   1HB   TYR  99          2HB       TYR  99  -6.249   2.978   1.524
  717   2HB   TYR  99          1HB       TYR  99  -7.464   3.909   2.392
  718    HD1  TYR  99           1HD      TYR  99  -3.835   3.047   2.672
  719    HD2  TYR  99           2HD      TYR  99  -6.861   5.997   3.153
  720    HE1  TYR  99           1HE      TYR  99  -2.120   4.696   3.298
  721    HE2  TYR  99           2HE      TYR  99  -5.157   7.654   3.779
  722    HH   TYR  99           HH       TYR  99  -2.551   7.898   3.268
  723    H    SER 100           H        SER 100  -7.267   2.374   5.943
  724    HA   SER 100           HA       SER 100 -10.108   1.873   5.599
  725   1HB   SER 100          2HB       SER 100  -8.178   1.782   7.834
  726   2HB   SER 100          1HB       SER 100  -9.804   2.312   8.266
  727    HG   SER 100           HG       SER 100  -8.950  -0.148   7.211
  728    H    GLY 101           H        GLY 101  -8.437   4.478   5.034
  729   1HA   GLY 101          2HA       GLY 101  -9.878   6.498   4.728
  730   2HA   GLY 101          1HA       GLY 101 -10.305   6.297   6.420
  731    H    GLY 102           H        GLY 102  -8.196   6.068   7.842
  732   1HA   GLY 102          2HA       GLY 102  -6.317   8.169   6.970
  733   2HA   GLY 102          1HA       GLY 102  -7.004   8.170   8.588
  734    H    ALA 103           H        ALA 103  -4.335   7.427   6.868
  735    HA   ALA 103           HA       ALA 103  -2.392   6.346   7.350
  736   1HB   ALA 103          1HB       ALA 103  -2.017   6.858   9.492
  737   2HB   ALA 103          2HB       ALA 103  -2.584   5.226   9.845
  738   3HB   ALA 103          3HB       ALA 103  -3.699   6.588   9.947
  739    H    LEU 104           H        LEU 104  -1.469   4.179   7.613
  740    HA   LEU 104           HA       LEU 104  -3.414   2.161   6.776
  741   1HB   LEU 104          2HB       LEU 104  -1.163   2.818   5.556
  742   2HB   LEU 104          1HB       LEU 104  -0.477   1.669   6.689
  743    HG   LEU 104           HG       LEU 104  -1.944  -0.089   5.834
  744   1HD1  LEU 104          1HD1      LEU 104  -3.130   0.531   3.620
  745   2HD1  LEU 104          2HD1      LEU 104  -3.076   2.172   4.259
  746   3HD1  LEU 104          3HD1      LEU 104  -3.906   0.902   5.159
  747   1HD2  LEU 104          1HD2      LEU 104  -1.134   0.293   3.271
  748   2HD2  LEU 104          2HD2      LEU 104  -0.126  -0.365   4.560
  749   3HD2  LEU 104          3HD2      LEU 104  -0.028   1.348   4.151
  750    H    ASP 105           H        ASP 105  -3.264  -0.013   7.567
  751    HA   ASP 105           HA       ASP 105  -2.600  -0.074  10.416
  752   1HB   ASP 105          2HB       ASP 105  -4.877  -0.807   9.222
  753   2HB   ASP 105          1HB       ASP 105  -4.016  -2.337   9.098
  754    H    ALA 106           H        ALA 106  -1.790  -1.559   7.371
  755    HA   ALA 106           HA       ALA 106  -0.105  -2.934   6.717
  756   1HB   ALA 106          1HB       ALA 106   1.480  -3.087   9.098
  757   2HB   ALA 106          2HB       ALA 106   0.957  -1.425   8.825
  758   3HB   ALA 106          3HB       ALA 106   1.837  -2.291   7.566
  759    H    TRP 107           H        TRP 107  -0.774  -4.963   6.433
  760    HA   TRP 107           HA       TRP 107  -0.879  -6.722   8.786
  761   1HB   TRP 107          2HB       TRP 107  -2.602  -7.214   6.382
  762   2HB   TRP 107          1HB       TRP 107  -2.795  -7.831   8.018
  763    HD1  TRP 107           HD       TRP 107  -3.044  -5.392   9.783
  764    HE1  TRP 107           1HE      TRP 107  -4.933  -3.666   9.502
  765    HE3  TRP 107           3HE      TRP 107  -4.266  -6.336   4.922
  766    HZ2  TRP 107           2HZ      TRP 107  -6.706  -2.815   7.471
  767    HZ3  TRP 107           3HZ      TRP 107  -6.068  -5.026   3.879
  768    HH2  TRP 107           HH       TRP 107  -7.258  -3.303   5.128
  769    H    GLY 108           H        GLY 108   0.481  -6.076   5.839
  770   1HA   GLY 108          2HA       GLY 108   0.982  -8.768   4.971
  771   2HA   GLY 108          1HA       GLY 108   1.714  -7.311   4.315
  772    H    GLN 109           H        GLN 109   2.918  -9.917   5.033
  773    HA   GLN 109           HA       GLN 109   4.368  -9.880   7.381
  774   1HB   GLN 109          2HB       GLN 109   4.857 -11.045   4.677
  775   2HB   GLN 109          1HB       GLN 109   6.180 -11.039   5.836
  776   1HG   GLN 109          2HG       GLN 109   3.615 -12.023   6.874
  777   2HG   GLN 109          1HG       GLN 109   4.351 -13.010   5.612
  778   1HE2  GLN 109          1HE2      GLN 109   4.234 -14.389   7.704
  779   2HE2  GLN 109          2HE2      GLN 109   5.688 -14.421   8.636
  780    H    GLY 110           H        GLY 110   6.046  -8.754   8.138
  781   1HA   GLY 110          2HA       GLY 110   6.863  -6.390   6.781
  782   2HA   GLY 110          1HA       GLY 110   7.515  -6.988   8.298
  783    H    THR 111           H        THR 111   7.933  -6.743   4.903
  784    HA   THR 111           HA       THR 111  10.004  -8.679   4.615
  785    HB   THR 111           HB       THR 111   8.762  -7.983   2.660
  786    HG1  THR 111           1HG      THR 111  11.101  -6.821   1.885
  787   1HG2  THR 111          1HG2      THR 111   9.701  -5.259   3.463
  788   2HG2  THR 111          2HG2      THR 111   8.098  -5.787   2.948
  789   3HG2  THR 111          3HG2      THR 111   9.392  -5.609   1.762
  790    H    GLN 112           H        GLN 112  12.179  -8.476   4.773
  791    HA   GLN 112           HA       GLN 112  13.165  -6.105   6.134
  792   1HB   GLN 112          2HB       GLN 112  13.732  -8.293   7.050
  793   2HB   GLN 112          1HB       GLN 112  14.501  -8.747   5.535
  794   1HG   GLN 112          2HG       GLN 112  16.307  -8.164   6.822
  795   2HG   GLN 112          1HG       GLN 112  15.982  -6.659   5.963
  796   1HE2  GLN 112          1HE2      GLN 112  14.800  -5.004   7.089
  797   2HE2  GLN 112          2HE2      GLN 112  14.909  -4.890   8.810
  798    H    VAL 113           H        VAL 113  13.602  -4.473   4.778
  799    HA   VAL 113           HA       VAL 113  15.220  -5.027   2.375
  800    HB   VAL 113           HB       VAL 113  13.535  -2.609   3.058
  801   1HG1  VAL 113          1HG1      VAL 113  15.580  -3.090   0.983
  802   2HG1  VAL 113          2HG1      VAL 113  15.058  -1.583   1.738
  803   3HG1  VAL 113          3HG1      VAL 113  14.092  -2.307   0.452
  804   1HG2  VAL 113          1HG2      VAL 113  11.877  -3.450   1.783
  805   2HG2  VAL 113          2HG2      VAL 113  12.636  -4.995   2.174
  806   3HG2  VAL 113          3HG2      VAL 113  12.991  -4.199   0.639
  807    H    THR 114           H        THR 114  17.309  -4.333   2.328
  808    HA   THR 114           HA       THR 114  18.089  -2.272   4.282
  809    HB   THR 114           HB       THR 114  19.949  -4.548   3.736
  810    HG1  THR 114           1HG      THR 114  19.023  -5.423   5.775
  811   1HG2  THR 114          1HG2      THR 114  20.097  -2.192   5.199
  812   2HG2  THR 114          2HG2      THR 114  21.199  -3.567   5.304
  813   3HG2  THR 114          3HG2      THR 114  19.831  -3.447   6.411
  814    H    VAL 115           H        VAL 115  20.181  -1.291   3.885
  815    HA   VAL 115           HA       VAL 115  20.985  -1.271   1.054
  816    HB   VAL 115           HB       VAL 115  20.899   1.230   2.718
  817   1HG1  VAL 115          1HG1      VAL 115  21.167   2.383   0.712
  818   2HG1  VAL 115          2HG1      VAL 115  20.673   0.997  -0.261
  819   3HG1  VAL 115          3HG1      VAL 115  22.240   0.993   0.551
  820   1HG2  VAL 115          1HG2      VAL 115  18.737   1.759   2.024
  821   2HG2  VAL 115          2HG2      VAL 115  18.627   0.059   2.486
  822   3HG2  VAL 115          3HG2      VAL 115  18.728   0.508   0.781
  823    H    SER 116           H        SER 116  23.003  -2.070   1.093
  824    HA   SER 116           HA       SER 116  24.905  -0.916   3.017
  825   1HB   SER 116          2HB       SER 116  24.246  -3.286   3.586
  826   2HB   SER 116          1HB       SER 116  24.991  -3.785   2.067
  827    HG   SER 116           HG       SER 116  26.800  -3.788   3.115
  828    H    SER 117           H        SER 117  27.046  -0.665   2.288
  829    HA   SER 117           HA       SER 117  27.266  -0.151  -0.529
  830   1HB   SER 117          2HB       SER 117  28.532   0.791   1.797
  831   2HB   SER 117          1HB       SER 117  29.795  -0.016   0.866
  832    HG   SER 117           HG       SER 117  28.079   2.068   0.000
  833    H    GLN 118           H        GLN 118  27.664  -1.699  -1.953
  834    HA   GLN 118           HA       GLN 118  29.107  -4.100  -1.142
  835   1HB   GLN 118          2HB       GLN 118  27.373  -3.359  -3.466
  836   2HB   GLN 118          1HB       GLN 118  28.495  -4.703  -3.627
  837   1HG   GLN 118          2HG       GLN 118  26.978  -4.871  -1.172
  838   2HG   GLN 118          1HG       GLN 118  25.930  -4.787  -2.587
  839   1HE2  GLN 118          1HE2      GLN 118  26.372  -6.322  -4.326
  840   2HE2  GLN 118          2HE2      GLN 118  26.960  -7.894  -3.918
  841    H    SER 119           H        SER 119  30.220  -1.275  -1.822
  842    HA   SER 119           HA       SER 119  31.900  -1.707  -4.100
  843   1HB   SER 119          2HB       SER 119  33.045   0.346  -2.586
  844   2HB   SER 119          1HB       SER 119  31.921   0.530  -3.931
  845    HG   SER 119           HG       SER 119  31.359   1.513  -1.800
  846    H    GLU 120           H        GLU 120  34.040  -2.262  -4.186
  847    HA   GLU 120           HA       GLU 120  35.043  -3.913  -2.101
  848   1HB   GLU 120          2HB       GLU 120  35.491  -4.145  -4.592
  849   2HB   GLU 120          1HB       GLU 120  36.627  -2.814  -4.420
  850   1HG   GLU 120          2HG       GLU 120  38.063  -4.065  -3.057
  851   2HG   GLU 120          1HG       GLU 120  36.834  -5.292  -2.747
  852    H    GLN 121           H        GLN 121  35.336  -0.564  -2.850
  853    HA   GLN 121           HA       GLN 121  37.786  -0.049  -1.510
  854   1HB   GLN 121          2HB       GLN 121  36.877   1.490  -3.174
  855   2HB   GLN 121          1HB       GLN 121  35.480   1.798  -2.153
  856   1HG   GLN 121          2HG       GLN 121  37.381   2.487  -0.432
  857   2HG   GLN 121          1HG       GLN 121  38.257   2.794  -1.930
  858   1HE2  GLN 121          1HE2      GLN 121  37.855   4.609  -3.024
  859   2HE2  GLN 121          2HE2      GLN 121  36.615   5.748  -2.638
  860    H    LYS 122           H        LYS 122  37.962  -0.685   0.562
  861    HA   LYS 122           HA       LYS 122  35.811   0.020   2.437
  862   1HB   LYS 122          2HB       LYS 122  38.082  -1.962   2.650
  863   2HB   LYS 122          1HB       LYS 122  37.016  -1.560   3.989
  864   1HG   LYS 122          2HG       LYS 122  35.258  -2.188   1.975
  865   2HG   LYS 122          1HG       LYS 122  36.582  -3.325   1.720
  866   1HD   LYS 122          2HD       LYS 122  35.926  -3.097   4.524
  867   2HD   LYS 122          1HD       LYS 122  34.508  -3.544   3.573
  868   1HE   LYS 122          2HE       LYS 122  37.176  -4.939   3.406
  869   2HE   LYS 122          1HE       LYS 122  35.835  -5.482   4.414
  870   1HZ   LYS 122          1HZ       LYS 122  36.190  -5.672   1.544
  871   2HZ   LYS 122          2HZ       LYS 122  34.634  -5.237   2.045
  872   3HZ   LYS 122          3HZ       LYS 122  35.328  -6.677   2.600
  873    H    LEU 123           H        LEU 123  39.332  -0.364   2.789
  874    HA   LEU 123           HA       LEU 123  40.907   0.890   3.840
  875   1HB   LEU 123          2HB       LEU 123  39.445   2.624   2.143
  876   2HB   LEU 123          1HB       LEU 123  39.767   3.504   3.626
  877    HG   LEU 123           HG       LEU 123  42.216   2.733   3.297
  878   1HD1  LEU 123          1HD1      LEU 123  41.399   1.175   1.390
  879   2HD1  LEU 123          2HD1      LEU 123  42.917   2.054   1.205
  880   3HD1  LEU 123          3HD1      LEU 123  41.456   2.640   0.410
  881   1HD2  LEU 123          1HD2      LEU 123  42.672   4.670   1.878
  882   2HD2  LEU 123          2HD2      LEU 123  41.460   5.046   3.103
  883   3HD2  LEU 123          3HD2      LEU 123  40.966   4.752   1.436
  884    H    ILE 124           H        ILE 124  40.575   0.160   5.930
  885    HA   ILE 124           HA       ILE 124  39.065   2.000   7.668
  886    HB   ILE 124           HB       ILE 124  37.840  -0.070   7.582
  887   1HG1  ILE 124          2HG1      ILE 124  38.961  -0.726  10.148
  888   2HG1  ILE 124          1HG1      ILE 124  38.936   1.024   9.947
  889   1HG2  ILE 124          1HG2      ILE 124  38.965  -2.188   8.400
  890   2HG2  ILE 124          2HG2      ILE 124  40.496  -1.350   8.148
  891   3HG2  ILE 124          3HG2      ILE 124  39.410  -1.630   6.787
  892   1HD1  ILE 124          1HD1      ILE 124  36.491  -0.507   9.252
  893   2HD1  ILE 124          2HD1      ILE 124  36.662   1.122   9.906
  894   3HD1  ILE 124          3HD1      ILE 124  36.891  -0.279  10.954
  895    H    SER 125           H        SER 125  40.066   2.706   9.489
  896    HA   SER 125           HA       SER 125  42.603   1.483  10.284
  897   1HB   SER 125          2HB       SER 125  42.555   3.785   8.748
  898   2HB   SER 125          1HB       SER 125  42.718   4.402  10.392
  899    HG   SER 125           HG       SER 125  44.648   3.515  10.554
  900    H    GLU 126           H        GLU 126  40.944   0.777  11.921
  901    HA   GLU 126           HA       GLU 126  41.079   2.585  14.198
  902   1HB   GLU 126          2HB       GLU 126  38.555   1.698  12.879
  903   2HB   GLU 126          1HB       GLU 126  38.579   1.825  14.633
  904   1HG   GLU 126          2HG       GLU 126  39.664   4.193  13.991
  905   2HG   GLU 126          1HG       GLU 126  38.647   3.929  12.574
  906    H    GLU 127           H        GLU 127  41.644  -0.335  12.957
  907    HA   GLU 127           HA       GLU 127  42.073  -2.408  13.780
  908   1HB   GLU 127          2HB       GLU 127  42.881  -0.569  15.747
  909   2HB   GLU 127          1HB       GLU 127  42.035  -1.847  16.609
  910   1HG   GLU 127          2HG       GLU 127  44.358  -2.208  14.729
  911   2HG   GLU 127          1HG       GLU 127  44.409  -2.308  16.489
  912    H    ASP 128           H        ASP 128  40.250  -3.545  13.327
  913    HA   ASP 128           HA       ASP 128  38.117  -3.550  15.355
  914   1HB   ASP 128          2HB       ASP 128  37.855  -3.127  12.686
  915   2HB   ASP 128          1HB       ASP 128  37.617  -4.870  12.759
  916    H    LEU 129           H        LEU 129  39.063  -5.013  16.770
  917    HA   LEU 129           HA       LEU 129  39.473  -7.047  17.686
  918   1HB   LEU 129          2HB       LEU 129  37.990  -8.021  15.245
  919   2HB   LEU 129          1HB       LEU 129  38.443  -9.038  16.599
  920    HG   LEU 129           HG       LEU 129  36.791  -6.604  17.116
  921   1HD1  LEU 129          1HD1      LEU 129  35.910  -8.132  15.160
  922   2HD1  LEU 129          2HD1      LEU 129  34.822  -7.507  16.398
  923   3HD1  LEU 129          3HD1      LEU 129  35.414  -9.165  16.500
  924   1HD2  LEU 129          1HD2      LEU 129  36.720  -7.488  19.147
  925   2HD2  LEU 129          2HD2      LEU 129  37.754  -8.808  18.603
  926   3HD2  LEU 129          3HD2      LEU 129  36.000  -8.962  18.501
  927    H    ASN 130           H        ASN 130  39.639  -8.196  14.344
  928    HA   ASN 130           HA       ASN 130  41.315  -9.124  13.125
  929   1HB   ASN 130          2HB       ASN 130  42.260  -6.736  13.726
  930   2HB   ASN 130          1HB       ASN 130  43.390  -7.662  14.709
  931   1HD2  ASN 130          1HD2      ASN 130  42.269  -7.010  11.476
  932   2HD2  ASN 130          2HD2      ASN 130  43.634  -7.679  10.655
  933    H    HIS 131           H        HIS 131  40.617 -11.033  14.481
  934    HA   HIS 131           HA       HIS 131  43.006 -12.218  15.669
  935   1HB   HIS 131          2HB       HIS 131  40.973 -11.237  17.285
  936   2HB   HIS 131          1HB       HIS 131  40.613 -12.957  17.167
  937    HD1  HIS 131           1HD      HIS 131  43.369 -14.189  17.267
  938    HD2  HIS 131           2HD      HIS 131  42.225 -11.000  19.674
  939    HE1  HIS 131           1HE      HIS 131  44.919 -14.251  19.246
  940    HE2  HIS 131           2HE      HIS 131  44.251 -12.273  20.658
  941    H    HIS 132           H        HIS 132  43.173 -13.568  13.890
  942    HA   HIS 132           HA       HIS 132  40.910 -15.280  13.210
  943   1HB   HIS 132          2HB       HIS 132  43.636 -15.011  11.926
  944   2HB   HIS 132          1HB       HIS 132  42.327 -16.024  11.325
  945    HD1  HIS 132           1HD      HIS 132  40.648 -14.936   9.820
  946    HD2  HIS 132           2HD      HIS 132  43.059 -12.172  11.775
  947    HE1  HIS 132           1HE      HIS 132  40.096 -12.711   8.784
  948    HE2  HIS 132           2HE      HIS 132  41.603 -11.061   9.947
  949    H    HIS 133           H        HIS 133  44.323 -15.618  14.165
  950    HA   HIS 133           HA       HIS 133  44.171 -18.447  14.474
  951   1HB   HIS 133          2HB       HIS 133  46.364 -18.038  15.789
  952   2HB   HIS 133          1HB       HIS 133  46.338 -17.666  14.068
  953    HD1  HIS 133           1HD      HIS 133  45.074 -15.470  16.891
  954    HD2  HIS 133           2HD      HIS 133  48.033 -15.534  13.974
  955    HE1  HIS 133           1HE      HIS 133  46.173 -13.211  16.999
  956    HE2  HIS 133           2HE      HIS 133  48.022 -13.307  15.289
  957    H    HIS 134           H        HIS 134  45.065 -19.290  16.752
  958    HA   HIS 134           HA       HIS 134  42.981 -18.568  18.653
  959   1HB   HIS 134          2HB       HIS 134  44.923 -20.860  18.453
  960   2HB   HIS 134          1HB       HIS 134  43.997 -20.570  19.922
  961    HD1  HIS 134           1HD      HIS 134  41.339 -20.717  19.652
  962    HD2  HIS 134           2HD      HIS 134  43.574 -22.179  16.469
  963    HE1  HIS 134           1HE      HIS 134  39.750 -22.126  18.304
  964    HE2  HIS 134           2HE      HIS 134  41.104 -22.929  16.337
  965    H    HIS 135           H        HIS 135  44.093 -19.170  21.059
  966    HA   HIS 135           HA       HIS 135  45.669 -16.813  21.568
  967   1HB   HIS 135          2HB       HIS 135  44.758 -18.980  23.472
  968   2HB   HIS 135          1HB       HIS 135  45.430 -17.418  23.930
  969    HD1  HIS 135           1HD      HIS 135  42.563 -18.450  21.630
  970    HD2  HIS 135           2HD      HIS 135  43.410 -15.837  24.749
  971    HE1  HIS 135           1HE      HIS 135  40.436 -17.168  22.030
  972    HE2  HIS 135           2HE      HIS 135  40.949 -15.649  23.974
  Start of MODEL    7
    1   1H    ASP   1          1HT       ASP   1 -10.333  -7.369  10.150
    2   2H    ASP   1          2HT       ASP   1  -9.509  -8.803   9.798
    3   3H    ASP   1          3HT       ASP   1 -10.947  -8.851  10.687
    4    HA   ASP   1           HA       ASP   1 -12.146  -9.032   8.867
    5   1HB   ASP   1          2HB       ASP   1 -10.666  -6.497   8.178
    6   2HB   ASP   1          1HB       ASP   1 -11.861  -7.190   7.086
    7    H    VAL   2           H        VAL   2  -9.321  -7.698   7.181
    8    HA   VAL   2           HA       VAL   2  -8.967 -10.318   5.881
    9    HB   VAL   2           HB       VAL   2  -8.913  -9.431   3.806
   10   1HG1  VAL   2          1HG1      VAL   2 -10.791  -8.128   5.386
   11   2HG1  VAL   2          2HG1      VAL   2 -10.785  -8.248   3.626
   12   3HG1  VAL   2          3HG1      VAL   2 -10.056  -6.849   4.417
   13   1HG2  VAL   2          1HG2      VAL   2  -6.955  -8.241   3.721
   14   2HG2  VAL   2          2HG2      VAL   2  -7.398  -7.200   5.073
   15   3HG2  VAL   2          3HG2      VAL   2  -8.124  -6.942   3.488
   16    H    GLN   3           H        GLN   3  -6.847 -10.917   5.290
   17    HA   GLN   3           HA       GLN   3  -4.692  -9.317   6.485
   18   1HB   GLN   3          2HB       GLN   3  -5.415 -11.323   7.904
   19   2HB   GLN   3          1HB       GLN   3  -4.731 -12.325   6.630
   20   1HG   GLN   3          2HG       GLN   3  -2.788 -10.396   7.253
   21   2HG   GLN   3          1HG       GLN   3  -3.415 -10.995   8.788
   22   1HE2  GLN   3          1HE2      GLN   3  -0.921 -11.390   6.935
   23   2HE2  GLN   3          2HE2      GLN   3  -0.657 -13.094   7.035
   24    H    LEU   4           H        LEU   4  -2.787  -9.274   5.373
   25    HA   LEU   4           HA       LEU   4  -2.702 -10.807   2.855
   26   1HB   LEU   4          2HB       LEU   4  -1.198  -8.356   2.704
   27   2HB   LEU   4          1HB       LEU   4  -2.469  -8.949   1.653
   28    HG   LEU   4           HG       LEU   4  -3.135  -7.636   4.267
   29   1HD1  LEU   4          1HD1      LEU   4  -3.524  -5.648   2.500
   30   2HD1  LEU   4          2HD1      LEU   4  -2.074  -6.388   1.822
   31   3HD1  LEU   4          3HD1      LEU   4  -2.072  -5.814   3.489
   32   1HD2  LEU   4          1HD2      LEU   4  -4.561  -8.529   1.854
   33   2HD2  LEU   4          2HD2      LEU   4  -5.047  -6.954   2.483
   34   3HD2  LEU   4          3HD2      LEU   4  -5.122  -8.379   3.521
   35    H    GLN   5           H        GLN   5  -0.265 -10.312   1.928
   36    HA   GLN   5           HA       GLN   5   1.721 -10.583   4.019
   37   1HB   GLN   5          2HB       GLN   5   1.025 -12.868   3.882
   38   2HB   GLN   5          1HB       GLN   5   1.047 -12.833   2.125
   39   1HG   GLN   5          2HG       GLN   5   3.622 -12.155   2.776
   40   2HG   GLN   5          1HG       GLN   5   3.197 -13.335   4.015
   41   1HE2  GLN   5          1HE2      GLN   5   1.713 -15.146   2.853
   42   2HE2  GLN   5          2HE2      GLN   5   2.510 -15.892   1.515
   43    H    ALA   6           H        ALA   6   3.754  -9.992   3.360
   44    HA   ALA   6           HA       ALA   6   4.079  -9.374   0.501
   45   1HB   ALA   6          1HB       ALA   6   4.834  -7.264   0.892
   46   2HB   ALA   6          2HB       ALA   6   5.466  -7.667   2.488
   47   3HB   ALA   6          3HB       ALA   6   3.733  -7.431   2.259
   48    H    SER   7           H        SER   7   6.370  -9.102  -0.170
   49    HA   SER   7           HA       SER   7   8.530 -10.077   1.335
   50   1HB   SER   7          2HB       SER   7   7.257 -12.220   1.140
   51   2HB   SER   7          1HB       SER   7   7.412 -12.107  -0.613
   52    HG   SER   7           HG       SER   7   9.820 -11.792   0.504
   53    H    GLY   8           H        GLY   8  10.441 -10.631  -0.129
   54   1HA   GLY   8          2HA       GLY   8  11.280 -10.481  -2.444
   55   2HA   GLY   8          1HA       GLY   8  10.226  -9.090  -2.642
   56    H    GLY   9           H        GLY   9  11.714  -9.238   0.410
   57   1HA   GLY   9          2HA       GLY   9  13.129  -6.822   0.005
   58   2HA   GLY   9          1HA       GLY   9  13.263  -7.870   1.409
   59    H    GLY  10           H        GLY  10  15.277  -6.373  -0.228
   60   1HA   GLY  10          2HA       GLY  10  17.163  -8.595  -0.451
   61   2HA   GLY  10          1HA       GLY  10  16.916  -7.606  -1.883
   62    H    LEU  11           H        LEU  11  19.402  -7.662  -1.106
   63    HA   LEU  11           HA       LEU  11  19.839  -5.272   0.553
   64   1HB   LEU  11          2HB       LEU  11  21.324  -7.796   0.171
   65   2HB   LEU  11          1HB       LEU  11  22.306  -6.348   0.297
   66    HG   LEU  11           HG       LEU  11  20.582  -6.049   2.408
   67   1HD1  LEU  11          1HD1      LEU  11  20.910  -8.934   1.809
   68   2HD1  LEU  11          2HD1      LEU  11  19.566  -8.076   2.565
   69   3HD1  LEU  11          3HD1      LEU  11  21.025  -8.422   3.493
   70   1HD2  LEU  11          1HD2      LEU  11  23.335  -6.431   1.946
   71   2HD2  LEU  11          2HD2      LEU  11  22.882  -7.503   3.271
   72   3HD2  LEU  11          3HD2      LEU  11  22.552  -5.774   3.384
   73    H    VAL  12           H        VAL  12  19.949  -3.533  -0.715
   74    HA   VAL  12           HA       VAL  12  21.530  -3.714  -3.196
   75    HB   VAL  12           HB       VAL  12  20.260  -1.971  -4.147
   76   1HG1  VAL  12          1HG1      VAL  12  19.125  -4.244  -3.831
   77   2HG1  VAL  12          2HG1      VAL  12  18.110  -2.874  -4.280
   78   3HG1  VAL  12          3HG1      VAL  12  18.143  -3.437  -2.608
   79   1HG2  VAL  12          1HG2      VAL  12  18.338  -1.251  -2.202
   80   2HG2  VAL  12          2HG2      VAL  12  19.591  -0.241  -2.928
   81   3HG2  VAL  12          3HG2      VAL  12  19.926  -1.130  -1.443
   82    H    GLN  13           H        GLN  13  22.244  -1.286  -3.778
   83    HA   GLN  13           HA       GLN  13  23.711  -0.305  -1.420
   84   1HB   GLN  13          2HB       GLN  13  24.711   0.410  -4.109
   85   2HB   GLN  13          1HB       GLN  13  25.597  -0.054  -2.663
   86   1HG   GLN  13          2HG       GLN  13  25.989  -1.993  -3.657
   87   2HG   GLN  13          1HG       GLN  13  24.286  -2.371  -3.408
   88   1HE2  GLN  13          1HE2      GLN  13  25.681   0.025  -5.582
   89   2HE2  GLN  13          2HE2      GLN  13  25.117  -0.704  -7.043
   90    HA   PRO  14           HA       PRO  14  21.823   3.667  -1.706
   91   1HB   PRO  14          2HB       PRO  14  24.529   4.899  -1.753
   92   2HB   PRO  14          1HB       PRO  14  23.188   5.169  -0.633
   93   1HG   PRO  14          2HG       PRO  14  25.311   3.761   0.128
   94   2HG   PRO  14          1HG       PRO  14  23.676   3.272   0.617
   95   1HD   PRO  14          2HD       PRO  14  25.434   2.136  -1.527
   96   2HD   PRO  14          1HD       PRO  14  24.386   1.294  -0.365
   97    H    GLY  15           H        GLY  15  21.177   3.202  -3.937
   98   1HA   GLY  15          2HA       GLY  15  21.280   5.129  -5.735
   99   2HA   GLY  15          1HA       GLY  15  22.846   4.385  -6.026
  100    H    GLY  16           H        GLY  16  21.571   1.727  -5.255
  101   1HA   GLY  16          2HA       GLY  16  20.939   0.901  -7.910
  102   2HA   GLY  16          1HA       GLY  16  20.843  -0.092  -6.463
  103    H    SER  17           H        SER  17  18.873  -1.016  -6.625
  104    HA   SER  17           HA       SER  17  16.571   0.488  -6.022
  105   1HB   SER  17          2HB       SER  17  15.364   0.556  -8.036
  106   2HB   SER  17          1HB       SER  17  16.990   1.040  -8.514
  107    HG   SER  17           HG       SER  17  15.540  -1.163  -9.230
  108    H    LEU  18           H        LEU  18  15.007  -0.794  -5.225
  109    HA   LEU  18           HA       LEU  18  15.235  -3.692  -5.711
  110   1HB   LEU  18          2HB       LEU  18  15.880  -3.527  -3.492
  111   2HB   LEU  18          1HB       LEU  18  14.832  -2.158  -3.179
  112    HG   LEU  18           HG       LEU  18  13.228  -4.468  -3.802
  113   1HD1  LEU  18          1HD1      LEU  18  14.985  -5.871  -3.052
  114   2HD1  LEU  18          2HD1      LEU  18  13.827  -5.745  -1.727
  115   3HD1  LEU  18          3HD1      LEU  18  15.329  -4.819  -1.680
  116   1HD2  LEU  18          1HD2      LEU  18  12.646  -2.370  -2.527
  117   2HD2  LEU  18          2HD2      LEU  18  13.545  -3.049  -1.172
  118   3HD2  LEU  18          3HD2      LEU  18  12.126  -3.888  -1.797
  119    H    ARG  19           H        ARG  19  13.326  -4.847  -5.946
  120    HA   ARG  19           HA       ARG  19  10.882  -3.220  -6.162
  121   1HB   ARG  19          2HB       ARG  19  11.710  -3.805  -8.388
  122   2HB   ARG  19          1HB       ARG  19  11.750  -5.505  -7.942
  123   1HG   ARG  19          2HG       ARG  19   9.152  -4.783  -7.400
  124   2HG   ARG  19          1HG       ARG  19   9.534  -3.870  -8.862
  125   1HD   ARG  19          2HD       ARG  19   9.750  -6.847  -8.451
  126   2HD   ARG  19          1HD       ARG  19   8.631  -5.993  -9.512
  127    HE   ARG  19           HE       ARG  19  11.311  -6.737 -10.107
  128   1HH1  ARG  19          1HH1      ARG  19   8.923  -4.264 -10.677
  129   2HH1  ARG  19          2HH1      ARG  19   9.596  -3.783 -12.198
  130   1HH2  ARG  19          1HH2      ARG  19  12.202  -6.113 -12.111
  131   2HH2  ARG  19          2HH2      ARG  19  11.459  -4.835 -13.014
  132    H    VAL  20           H        VAL  20   9.654  -3.784  -4.459
  133    HA   VAL  20           HA       VAL  20   9.568  -6.630  -3.747
  134    HB   VAL  20           HB       VAL  20   9.863  -4.507  -2.064
  135   1HG1  VAL  20          1HG1      VAL  20   7.875  -4.446  -0.656
  136   2HG1  VAL  20          2HG1      VAL  20   7.019  -5.370  -1.890
  137   3HG1  VAL  20          3HG1      VAL  20   7.619  -3.751  -2.257
  138   1HG2  VAL  20          1HG2      VAL  20  10.601  -6.371  -1.109
  139   2HG2  VAL  20          2HG2      VAL  20   9.335  -7.353  -1.848
  140   3HG2  VAL  20          3HG2      VAL  20   8.988  -6.419  -0.392
  141    H    SER  21           H        SER  21   7.484  -7.345  -2.837
  142    HA   SER  21           HA       SER  21   5.144  -6.224  -4.194
  143   1HB   SER  21          2HB       SER  21   4.567  -8.660  -4.909
  144   2HB   SER  21          1HB       SER  21   5.708  -7.731  -5.881
  145    HG   SER  21           HG       SER  21   6.731  -9.615  -5.558
  146    H    CYS  22           H        CYS  22   3.098  -7.334  -3.549
  147    HA   CYS  22           HA       CYS  22   3.226  -8.724  -0.994
  148   1HB   CYS  22          2HB       CYS  22   3.088  -6.429  -0.279
  149   2HB   CYS  22          1HB       CYS  22   1.776  -6.112  -1.408
  150    H    ALA  23           H        ALA  23   2.078 -10.493  -1.294
  151    HA   ALA  23           HA       ALA  23  -0.179 -10.463  -3.137
  152   1HB   ALA  23          1HB       ALA  23   1.365 -12.276  -3.430
  153   2HB   ALA  23          2HB       ALA  23  -0.149 -12.932  -2.809
  154   3HB   ALA  23          3HB       ALA  23   1.230 -12.726  -1.730
  155    H    ALA  24           H        ALA  24  -1.997  -9.697  -2.227
  156    HA   ALA  24           HA       ALA  24  -2.631 -10.279   0.545
  157   1HB   ALA  24          1HB       ALA  24  -3.168  -8.084   0.023
  158   2HB   ALA  24          2HB       ALA  24  -4.729  -8.901  -0.079
  159   3HB   ALA  24          3HB       ALA  24  -3.837  -8.515  -1.552
  160    H    SER  25           H        SER  25  -4.973 -10.875   1.019
  161    HA   SER  25           HA       SER  25  -6.204 -12.650  -0.918
  162   1HB   SER  25          2HB       SER  25  -4.528 -14.075   0.252
  163   2HB   SER  25          1HB       SER  25  -5.325 -13.707   1.781
  164    HG   SER  25           HG       SER  25  -6.367 -15.484   1.233
  165    H    GLY  26           H        GLY  26  -8.333 -12.403  -0.816
  166   1HA   GLY  26          2HA       GLY  26 -10.214 -12.624   0.933
  167   2HA   GLY  26          1HA       GLY  26  -9.475 -11.178   1.605
  168    H    PHE  27           H        PHE  27  -9.136  -9.389  -0.113
  169    HA   PHE  27           HA       PHE  27 -11.633  -9.185  -1.657
  170   1HB   PHE  27          2HB       PHE  27 -11.628  -6.834  -1.307
  171   2HB   PHE  27          1HB       PHE  27 -11.273  -7.561   0.253
  172    HD1  PHE  27           1HD      PHE  27  -9.724  -5.852  -2.649
  173    HD2  PHE  27           2HD      PHE  27  -9.322  -7.021   1.425
  174    HE1  PHE  27           1HE      PHE  27  -7.729  -4.433  -2.443
  175    HE2  PHE  27           2HE      PHE  27  -7.322  -5.602   1.637
  176    HZ   PHE  27           HZ       PHE  27  -6.524  -4.310  -0.304
  177    H    THR  28           H        THR  28 -11.288  -7.363  -3.462
  178    HA   THR  28           HA       THR  28  -9.436  -8.511  -5.303
  179    HB   THR  28           HB       THR  28 -10.800  -5.872  -5.755
  180    HG1  THR  28           1HG      THR  28 -11.965  -8.472  -5.846
  181   1HG2  THR  28          1HG2      THR  28 -10.479  -8.135  -7.698
  182   2HG2  THR  28          2HG2      THR  28  -9.149  -7.021  -7.383
  183   3HG2  THR  28          3HG2      THR  28 -10.677  -6.413  -8.020
  184    H    PHE  29           H        PHE  29  -9.336  -5.257  -5.953
  185    HA   PHE  29           HA       PHE  29  -7.245  -4.385  -4.254
  186   1HB   PHE  29          2HB       PHE  29  -6.411  -6.117  -6.307
  187   2HB   PHE  29          1HB       PHE  29  -5.969  -4.498  -6.842
  188    HD1  PHE  29           1HD      PHE  29  -5.505  -7.022  -4.209
  189    HD2  PHE  29           2HD      PHE  29  -4.249  -3.267  -5.763
  190    HE1  PHE  29           1HE      PHE  29  -3.540  -7.073  -2.730
  191    HE2  PHE  29           2HE      PHE  29  -2.282  -3.311  -4.288
  192    HZ   PHE  29           HZ       PHE  29  -1.926  -5.215  -2.767
  193    H    SER  30           H        SER  30  -8.147  -4.082  -7.699
  194    HA   SER  30           HA       SER  30  -7.805  -1.258  -7.737
  195   1HB   SER  30          2HB       SER  30  -7.622  -2.197  -9.858
  196   2HB   SER  30          1HB       SER  30  -8.994  -3.277  -9.611
  197    HG   SER  30           HG       SER  30  -9.522  -1.566 -11.020
  198    H    SER  31           H        SER  31 -10.301  -3.310  -6.646
  199    HA   SER  31           HA       SER  31 -12.437  -1.389  -6.947
  200   1HB   SER  31          2HB       SER  31 -13.308  -3.530  -7.029
  201   2HB   SER  31          1HB       SER  31 -12.183  -4.148  -5.821
  202    HG   SER  31           HG       SER  31 -14.421  -2.464  -5.361
  203    H    TYR  32           H        TYR  32 -10.099  -2.300  -4.554
  204    HA   TYR  32           HA       TYR  32 -11.346  -0.463  -2.616
  205   1HB   TYR  32          2HB       TYR  32  -9.550  -2.857  -2.217
  206   2HB   TYR  32          1HB       TYR  32  -9.861  -1.684  -0.942
  207    HD1  TYR  32           1HD      TYR  32 -11.636  -2.041   0.501
  208    HD2  TYR  32           2HD      TYR  32 -11.686  -3.905  -3.324
  209    HE1  TYR  32           1HE      TYR  32 -13.674  -3.264   1.130
  210    HE2  TYR  32           2HE      TYR  32 -13.726  -5.131  -2.706
  211    HH   TYR  32           HH       TYR  32 -15.482  -5.141  -1.190
  212    H    HIS  33           H        HIS  33  -9.234   0.007  -0.961
  213    HA   HIS  33           HA       HIS  33  -7.376   1.481  -2.704
  214   1HB   HIS  33          2HB       HIS  33  -8.077   2.053   0.185
  215   2HB   HIS  33          1HB       HIS  33  -7.077   3.049  -0.868
  216    HD1  HIS  33           1HD      HIS  33 -10.657   1.750  -0.809
  217    HD2  HIS  33           2HD      HIS  33  -8.462   5.058  -2.032
  218    HE1  HIS  33           1HE      HIS  33 -12.349   3.395  -1.674
  219    HE2  HIS  33           2HE      HIS  33 -10.989   5.347  -2.503
  220    H    MET  34           H        MET  34  -5.144   1.538  -2.134
  221    HA   MET  34           HA       MET  34  -4.259  -0.345  -0.086
  222   1HB   MET  34          2HB       MET  34  -3.985  -0.733  -2.993
  223   2HB   MET  34          1HB       MET  34  -2.508  -0.981  -2.070
  224   1HG   MET  34          2HG       MET  34  -5.025  -2.267  -1.139
  225   2HG   MET  34          1HG       MET  34  -4.173  -2.949  -2.524
  226   1HE   MET  34          1HE       MET  34  -4.557  -4.866  -0.957
  227   2HE   MET  34          2HE       MET  34  -4.341  -4.609   0.776
  228   3HE   MET  34          3HE       MET  34  -3.146  -5.533  -0.136
  229    H    ALA  35           H        ALA  35  -1.894  -0.218   0.290
  230    HA   ALA  35           HA       ALA  35  -0.459   2.054  -0.707
  231   1HB   ALA  35          1HB       ALA  35  -0.336   3.346   1.292
  232   2HB   ALA  35          2HB       ALA  35  -1.235   2.131   2.201
  233   3HB   ALA  35          3HB       ALA  35  -2.042   3.068   0.941
  234    H    TRP  36           H        TRP  36   1.711   2.166   0.059
  235    HA   TRP  36           HA       TRP  36   2.643  -0.346   1.277
  236   1HB   TRP  36          2HB       TRP  36   3.690   1.334  -0.938
  237   2HB   TRP  36          1HB       TRP  36   4.877   0.580   0.125
  238    HD1  TRP  36           HD       TRP  36   2.484  -0.187  -2.669
  239    HE1  TRP  36           1HE      TRP  36   2.637  -2.683  -3.298
  240    HE3  TRP  36           3HE      TRP  36   5.391  -1.774   1.208
  241    HZ2  TRP  36           2HZ      TRP  36   3.900  -5.013  -2.272
  242    HZ3  TRP  36           3HZ      TRP  36   6.038  -4.142   1.313
  243    HH2  TRP  36           HH       TRP  36   5.316  -5.725  -0.397
  244    H    VAL  37           H        VAL  37   3.242  -0.122   3.310
  245    HA   VAL  37           HA       VAL  37   4.221   2.483   4.226
  246    HB   VAL  37           HB       VAL  37   3.711   1.779   6.469
  247   1HG1  VAL  37          1HG1      VAL  37   1.238   0.746   5.397
  248   2HG1  VAL  37          2HG1      VAL  37   1.815   2.138   4.479
  249   3HG1  VAL  37          3HG1      VAL  37   1.563   2.273   6.219
  250   1HG2  VAL  37          1HG2      VAL  37   2.360  -0.690   6.078
  251   2HG2  VAL  37          2HG2      VAL  37   3.768  -0.345   7.090
  252   3HG2  VAL  37          3HG2      VAL  37   3.987  -0.832   5.407
  253    H    ARG  38           H        ARG  38   5.919   2.479   5.882
  254    HA   ARG  38           HA       ARG  38   7.829   0.272   5.653
  255   1HB   ARG  38          2HB       ARG  38   8.664   1.743   4.014
  256   2HB   ARG  38          1HB       ARG  38   8.311   3.165   4.982
  257   1HG   ARG  38          2HG       ARG  38  10.073   1.929   6.594
  258   2HG   ARG  38          1HG       ARG  38  10.644   1.376   5.018
  259   1HD   ARG  38          2HD       ARG  38  11.797   3.403   5.571
  260   2HD   ARG  38          1HD       ARG  38  10.665   3.742   4.261
  261    HE   ARG  38           HE       ARG  38   9.273   4.353   6.523
  262   1HH1  ARG  38          1HH1      ARG  38  12.345   5.344   5.200
  263   2HH1  ARG  38          2HH1      ARG  38  12.289   6.919   5.917
  264   1HH2  ARG  38          1HH2      ARG  38   9.197   6.427   7.471
  265   2HH2  ARG  38          2HH2      ARG  38  10.502   7.534   7.207
  266    H    GLN  39           H        GLN  39   9.228   0.057   7.427
  267    HA   GLN  39           HA       GLN  39   8.799   1.879   9.678
  268   1HB   GLN  39          2HB       GLN  39   7.358  -0.310   9.688
  269   2HB   GLN  39          1HB       GLN  39   8.864  -1.074  10.183
  270   1HG   GLN  39          2HG       GLN  39   8.951   0.147  12.179
  271   2HG   GLN  39          1HG       GLN  39   7.765   1.320  11.618
  272   1HE2  GLN  39          1HE2      GLN  39   7.269   0.383  14.000
  273   2HE2  GLN  39          2HE2      GLN  39   6.010  -0.799  14.000
  274    H    ALA  40           H        ALA  40  10.789   2.691   9.909
  275    HA   ALA  40           HA       ALA  40  13.160   1.149   9.437
  276   1HB   ALA  40          1HB       ALA  40  13.569   3.336   8.928
  277   2HB   ALA  40          2HB       ALA  40  14.170   3.305  10.585
  278   3HB   ALA  40          3HB       ALA  40  12.563   3.946  10.243
  279    HA   PRO  41           HA       PRO  41  13.966  -0.698  13.347
  280   1HB   PRO  41          2HB       PRO  41  16.607   0.110  13.743
  281   2HB   PRO  41          1HB       PRO  41  16.090  -1.325  12.855
  282   1HG   PRO  41          2HG       PRO  41  16.886   1.360  11.826
  283   2HG   PRO  41          1HG       PRO  41  17.193  -0.245  11.138
  284   1HD   PRO  41          2HD       PRO  41  15.310   1.366  10.126
  285   2HD   PRO  41          1HD       PRO  41  15.068  -0.391  10.213
  286    H    GLY  42           H        GLY  42  12.569   0.593  14.597
  287   1HA   GLY  42          2HA       GLY  42  12.350   1.738  16.630
  288   2HA   GLY  42          1HA       GLY  42  13.973   2.376  16.421
  289    H    LYS  43           H        LYS  43  10.733   2.593  14.944
  290    HA   LYS  43           HA       LYS  43  11.019   5.502  14.910
  291   1HB   LYS  43          2HB       LYS  43  10.514   3.777  12.495
  292   2HB   LYS  43          1HB       LYS  43   9.991   5.455  12.551
  293   1HG   LYS  43          2HG       LYS  43  12.810   4.867  13.233
  294   2HG   LYS  43          1HG       LYS  43  12.316   4.731  11.545
  295   1HD   LYS  43          2HD       LYS  43  12.076   6.957  11.306
  296   2HD   LYS  43          1HD       LYS  43  11.368   7.150  12.911
  297   1HE   LYS  43          2HE       LYS  43  13.685   6.816  13.844
  298   2HE   LYS  43          1HE       LYS  43  14.283   6.937  12.189
  299   1HZ   LYS  43          1HZ       LYS  43  14.462   9.089  12.921
  300   2HZ   LYS  43          2HZ       LYS  43  13.072   9.013  13.881
  301   3HZ   LYS  43          3HZ       LYS  43  12.933   9.133  12.200
  302    H    GLY  44           H        GLY  44   8.585   3.985  12.988
  303   1HA   GLY  44          2HA       GLY  44   6.582   3.425  14.808
  304   2HA   GLY  44          1HA       GLY  44   6.488   5.157  14.519
  305    H    LEU  45           H        LEU  45   7.603   3.124  11.964
  306    HA   LEU  45           HA       LEU  45   6.744   2.534   9.946
  307   1HB   LEU  45          2HB       LEU  45   5.060   1.424  11.539
  308   2HB   LEU  45          1HB       LEU  45   3.992   2.753  11.133
  309    HG   LEU  45           HG       LEU  45   5.123   1.337   8.808
  310   1HD1  LEU  45          1HD1      LEU  45   3.983  -0.663   9.015
  311   2HD1  LEU  45          2HD1      LEU  45   2.940  -0.057  10.300
  312   3HD1  LEU  45          3HD1      LEU  45   4.631  -0.425  10.637
  313   1HD2  LEU  45          1HD2      LEU  45   2.860   1.599   7.998
  314   2HD2  LEU  45          2HD2      LEU  45   3.440   3.122   8.673
  315   3HD2  LEU  45          3HD2      LEU  45   2.322   2.117   9.595
  316    H    GLU  46           H        GLU  46   5.421   3.317   8.118
  317    HA   GLU  46           HA       GLU  46   4.212   5.918   8.273
  318   1HB   GLU  46          2HB       GLU  46   6.431   6.751   8.213
  319   2HB   GLU  46          1HB       GLU  46   6.931   5.560   7.022
  320   1HG   GLU  46          2HG       GLU  46   6.477   6.964   5.382
  321   2HG   GLU  46          1HG       GLU  46   4.807   7.105   5.930
  322    H    TRP  47           H        TRP  47   2.618   5.956   6.806
  323    HA   TRP  47           HA       TRP  47   2.028   3.849   5.130
  324   1HB   TRP  47          2HB       TRP  47   0.110   4.973   5.053
  325   2HB   TRP  47          1HB       TRP  47   0.897   6.400   5.717
  326    HD1  TRP  47           HD       TRP  47   0.317   4.759   2.231
  327    HE1  TRP  47           1HE      TRP  47   0.105   6.661   0.512
  328    HE3  TRP  47           3HE      TRP  47   1.185   8.769   5.299
  329    HZ2  TRP  47           2HZ      TRP  47   0.262   9.474   0.451
  330    HZ3  TRP  47           3HZ      TRP  47   1.129  11.029   4.328
  331    HH2  TRP  47           HH       TRP  47   0.676  11.371   1.952
  332    H    VAL  48           H        VAL  48   4.228   6.441   4.566
  333    HA   VAL  48           HA       VAL  48   5.581   6.989   2.832
  334    HB   VAL  48           HB       VAL  48   5.280   4.037   2.543
  335   1HG1  VAL  48          1HG1      VAL  48   7.254   5.193   0.710
  336   2HG1  VAL  48          2HG1      VAL  48   5.580   5.460   0.230
  337   3HG1  VAL  48          3HG1      VAL  48   6.169   3.820   0.489
  338   1HG2  VAL  48          1HG2      VAL  48   6.875   5.534   4.059
  339   2HG2  VAL  48          2HG2      VAL  48   7.885   5.441   2.614
  340   3HG2  VAL  48          3HG2      VAL  48   7.364   3.962   3.428
  341    H    SER  49           H        SER  49   3.563   4.635   1.018
  342    HA   SER  49           HA       SER  49   2.648   6.907  -0.625
  343   1HB   SER  49          2HB       SER  49   3.011   5.505  -2.656
  344   2HB   SER  49          1HB       SER  49   4.501   5.928  -1.811
  345    HG   SER  49           HG       SER  49   4.750   3.817  -2.061
  346    H    THR  50           H        THR  50   0.717   6.699  -1.705
  347    HA   THR  50           HA       THR  50  -0.936   4.337  -1.143
  348    HB   THR  50           HB       THR  50  -1.485   7.150  -0.335
  349    HG1  THR  50           1HG      THR  50  -1.218   4.950   0.909
  350   1HG2  THR  50          1HG2      THR  50  -3.179   6.674  -2.122
  351   2HG2  THR  50          2HG2      THR  50  -3.862   6.972  -0.524
  352   3HG2  THR  50          3HG2      THR  50  -3.748   5.323  -1.139
  353    H    ILE  51           H        ILE  51  -2.446   3.853  -2.745
  354    HA   ILE  51           HA       ILE  51  -2.314   5.540  -5.157
  355    HB   ILE  51           HB       ILE  51  -1.030   3.482  -5.480
  356   1HG1  ILE  51          2HG1      ILE  51  -3.450   2.968  -7.131
  357   2HG1  ILE  51          1HG1      ILE  51  -2.753   4.588  -7.216
  358   1HG2  ILE  51          1HG2      ILE  51  -2.257   1.310  -5.568
  359   2HG2  ILE  51          2HG2      ILE  51  -3.627   2.117  -4.807
  360   3HG2  ILE  51          3HG2      ILE  51  -2.090   1.992  -3.951
  361   1HD1  ILE  51          1HD1      ILE  51  -1.883   3.150  -8.970
  362   2HD1  ILE  51          2HD1      ILE  51  -1.289   2.016  -7.757
  363   3HD1  ILE  51          3HD1      ILE  51  -0.606   3.640  -7.855
  364    H    ASN  52           H        ASN  52  -4.183   5.817  -6.337
  365    HA   ASN  52           HA       ASN  52  -6.642   5.337  -4.885
  366   1HB   ASN  52          2HB       ASN  52  -5.769   7.369  -6.541
  367   2HB   ASN  52          1HB       ASN  52  -6.897   6.487  -7.566
  368   1HD2  ASN  52          1HD2      ASN  52  -8.543   7.908  -7.593
  369   2HD2  ASN  52          2HD2      ASN  52  -9.440   8.386  -6.196
  370    HA   PRO  53           HA       PRO  53  -7.953   1.615  -6.840
  371   1HB   PRO  53          2HB       PRO  53 -10.612   2.357  -7.336
  372   2HB   PRO  53          1HB       PRO  53 -10.001   1.574  -5.877
  373   1HG   PRO  53          2HG       PRO  53 -10.571   4.453  -6.387
  374   2HG   PRO  53          1HG       PRO  53 -10.771   3.511  -4.898
  375   1HD   PRO  53          2HD       PRO  53  -8.735   5.220  -5.195
  376   2HD   PRO  53          1HD       PRO  53  -8.521   3.674  -4.345
  377    H    GLY  54           H        GLY  54  -7.415   1.068  -8.838
  378   1HA   GLY  54          2HA       GLY  54  -7.849   0.888 -11.152
  379   2HA   GLY  54          1HA       GLY  54  -8.692   2.428 -11.090
  380    H    ASP  55           H        ASP  55  -5.637   2.248  -9.520
  381    HA   ASP  55           HA       ASP  55  -3.670   3.328  -9.893
  382   1HB   ASP  55          2HB       ASP  55  -3.487   1.468 -11.545
  383   2HB   ASP  55          1HB       ASP  55  -4.157   2.539 -12.774
  384    H    GLY  56           H        GLY  56  -5.212   5.244  -9.437
  385   1HA   GLY  56          2HA       GLY  56  -5.302   7.050 -11.763
  386   2HA   GLY  56          1HA       GLY  56  -6.291   7.210 -10.318
  387    H    SER  57           H        SER  57  -5.660   8.632  -8.832
  388    HA   SER  57           HA       SER  57  -3.216  10.102  -9.231
  389   1HB   SER  57          2HB       SER  57  -5.579  10.354  -7.405
  390   2HB   SER  57          1HB       SER  57  -4.097  11.228  -7.022
  391    HG   SER  57           HG       SER  57  -4.536  11.639  -9.568
  392    H    THR  58           H        THR  58  -1.613  10.440  -7.571
  393    HA   THR  58           HA       THR  58  -1.373   8.174  -5.704
  394    HB   THR  58           HB       THR  58   1.226   9.109  -6.336
  395    HG1  THR  58           1HG      THR  58   0.762   9.814  -8.326
  396   1HG2  THR  58          1HG2      THR  58   1.178   6.722  -7.497
  397   2HG2  THR  58          2HG2      THR  58  -0.345   6.603  -6.615
  398   3HG2  THR  58          3HG2      THR  58   1.158   6.907  -5.743
  399    H    TYR  59           H        TYR  59  -0.544   8.586  -3.691
  400    HA   TYR  59           HA       TYR  59   0.162  11.368  -3.058
  401   1HB   TYR  59          2HB       TYR  59  -1.425   9.747  -1.101
  402   2HB   TYR  59          1HB       TYR  59  -1.285  11.496  -1.241
  403    HD1  TYR  59           1HD      TYR  59  -3.109   8.542  -2.282
  404    HD2  TYR  59           2HD      TYR  59  -2.543  12.693  -3.019
  405    HE1  TYR  59           1HE      TYR  59  -5.226   8.604  -3.529
  406    HE2  TYR  59           2HE      TYR  59  -4.660  12.766  -4.265
  407    HH   TYR  59           HH       TYR  59  -6.560   9.832  -4.834
  408    H    TYR  60           H        TYR  60   1.997  11.546  -1.935
  409    HA   TYR  60           HA       TYR  60   3.011   9.142  -0.568
  410   1HB   TYR  60          2HB       TYR  60   4.522  11.261  -2.102
  411   2HB   TYR  60          1HB       TYR  60   5.307  10.091  -1.047
  412    HD1  TYR  60           1HD      TYR  60   6.154   8.184  -2.033
  413    HD2  TYR  60           2HD      TYR  60   2.853  10.135  -3.874
  414    HE1  TYR  60           1HE      TYR  60   6.236   6.565  -3.880
  415    HE2  TYR  60           2HE      TYR  60   2.925   8.520  -5.726
  416    HH   TYR  60           HH       TYR  60   3.813   6.033  -5.967
  417    H    ALA  61           H        ALA  61   4.620   9.662   1.182
  418    HA   ALA  61           HA       ALA  61   3.430  11.565   2.976
  419   1HB   ALA  61          1HB       ALA  61   4.965   9.218   3.227
  420   2HB   ALA  61          2HB       ALA  61   4.231  10.180   4.511
  421   3HB   ALA  61          3HB       ALA  61   5.884  10.514   3.993
  422    H    ASP  62           H        ASP  62   5.149  12.278   0.480
  423    HA   ASP  62           HA       ASP  62   6.357  14.100  -0.144
  424   1HB   ASP  62          2HB       ASP  62   6.482  14.941   2.751
  425   2HB   ASP  62          1HB       ASP  62   6.667  15.954   1.324
  426    H    SER  63           H        SER  63   7.445  12.137   2.516
  427    HA   SER  63           HA       SER  63  10.223  12.897   2.124
  428   1HB   SER  63          2HB       SER  63   9.474  10.608   3.879
  429   2HB   SER  63          1HB       SER  63  10.669  11.880   4.136
  430    HG   SER  63           HG       SER  63   9.039  13.281   4.703
  431    H    VAL  64           H        VAL  64   8.037  10.737   0.784
  432    HA   VAL  64           HA       VAL  64  10.238   9.051  -0.201
  433    HB   VAL  64           HB       VAL  64   8.665   7.179  -0.407
  434   1HG1  VAL  64          1HG1      VAL  64  10.050   7.330   1.577
  435   2HG1  VAL  64          2HG1      VAL  64   8.469   6.664   1.985
  436   3HG1  VAL  64          3HG1      VAL  64   8.843   8.345   2.367
  437   1HG2  VAL  64          1HG2      VAL  64   6.728   9.143  -0.111
  438   2HG2  VAL  64          2HG2      VAL  64   6.638   8.201   1.377
  439   3HG2  VAL  64          3HG2      VAL  64   6.468   7.400  -0.185
  440    H    LYS  65           H        LYS  65   8.548  11.492  -1.169
  441    HA   LYS  65           HA       LYS  65   7.394  10.462  -3.616
  442   1HB   LYS  65          2HB       LYS  65   6.360  12.357  -2.376
  443   2HB   LYS  65          1HB       LYS  65   7.777  13.332  -2.742
  444   1HG   LYS  65          2HG       LYS  65   6.338  14.012  -4.383
  445   2HG   LYS  65          1HG       LYS  65   7.203  12.719  -5.215
  446   1HD   LYS  65          2HD       LYS  65   5.408  11.249  -5.066
  447   2HD   LYS  65          1HD       LYS  65   4.673  12.128  -3.723
  448   1HE   LYS  65          2HE       LYS  65   3.589  13.551  -5.086
  449   2HE   LYS  65          1HE       LYS  65   4.950  13.677  -6.201
  450   1HZ   LYS  65          1HZ       LYS  65   2.603  12.155  -6.468
  451   2HZ   LYS  65          2HZ       LYS  65   3.921  11.098  -6.416
  452   3HZ   LYS  65          3HZ       LYS  65   3.874  12.334  -7.570
  453    H    GLY  66           H        GLY  66   8.497  10.146  -5.418
  454   1HA   GLY  66          2HA       GLY  66   9.934  10.856  -7.173
  455   2HA   GLY  66          1HA       GLY  66  10.785  11.879  -6.024
  456    H    ARG  67           H        ARG  67  10.505   9.282  -4.253
  457    HA   ARG  67           HA       ARG  67  13.009   8.096  -5.242
  458   1HB   ARG  67          2HB       ARG  67  12.910   7.153  -2.751
  459   2HB   ARG  67          1HB       ARG  67  13.593   8.731  -3.125
  460   1HG   ARG  67          2HG       ARG  67  10.794   9.010  -2.712
  461   2HG   ARG  67          1HG       ARG  67  11.488   8.091  -1.368
  462   1HD   ARG  67          2HD       ARG  67  11.587  10.420  -0.815
  463   2HD   ARG  67          1HD       ARG  67  13.227   9.866  -1.151
  464    HE   ARG  67           HE       ARG  67  12.030  10.942  -3.485
  465   1HH1  ARG  67          1HH1      ARG  67  13.467  11.875  -0.448
  466   2HH1  ARG  67          2HH1      ARG  67  13.990  13.422  -1.025
  467   1HH2  ARG  67          1HH2      ARG  67  12.714  12.978  -4.249
  468   2HH2  ARG  67          2HH2      ARG  67  13.562  14.048  -3.184
  469    H    PHE  68           H        PHE  68   9.938   7.246  -3.652
  470    HA   PHE  68           HA       PHE  68  10.297   4.488  -4.598
  471   1HB   PHE  68          2HB       PHE  68   8.551   5.656  -2.431
  472   2HB   PHE  68          1HB       PHE  68   8.429   3.987  -2.973
  473    HD1  PHE  68           1HD      PHE  68  11.762   4.546  -3.326
  474    HD2  PHE  68           2HD      PHE  68   8.844   4.241  -0.244
  475    HE1  PHE  68           1HE      PHE  68  13.518   3.902  -1.730
  476    HE2  PHE  68           2HE      PHE  68  10.598   3.596   1.355
  477    HZ   PHE  68           HZ       PHE  68  12.935   3.426   0.611
  478    H    THR  69           H        THR  69   8.587   3.367  -5.580
  479    HA   THR  69           HA       THR  69   6.512   5.080  -6.785
  480    HB   THR  69           HB       THR  69   8.009   2.809  -8.114
  481    HG1  THR  69           1HG      THR  69   8.006   5.627  -8.428
  482   1HG2  THR  69          1HG2      THR  69   5.528   2.986  -8.645
  483   2HG2  THR  69          2HG2      THR  69   6.628   3.085 -10.018
  484   3HG2  THR  69          3HG2      THR  69   5.896   4.551  -9.369
  485    H    ILE  70           H        ILE  70   4.573   4.502  -6.179
  486    HA   ILE  70           HA       ILE  70   4.121   1.760  -5.262
  487    HB   ILE  70           HB       ILE  70   3.637   3.686  -3.727
  488   1HG1  ILE  70          2HG1      ILE  70   2.058   1.353  -4.299
  489   2HG1  ILE  70          1HG1      ILE  70   2.432   2.087  -2.744
  490   1HG2  ILE  70          1HG2      ILE  70   1.227   4.176  -5.457
  491   2HG2  ILE  70          2HG2      ILE  70   2.699   5.143  -5.545
  492   3HG2  ILE  70          3HG2      ILE  70   1.764   5.095  -4.050
  493   1HD1  ILE  70          1HD1      ILE  70   0.522   3.599  -3.025
  494   2HD1  ILE  70          2HD1      ILE  70   0.052   1.898  -3.027
  495   3HD1  ILE  70          3HD1      ILE  70   0.132   2.794  -4.545
  496    H    SER  71           H        SER  71   3.110   0.414  -6.556
  497    HA   SER  71           HA       SER  71   0.869   1.250  -8.179
  498   1HB   SER  71          2HB       SER  71   3.533   0.886  -9.318
  499   2HB   SER  71          1HB       SER  71   2.331  -0.165 -10.067
  500    HG   SER  71           HG       SER  71   2.322   2.658  -9.878
  501    H    ARG  72           H        ARG  72  -0.081  -0.668  -9.349
  502    HA   ARG  72           HA       ARG  72   0.669  -3.275  -8.384
  503   1HB   ARG  72          2HB       ARG  72  -1.261  -3.756  -7.090
  504   2HB   ARG  72          1HB       ARG  72  -0.631  -2.229  -6.490
  505   1HG   ARG  72          2HG       ARG  72  -2.415  -1.449  -8.432
  506   2HG   ARG  72          1HG       ARG  72  -3.199  -2.847  -7.697
  507   1HD   ARG  72          2HD       ARG  72  -3.512  -1.800  -5.722
  508   2HD   ARG  72          1HD       ARG  72  -1.987  -0.922  -5.823
  509    HE   ARG  72           HE       ARG  72  -3.081   0.811  -6.881
  510   1HH1  ARG  72          1HH1      ARG  72  -5.174  -1.961  -6.648
  511   2HH1  ARG  72          2HH1      ARG  72  -6.591  -1.091  -7.124
  512   1HH2  ARG  72          1HH2      ARG  72  -4.941   1.965  -7.512
  513   2HH2  ARG  72          2HH2      ARG  72  -6.461   1.141  -7.619
  514    H    ASP  73           H        ASP  73  -1.323  -4.838  -8.930
  515    HA   ASP  73           HA       ASP  73  -1.852  -4.376 -11.763
  516   1HB   ASP  73          2HB       ASP  73  -2.775  -6.856 -11.401
  517   2HB   ASP  73          1HB       ASP  73  -1.061  -6.524 -11.630
  518    H    ASN  74           H        ASN  74  -4.075  -5.543 -12.411
  519    HA   ASN  74           HA       ASN  74  -6.157  -4.464 -10.627
  520   1HB   ASN  74          2HB       ASN  74  -7.437  -4.071 -12.851
  521   2HB   ASN  74          1HB       ASN  74  -6.183  -2.926 -12.382
  522   1HD2  ASN  74          1HD2      ASN  74  -5.719  -2.248 -14.428
  523   2HD2  ASN  74          2HD2      ASN  74  -4.965  -3.252 -15.614
  524    H    ALA  75           H        ALA  75  -4.938  -7.220 -11.362
  525    HA   ALA  75           HA       ALA  75  -7.321  -8.711 -11.003
  526   1HB   ALA  75          1HB       ALA  75  -6.122  -9.391 -13.637
  527   2HB   ALA  75          2HB       ALA  75  -7.205  -8.001 -13.549
  528   3HB   ALA  75          3HB       ALA  75  -7.777  -9.595 -13.059
  529    H    LYS  76           H        LYS  76  -5.115  -8.745  -9.501
  530    HA   LYS  76           HA       LYS  76  -4.212 -11.466  -9.766
  531   1HB   LYS  76          2HB       LYS  76  -2.642  -9.454 -10.928
  532   2HB   LYS  76          1HB       LYS  76  -1.837  -9.858  -9.416
  533   1HG   LYS  76          2HG       LYS  76  -2.494 -12.315 -10.535
  534   2HG   LYS  76          1HG       LYS  76  -1.955 -11.327 -11.895
  535   1HD   LYS  76          2HD       LYS  76   0.112 -10.807 -10.734
  536   2HD   LYS  76          1HD       LYS  76  -0.433 -11.707  -9.317
  537   1HE   LYS  76          2HE       LYS  76  -0.227 -13.762 -10.392
  538   2HE   LYS  76          1HE       LYS  76  -0.251 -13.032 -11.997
  539   1HZ   LYS  76          1HZ       LYS  76   1.958 -13.601 -11.673
  540   2HZ   LYS  76          2HZ       LYS  76   1.964 -13.131 -10.049
  541   3HZ   LYS  76          3HZ       LYS  76   1.938 -11.958 -11.267
  542    H    ASN  77           H        ASN  77  -4.929  -8.737  -7.970
  543    HA   ASN  77           HA       ASN  77  -4.875  -8.217  -5.754
  544   1HB   ASN  77          2HB       ASN  77  -5.435 -11.001  -5.976
  545   2HB   ASN  77          1HB       ASN  77  -4.385 -10.776  -4.580
  546   1HD2  ASN  77          1HD2      ASN  77  -5.209  -9.952  -2.758
  547   2HD2  ASN  77          2HD2      ASN  77  -6.834  -9.394  -2.576
  548    H    THR  78           H        THR  78  -2.737  -7.214  -6.276
  549    HA   THR  78           HA       THR  78  -0.786  -8.076  -4.349
  550    HB   THR  78           HB       THR  78   0.829  -7.785  -6.627
  551    HG1  THR  78           1HG      THR  78  -1.279  -9.669  -7.031
  552   1HG2  THR  78          1HG2      THR  78   0.258  -9.781  -4.560
  553   2HG2  THR  78          2HG2      THR  78   1.803  -9.229  -5.208
  554   3HG2  THR  78          3HG2      THR  78   0.879 -10.464  -6.064
  555    H    LEU  79           H        LEU  79   0.962  -6.600  -4.084
  556    HA   LEU  79           HA       LEU  79   0.525  -3.961  -5.310
  557   1HB   LEU  79          2HB       LEU  79   0.167  -4.627  -2.604
  558   2HB   LEU  79          1HB       LEU  79   1.704  -3.787  -2.671
  559    HG   LEU  79           HG       LEU  79  -0.986  -2.757  -3.498
  560   1HD1  LEU  79          1HD1      LEU  79   0.467  -0.976  -1.835
  561   2HD1  LEU  79          2HD1      LEU  79   0.491  -2.580  -1.100
  562   3HD1  LEU  79          3HD1      LEU  79  -1.047  -1.816  -1.497
  563   1HD2  LEU  79          1HD2      LEU  79  -0.119  -1.275  -4.884
  564   2HD2  LEU  79          2HD2      LEU  79   1.410  -2.147  -4.764
  565   3HD2  LEU  79          3HD2      LEU  79   1.083  -0.788  -3.688
  566    H    TYR  80           H        TYR  80   2.277  -3.240  -6.349
  567    HA   TYR  80           HA       TYR  80   4.895  -4.357  -5.585
  568   1HB   TYR  80          2HB       TYR  80   3.964  -3.485  -8.326
  569   2HB   TYR  80          1HB       TYR  80   5.574  -4.082  -7.937
  570    HD1  TYR  80           1HD      TYR  80   6.018  -6.403  -7.817
  571    HD2  TYR  80           2HD      TYR  80   2.005  -5.029  -8.135
  572    HE1  TYR  80           1HE      TYR  80   5.271  -8.704  -8.259
  573    HE2  TYR  80           2HE      TYR  80   1.246  -7.324  -8.572
  574    HH   TYR  80           HH       TYR  80   3.459  -9.904  -9.200
  575    H    LEU  81           H        LEU  81   6.385  -2.960  -4.920
  576    HA   LEU  81           HA       LEU  81   6.128  -0.152  -5.761
  577   1HB   LEU  81          2HB       LEU  81   5.447  -0.391  -3.406
  578   2HB   LEU  81          1HB       LEU  81   7.003  -1.111  -3.034
  579    HG   LEU  81           HG       LEU  81   7.388   1.429  -4.334
  580   1HD1  LEU  81          1HD1      LEU  81   5.736   2.644  -3.507
  581   2HD1  LEU  81          2HD1      LEU  81   6.456   2.395  -1.916
  582   3HD1  LEU  81          3HD1      LEU  81   5.177   1.319  -2.485
  583   1HD2  LEU  81          1HD2      LEU  81   9.144   0.556  -3.070
  584   2HD2  LEU  81          2HD2      LEU  81   8.103   0.217  -1.689
  585   3HD2  LEU  81          3HD2      LEU  81   8.517   1.884  -2.093
  586    H    GLN  82           H        GLN  82   7.954   0.859  -6.391
  587    HA   GLN  82           HA       GLN  82  10.375  -0.797  -6.514
  588   1HB   GLN  82          2HB       GLN  82   9.286   0.109  -8.640
  589   2HB   GLN  82          1HB       GLN  82   9.829   1.698  -8.119
  590   1HG   GLN  82          2HG       GLN  82  11.572   1.142  -9.450
  591   2HG   GLN  82          1HG       GLN  82  12.149   0.444  -7.938
  592   1HE2  GLN  82          1HE2      GLN  82  12.978  -1.495  -8.168
  593   2HE2  GLN  82          2HE2      GLN  82  12.487  -2.692  -9.313
  594    H    MET  83           H        MET  83  11.640  -0.383  -4.822
  595    HA   MET  83           HA       MET  83  11.756   2.253  -3.639
  596   1HB   MET  83          2HB       MET  83  12.918  -0.426  -2.997
  597   2HB   MET  83          1HB       MET  83  13.646   1.007  -2.284
  598   1HG   MET  83          2HG       MET  83  11.673   1.566  -1.139
  599   2HG   MET  83          1HG       MET  83  10.710   0.432  -2.084
  600   1HE   MET  83          1HE       MET  83  10.197  -2.070   0.432
  601   2HE   MET  83          2HE       MET  83  10.548  -2.377  -1.268
  602   3HE   MET  83          3HE       MET  83   9.620  -0.952  -0.803
  603    H    ASN  84           H        ASN  84  12.604   3.511  -5.310
  604    HA   ASN  84           HA       ASN  84  15.377   2.926  -6.104
  605   1HB   ASN  84          2HB       ASN  84  13.251   3.580  -7.681
  606   2HB   ASN  84          1HB       ASN  84  13.981   5.162  -7.425
  607   1HD2  ASN  84          1HD2      ASN  84  13.795   3.582  -9.856
  608   2HD2  ASN  84          2HD2      ASN  84  15.417   3.340 -10.400
  609    H    SER  85           H        SER  85  16.718   4.965  -6.498
  610    HA   SER  85           HA       SER  85  17.907   6.656  -5.543
  611   1HB   SER  85          2HB       SER  85  15.131   7.516  -5.695
  612   2HB   SER  85          1HB       SER  85  15.999   8.327  -4.390
  613    HG   SER  85           HG       SER  85  16.213   8.660  -7.076
  614    H    LEU  86           H        LEU  86  18.063   4.566  -3.949
  615    HA   LEU  86           HA       LEU  86  17.076   4.990  -1.311
  616   1HB   LEU  86          2HB       LEU  86  19.404   3.254  -2.117
  617   2HB   LEU  86          1HB       LEU  86  18.406   3.096  -0.682
  618    HG   LEU  86           HG       LEU  86  16.597   2.907  -2.786
  619   1HD1  LEU  86          1HD1      LEU  86  18.014   0.779  -3.778
  620   2HD1  LEU  86          2HD1      LEU  86  19.241   2.040  -3.643
  621   3HD1  LEU  86          3HD1      LEU  86  17.778   2.329  -4.586
  622   1HD2  LEU  86          1HD2      LEU  86  17.229   1.536  -0.523
  623   2HD2  LEU  86          2HD2      LEU  86  17.653   0.369  -1.775
  624   3HD2  LEU  86          3HD2      LEU  86  16.020   1.031  -1.704
  625    H    LYS  87           H        LYS  87  18.635   5.055   0.583
  626    HA   LYS  87           HA       LYS  87  21.121   6.439   0.224
  627   1HB   LYS  87          2HB       LYS  87  20.316   8.423   1.636
  628   2HB   LYS  87          1HB       LYS  87  19.851   8.399  -0.059
  629   1HG   LYS  87          2HG       LYS  87  17.793   7.065   1.269
  630   2HG   LYS  87          1HG       LYS  87  18.198   8.438   2.299
  631   1HD   LYS  87          2HD       LYS  87  17.906   9.964   0.443
  632   2HD   LYS  87          1HD       LYS  87  17.622   8.615  -0.658
  633   1HE   LYS  87          2HE       LYS  87  15.833   8.399   1.555
  634   2HE   LYS  87          1HE       LYS  87  15.739  10.034   0.902
  635   1HZ   LYS  87          1HZ       LYS  87  14.170   8.624  -0.217
  636   2HZ   LYS  87          2HZ       LYS  87  15.375   7.506  -0.614
  637   3HZ   LYS  87          3HZ       LYS  87  15.390   9.048  -1.309
  638    H    SER  88           H        SER  88  18.483   5.832   2.517
  639    HA   SER  88           HA       SER  88  19.999   4.175   4.211
  640   1HB   SER  88          2HB       SER  88  20.528   6.915   4.607
  641   2HB   SER  88          1HB       SER  88  19.461   6.437   5.928
  642    HG   SER  88           HG       SER  88  21.941   5.266   5.199
  643    H    GLU  89           H        GLU  89  17.435   6.608   4.151
  644    HA   GLU  89           HA       GLU  89  15.816   5.525   6.152
  645   1HB   GLU  89          2HB       GLU  89  14.226   7.071   5.502
  646   2HB   GLU  89          1HB       GLU  89  15.701   7.802   4.899
  647   1HG   GLU  89          2HG       GLU  89  15.227   7.077   2.668
  648   2HG   GLU  89          1HG       GLU  89  13.843   6.136   3.219
  649    H    ASP  90           H        ASP  90  16.471   4.396   3.008
  650    HA   ASP  90           HA       ASP  90  14.017   2.993   2.563
  651   1HB   ASP  90          2HB       ASP  90  16.632   2.223   1.300
  652   2HB   ASP  90          1HB       ASP  90  15.011   2.155   0.617
  653    H    THR  91           H        THR  91  17.081   2.280   4.086
  654    HA   THR  91           HA       THR  91  16.846  -0.523   4.256
  655    HB   THR  91           HB       THR  91  18.203   1.141   6.361
  656    HG1  THR  91           1HG      THR  91  20.041   0.803   4.690
  657   1HG2  THR  91          1HG2      THR  91  18.394  -1.627   5.322
  658   2HG2  THR  91          2HG2      THR  91  18.580  -1.018   6.966
  659   3HG2  THR  91          3HG2      THR  91  19.898  -0.844   5.808
  660    H    ALA  92           H        ALA  92  14.779  -1.124   4.916
  661    HA   ALA  92           HA       ALA  92  14.349  -1.303   7.709
  662   1HB   ALA  92          1HB       ALA  92  12.477   0.123   8.031
  663   2HB   ALA  92          2HB       ALA  92  12.391   0.508   6.313
  664   3HB   ALA  92          3HB       ALA  92  13.740   1.099   7.283
  665    H    VAL  93           H        VAL  93  11.634  -1.634   7.843
  666    HA   VAL  93           HA       VAL  93  11.216  -3.937   6.063
  667    HB   VAL  93           HB       VAL  93   9.834  -3.353   8.689
  668   1HG1  VAL  93          1HG1      VAL  93   9.383  -5.858   8.494
  669   2HG1  VAL  93          2HG1      VAL  93   9.858  -5.693   6.803
  670   3HG1  VAL  93          3HG1      VAL  93   8.473  -4.790   7.424
  671   1HG2  VAL  93          1HG2      VAL  93  11.318  -4.872   9.751
  672   2HG2  VAL  93          2HG2      VAL  93  12.327  -3.739   8.851
  673   3HG2  VAL  93          3HG2      VAL  93  12.035  -5.358   8.213
  674    H    TYR  94           H        TYR  94   9.636  -3.854   4.580
  675    HA   TYR  94           HA       TYR  94   7.702  -1.647   4.774
  676   1HB   TYR  94          2HB       TYR  94   8.752  -3.132   2.362
  677   2HB   TYR  94          1HB       TYR  94   7.462  -1.934   2.297
  678    HD1  TYR  94           1HD      TYR  94   8.011   0.282   1.908
  679    HD2  TYR  94           2HD      TYR  94  10.982  -2.326   3.472
  680    HE1  TYR  94           1HE      TYR  94   9.677   2.082   1.732
  681    HE2  TYR  94           2HE      TYR  94  12.657  -0.534   3.300
  682    HH   TYR  94           HH       TYR  94  12.877   1.637   1.775
  683    H    TYR  95           H        TYR  95   5.563  -1.979   4.672
  684    HA   TYR  95           HA       TYR  95   4.603  -4.743   4.326
  685   1HB   TYR  95          2HB       TYR  95   3.180  -2.781   6.103
  686   2HB   TYR  95          1HB       TYR  95   3.080  -4.536   6.093
  687    HD1  TYR  95           1HD      TYR  95   4.368  -5.804   7.568
  688    HD2  TYR  95           2HD      TYR  95   5.342  -1.710   6.950
  689    HE1  TYR  95           1HE      TYR  95   5.970  -5.912   9.431
  690    HE2  TYR  95           2HE      TYR  95   6.950  -1.807   8.808
  691    HH   TYR  95           HH       TYR  95   8.345  -3.793   9.936
  692    H    CYS  96           H        CYS  96   2.251  -4.817   3.755
  693    HA   CYS  96           HA       CYS  96   1.409  -2.478   2.197
  694   1HB   CYS  96          2HB       CYS  96   1.333  -3.612   0.261
  695   2HB   CYS  96          1HB       CYS  96   2.300  -4.848   1.056
  696    H    ALA  97           H        ALA  97  -0.784  -2.070   2.201
  697    HA   ALA  97           HA       ALA  97  -2.658  -3.950   3.288
  698   1HB   ALA  97          1HB       ALA  97  -1.397  -1.985   5.043
  699   2HB   ALA  97          2HB       ALA  97  -2.283  -3.465   5.431
  700   3HB   ALA  97          3HB       ALA  97  -3.164  -1.975   5.093
  701    H    LYS  98           H        LYS  98  -4.839  -3.018   3.546
  702    HA   LYS  98           HA       LYS  98  -5.386  -1.229   1.325
  703   1HB   LYS  98          2HB       LYS  98  -6.919  -2.923   1.215
  704   2HB   LYS  98          1HB       LYS  98  -6.931  -3.174   2.953
  705   1HG   LYS  98          2HG       LYS  98  -8.067  -0.629   2.445
  706   2HG   LYS  98          1HG       LYS  98  -8.809  -1.787   1.340
  707   1HD   LYS  98          2HD       LYS  98  -8.654  -1.975   4.344
  708   2HD   LYS  98          1HD       LYS  98 -10.098  -1.705   3.371
  709   1HE   LYS  98          2HE       LYS  98  -8.402  -4.172   3.092
  710   2HE   LYS  98          1HE       LYS  98  -9.715  -4.059   4.265
  711   1HZ   LYS  98          1HZ       LYS  98 -10.113  -3.545   1.375
  712   2HZ   LYS  98          2HZ       LYS  98 -11.294  -3.806   2.557
  713   3HZ   LYS  98          3HZ       LYS  98 -10.299  -5.079   2.063
  714    H    TYR  99           H        TYR  99  -6.308   0.783   1.482
  715    HA   TYR  99           HA       TYR  99  -5.987   2.127   4.021
  716   1HB   TYR  99          2HB       TYR  99  -5.887   2.871   1.287
  717   2HB   TYR  99          1HB       TYR  99  -7.179   3.808   2.029
  718    HD1  TYR  99           1HD      TYR  99  -6.588   5.866   2.864
  719    HD2  TYR  99           2HD      TYR  99  -3.675   2.766   2.849
  720    HE1  TYR  99           1HE      TYR  99  -4.927   7.432   3.779
  721    HE2  TYR  99           2HE      TYR  99  -2.007   4.322   3.766
  722    HH   TYR  99           HH       TYR  99  -1.900   7.197   3.624
  723    H    SER 100           H        SER 100  -7.725   3.804   4.597
  724    HA   SER 100           HA       SER 100 -10.448   2.990   4.031
  725   1HB   SER 100          2HB       SER 100  -9.067   2.275   6.527
  726   2HB   SER 100          1HB       SER 100 -10.613   3.089   6.767
  727    HG   SER 100           HG       SER 100 -10.356   0.602   6.333
  728    H    GLY 101           H        GLY 101  -8.355   4.988   6.097
  729   1HA   GLY 101          2HA       GLY 101 -10.201   7.239   5.593
  730   2HA   GLY 101          1HA       GLY 101  -9.490   6.965   7.175
  731    H    GLY 102           H        GLY 102  -7.195   7.242   7.427
  732   1HA   GLY 102          2HA       GLY 102  -5.883   8.721   5.249
  733   2HA   GLY 102          1HA       GLY 102  -5.992   9.460   6.839
  734    H    ALA 103           H        ALA 103  -5.719   6.350   7.595
  735    HA   ALA 103           HA       ALA 103  -2.784   6.281   7.379
  736   1HB   ALA 103          1HB       ALA 103  -4.130   6.834   9.722
  737   2HB   ALA 103          2HB       ALA 103  -2.468   6.262   9.589
  738   3HB   ALA 103          3HB       ALA 103  -3.778   5.111   9.848
  739    H    LEU 104           H        LEU 104  -1.852   4.128   7.613
  740    HA   LEU 104           HA       LEU 104  -3.680   2.097   6.565
  741   1HB   LEU 104          2HB       LEU 104  -1.428   2.767   5.457
  742   2HB   LEU 104          1HB       LEU 104  -0.700   1.776   6.708
  743    HG   LEU 104           HG       LEU 104  -1.748  -0.199   5.900
  744   1HD1  LEU 104          1HD1      LEU 104  -3.550   1.716   4.563
  745   2HD1  LEU 104          2HD1      LEU 104  -3.898   0.159   5.316
  746   3HD1  LEU 104          3HD1      LEU 104  -3.197   0.221   3.699
  747   1HD2  LEU 104          1HD2      LEU 104  -0.296   1.508   4.033
  748   2HD2  LEU 104          2HD2      LEU 104  -1.277   0.274   3.243
  749   3HD2  LEU 104          3HD2      LEU 104  -0.063  -0.194   4.434
  750    H    ASP 105           H        ASP 105  -3.611  -0.072   7.341
  751    HA   ASP 105           HA       ASP 105  -3.125  -0.183  10.224
  752   1HB   ASP 105          2HB       ASP 105  -5.302  -0.926   8.760
  753   2HB   ASP 105          1HB       ASP 105  -4.459  -2.462   8.920
  754    H    ALA 106           H        ALA 106  -2.255  -1.771   7.215
  755    HA   ALA 106           HA       ALA 106  -0.541  -3.153   6.654
  756   1HB   ALA 106          1HB       ALA 106   0.896  -1.652   7.861
  757   2HB   ALA 106          2HB       ALA 106   1.403  -3.314   8.164
  758   3HB   ALA 106          3HB       ALA 106   0.490  -2.433   9.390
  759    H    TRP 107           H        TRP 107  -1.147  -5.190   6.376
  760    HA   TRP 107           HA       TRP 107  -1.329  -6.930   8.736
  761   1HB   TRP 107          2HB       TRP 107  -3.112  -7.437   6.387
  762   2HB   TRP 107          1HB       TRP 107  -3.310  -7.944   8.061
  763    HD1  TRP 107           HD       TRP 107  -3.646  -5.557   9.745
  764    HE1  TRP 107           1HE      TRP 107  -5.408  -3.729   9.334
  765    HE3  TRP 107           3HE      TRP 107  -4.499  -6.376   4.786
  766    HZ2  TRP 107           2HZ      TRP 107  -6.955  -2.757   7.177
  767    HZ3  TRP 107           3HZ      TRP 107  -6.131  -4.957   3.615
  768    HH2  TRP 107           HH       TRP 107  -7.332  -3.188   4.788
  769    H    GLY 108           H        GLY 108   0.240  -6.276   5.982
  770   1HA   GLY 108          2HA       GLY 108   0.603  -9.051   5.126
  771   2HA   GLY 108          1HA       GLY 108   1.185  -7.625   4.283
  772    H    GLN 109           H        GLN 109   2.582 -10.106   5.064
  773    HA   GLN 109           HA       GLN 109   4.278  -9.796   7.227
  774   1HB   GLN 109          2HB       GLN 109   4.478 -11.235   4.621
  775   2HB   GLN 109          1HB       GLN 109   5.929 -11.082   5.604
  776   1HG   GLN 109          2HG       GLN 109   3.702 -11.922   7.215
  777   2HG   GLN 109          1HG       GLN 109   3.915 -12.995   5.831
  778   1HE2  GLN 109          1HE2      GLN 109   4.287 -14.096   8.201
  779   2HE2  GLN 109          2HE2      GLN 109   5.962 -14.357   8.534
  780    H    GLY 110           H        GLY 110   6.035  -8.613   7.647
  781   1HA   GLY 110          2HA       GLY 110   6.604  -6.378   5.954
  782   2HA   GLY 110          1HA       GLY 110   7.398  -6.762   7.471
  783    H    THR 111           H        THR 111   7.813  -6.488   4.191
  784    HA   THR 111           HA       THR 111   9.729  -8.554   3.747
  785    HB   THR 111           HB       THR 111   8.593  -7.577   1.840
  786    HG1  THR 111           1HG      THR 111  10.929  -8.228   1.758
  787   1HG2  THR 111          1HG2      THR 111   9.452  -5.193   1.168
  788   2HG2  THR 111          2HG2      THR 111   9.722  -5.023   2.905
  789   3HG2  THR 111          3HG2      THR 111   8.103  -5.367   2.294
  790    H    GLN 112           H        GLN 112  11.838  -8.598   4.231
  791    HA   GLN 112           HA       GLN 112  12.956  -6.410   5.749
  792   1HB   GLN 112          2HB       GLN 112  13.249  -8.840   6.343
  793   2HB   GLN 112          1HB       GLN 112  14.301  -8.989   4.942
  794   1HG   GLN 112          2HG       GLN 112  15.643  -8.721   6.902
  795   2HG   GLN 112          1HG       GLN 112  15.778  -7.267   5.916
  796   1HE2  GLN 112          1HE2      GLN 112  15.214  -5.349   6.762
  797   2HE2  GLN 112          2HE2      GLN 112  14.581  -5.126   8.354
  798    H    VAL 113           H        VAL 113  13.415  -4.721   4.431
  799    HA   VAL 113           HA       VAL 113  15.149  -5.214   2.106
  800    HB   VAL 113           HB       VAL 113  13.600  -2.711   2.800
  801   1HG1  VAL 113          1HG1      VAL 113  14.283  -1.812   0.762
  802   2HG1  VAL 113          2HG1      VAL 113  14.800  -3.378   0.135
  803   3HG1  VAL 113          3HG1      VAL 113  15.746  -2.573   1.387
  804   1HG2  VAL 113          1HG2      VAL 113  12.132  -4.608   2.258
  805   2HG2  VAL 113          2HG2      VAL 113  12.994  -4.828   0.735
  806   3HG2  VAL 113          3HG2      VAL 113  12.072  -3.353   1.021
  807    H    THR 114           H        THR 114  17.234  -4.722   2.233
  808    HA   THR 114           HA       THR 114  18.102  -2.782   4.275
  809    HB   THR 114           HB       THR 114  20.197  -4.642   3.616
  810    HG1  THR 114           1HG      THR 114  18.194  -5.969   3.312
  811   1HG2  THR 114          1HG2      THR 114  19.082  -4.823   6.292
  812   2HG2  THR 114          2HG2      THR 114  19.326  -3.153   5.782
  813   3HG2  THR 114          3HG2      THR 114  20.678  -4.284   5.770
  814    H    VAL 115           H        VAL 115  20.171  -1.743   3.840
  815    HA   VAL 115           HA       VAL 115  20.853  -1.582   0.982
  816    HB   VAL 115           HB       VAL 115  20.688   0.802   2.815
  817   1HG1  VAL 115          1HG1      VAL 115  22.328   0.831   0.898
  818   2HG1  VAL 115          2HG1      VAL 115  21.142   2.137   0.924
  819   3HG1  VAL 115          3HG1      VAL 115  20.931   0.776  -0.179
  820   1HG2  VAL 115          1HG2      VAL 115  18.788   1.318   1.014
  821   2HG2  VAL 115          2HG2      VAL 115  18.458   0.474   2.530
  822   3HG2  VAL 115          3HG2      VAL 115  18.675  -0.444   1.039
  823    H    SER 116           H        SER 116  22.780  -2.563   1.044
  824    HA   SER 116           HA       SER 116  24.823  -1.463   2.856
  825   1HB   SER 116          2HB       SER 116  25.821  -3.618   3.091
  826   2HB   SER 116          1HB       SER 116  24.095  -3.848   3.355
  827    HG   SER 116           HG       SER 116  25.688  -4.612   1.179
  828    H    SER 117           H        SER 117  27.077  -1.774   2.009
  829    HA   SER 117           HA       SER 117  27.135  -0.943  -0.776
  830   1HB   SER 117          2HB       SER 117  29.567  -0.495  -0.279
  831   2HB   SER 117          1HB       SER 117  28.431   0.407   0.726
  832    HG   SER 117           HG       SER 117  30.327  -0.817   1.718
  833    H    GLN 118           H        GLN 118  27.470  -3.793   0.960
  834    HA   GLN 118           HA       GLN 118  28.490  -5.814   0.599
  835   1HB   GLN 118          2HB       GLN 118  27.811  -6.822  -1.526
  836   2HB   GLN 118          1HB       GLN 118  26.498  -5.913  -0.794
  837   1HG   GLN 118          2HG       GLN 118  27.536  -4.018  -2.386
  838   2HG   GLN 118          1HG       GLN 118  27.949  -5.458  -3.313
  839   1HE2  GLN 118          1HE2      GLN 118  25.145  -4.943  -1.249
  840   2HE2  GLN 118          2HE2      GLN 118  23.965  -5.074  -2.504
  841    H    SER 119           H        SER 119  29.464  -6.764  -2.014
  842    HA   SER 119           HA       SER 119  31.895  -5.183  -2.391
  843   1HB   SER 119          2HB       SER 119  32.808  -7.824  -2.411
  844   2HB   SER 119          1HB       SER 119  33.119  -6.615  -1.167
  845    HG   SER 119           HG       SER 119  32.201  -8.505  -0.284
  846    H    GLU 120           H        GLU 120  29.537  -5.670  -4.027
  847    HA   GLU 120           HA       GLU 120  30.297  -7.532  -6.087
  848   1HB   GLU 120          2HB       GLU 120  28.088  -5.479  -5.923
  849   2HB   GLU 120          1HB       GLU 120  28.310  -6.566  -7.287
  850   1HG   GLU 120          2HG       GLU 120  28.267  -8.006  -4.784
  851   2HG   GLU 120          1HG       GLU 120  26.813  -7.032  -5.001
  852    H    GLN 121           H        GLN 121  30.122  -6.628  -8.447
  853    HA   GLN 121           HA       GLN 121  31.261  -4.006  -8.826
  854   1HB   GLN 121          2HB       GLN 121  33.053  -6.050  -8.366
  855   2HB   GLN 121          1HB       GLN 121  32.983  -5.982 -10.121
  856   1HG   GLN 121          2HG       GLN 121  33.403  -3.517  -8.478
  857   2HG   GLN 121          1HG       GLN 121  34.743  -4.571  -8.924
  858   1HE2  GLN 121          1HE2      GLN 121  35.377  -4.702 -11.070
  859   2HE2  GLN 121          2HE2      GLN 121  34.871  -3.551 -12.256
  860    H    LYS 122           H        LYS 122  30.159  -7.063 -10.106
  861    HA   LYS 122           HA       LYS 122  29.664  -5.768 -12.707
  862   1HB   LYS 122          2HB       LYS 122  31.101  -8.013 -12.313
  863   2HB   LYS 122          1HB       LYS 122  29.500  -8.718 -12.490
  864   1HG   LYS 122          2HG       LYS 122  29.398  -7.187 -14.613
  865   2HG   LYS 122          1HG       LYS 122  31.156  -7.247 -14.476
  866   1HD   LYS 122          2HD       LYS 122  31.236  -9.350 -15.230
  867   2HD   LYS 122          1HD       LYS 122  29.928  -9.863 -14.161
  868   1HE   LYS 122          2HE       LYS 122  28.482  -9.860 -15.849
  869   2HE   LYS 122          1HE       LYS 122  28.883  -8.188 -16.239
  870   1HZ   LYS 122          1HZ       LYS 122  30.976  -9.822 -17.124
  871   2HZ   LYS 122          2HZ       LYS 122  29.905  -8.900 -18.053
  872   3HZ   LYS 122          3HZ       LYS 122  29.528 -10.503 -17.672
  873    H    LEU 123           H        LEU 123  27.694  -6.481 -13.845
  874    HA   LEU 123           HA       LEU 123  25.590  -7.751 -12.398
  875   1HB   LEU 123          2HB       LEU 123  25.930  -5.026 -11.882
  876   2HB   LEU 123          1HB       LEU 123  24.592  -5.106 -13.013
  877    HG   LEU 123           HG       LEU 123  24.689  -6.723 -10.473
  878   1HD1  LEU 123          1HD1      LEU 123  23.446  -5.078  -9.363
  879   2HD1  LEU 123          2HD1      LEU 123  23.123  -4.192 -10.854
  880   3HD1  LEU 123          3HD1      LEU 123  24.745  -4.192 -10.162
  881   1HD2  LEU 123          1HD2      LEU 123  22.086  -6.348 -11.092
  882   2HD2  LEU 123          2HD2      LEU 123  23.032  -7.749 -11.599
  883   3HD2  LEU 123          3HD2      LEU 123  22.800  -6.393 -12.703
  884    H    ILE 124           H        ILE 124  26.080  -8.834 -14.513
  885    HA   ILE 124           HA       ILE 124  25.540  -9.383 -16.656
  886    HB   ILE 124           HB       ILE 124  23.033  -7.789 -16.118
  887   1HG1  ILE 124          2HG1      ILE 124  23.595 -10.702 -15.518
  888   2HG1  ILE 124          1HG1      ILE 124  23.547  -9.421 -14.311
  889   1HG2  ILE 124          1HG2      ILE 124  22.241  -8.586 -18.040
  890   2HG2  ILE 124          2HG2      ILE 124  22.763 -10.225 -17.655
  891   3HG2  ILE 124          3HG2      ILE 124  23.887  -9.097 -18.414
  892   1HD1  ILE 124          1HD1      ILE 124  21.139  -9.341 -15.827
  893   2HD1  ILE 124          2HD1      ILE 124  21.364  -9.673 -14.110
  894   3HD1  ILE 124          3HD1      ILE 124  21.424 -10.993 -15.278
  895    H    SER 125           H        SER 125  23.586  -6.529 -17.065
  896    HA   SER 125           HA       SER 125  23.719  -4.772 -18.496
  897   1HB   SER 125          2HB       SER 125  25.466  -3.368 -18.107
  898   2HB   SER 125          1HB       SER 125  25.850  -4.540 -16.848
  899    HG   SER 125           HG       SER 125  27.379  -5.441 -18.149
  900    H    GLU 126           H        GLU 126  24.378  -7.655 -19.410
  901    HA   GLU 126           HA       GLU 126  24.764  -6.960 -22.169
  902   1HB   GLU 126          2HB       GLU 126  27.010  -7.900 -20.562
  903   2HB   GLU 126          1HB       GLU 126  26.708  -8.919 -21.963
  904   1HG   GLU 126          2HG       GLU 126  26.544  -6.352 -22.970
  905   2HG   GLU 126          1HG       GLU 126  27.867  -6.272 -21.807
  906    H    GLU 127           H        GLU 127  22.995  -8.454 -20.181
  907    HA   GLU 127           HA       GLU 127  21.649 -10.285 -20.144
  908   1HB   GLU 127          2HB       GLU 127  22.360 -10.102 -23.058
  909   2HB   GLU 127          1HB       GLU 127  21.315 -11.384 -22.461
  910   1HG   GLU 127          2HG       GLU 127  19.807  -9.651 -21.533
  911   2HG   GLU 127          1HG       GLU 127  20.820  -8.422 -22.287
  912    H    ASP 128           H        ASP 128  24.526 -10.616 -19.607
  913    HA   ASP 128           HA       ASP 128  26.005 -12.268 -19.117
  914   1HB   ASP 128          2HB       ASP 128  23.450 -13.372 -18.732
  915   2HB   ASP 128          1HB       ASP 128  24.368 -14.597 -19.603
  916    H    LEU 129           H        LEU 129  26.754 -14.593 -20.011
  917    HA   LEU 129           HA       LEU 129  26.994 -14.240 -22.924
  918   1HB   LEU 129          2HB       LEU 129  28.886 -15.461 -20.917
  919   2HB   LEU 129          1HB       LEU 129  29.105 -15.593 -22.653
  920    HG   LEU 129           HG       LEU 129  28.858 -12.897 -21.366
  921   1HD1  LEU 129          1HD1      LEU 129  30.603 -14.178 -20.151
  922   2HD1  LEU 129          2HD1      LEU 129  31.232 -12.792 -21.041
  923   3HD1  LEU 129          3HD1      LEU 129  31.437 -14.420 -21.686
  924   1HD2  LEU 129          1HD2      LEU 129  30.214 -13.931 -23.852
  925   2HD2  LEU 129          2HD2      LEU 129  30.264 -12.259 -23.291
  926   3HD2  LEU 129          3HD2      LEU 129  28.730 -12.982 -23.775
  927    H    ASN 130           H        ASN 130  25.796 -15.620 -24.037
  928    HA   ASN 130           HA       ASN 130  25.297 -18.294 -22.920
  929   1HB   ASN 130          2HB       ASN 130  23.728 -16.486 -24.708
  930   2HB   ASN 130          1HB       ASN 130  23.509 -18.226 -24.867
  931   1HD2  ASN 130          1HD2      ASN 130  22.134 -19.189 -23.550
  932   2HD2  ASN 130          2HD2      ASN 130  21.457 -18.497 -22.119
  933    H    HIS 131           H        HIS 131  25.566 -20.139 -24.179
  934    HA   HIS 131           HA       HIS 131  27.236 -19.760 -26.576
  935   1HB   HIS 131          2HB       HIS 131  27.703 -21.275 -24.213
  936   2HB   HIS 131          1HB       HIS 131  27.487 -22.411 -25.542
  937    HD1  HIS 131           1HD      HIS 131  29.727 -19.635 -24.370
  938    HD2  HIS 131           2HD      HIS 131  29.549 -22.471 -27.403
  939    HE1  HIS 131           1HE      HIS 131  31.986 -19.583 -25.474
  940    HE2  HIS 131           2HE      HIS 131  31.837 -21.264 -27.344
  941    H    HIS 132           H        HIS 132  27.189 -22.352 -27.535
  942    HA   HIS 132           HA       HIS 132  24.350 -22.913 -28.033
  943   1HB   HIS 132          2HB       HIS 132  26.460 -22.206 -30.014
  944   2HB   HIS 132          1HB       HIS 132  25.282 -23.432 -30.472
  945    HD1  HIS 132           1HD      HIS 132  25.429 -19.819 -29.350
  946    HD2  HIS 132           2HD      HIS 132  22.863 -22.451 -31.288
  947    HE1  HIS 132           1HE      HIS 132  23.522 -18.408 -30.183
  948    HE2  HIS 132           2HE      HIS 132  21.933 -20.038 -31.263
  949    H    HIS 133           H        HIS 133  23.907 -25.059 -28.798
  950    HA   HIS 133           HA       HIS 133  25.955 -26.982 -27.940
  951   1HB   HIS 133          2HB       HIS 133  23.824 -27.082 -26.716
  952   2HB   HIS 133          1HB       HIS 133  22.965 -27.347 -28.229
  953    HD1  HIS 133           1HD      HIS 133  26.163 -29.096 -27.231
  954    HD2  HIS 133           2HD      HIS 133  22.125 -29.917 -27.767
  955    HE1  HIS 133           1HE      HIS 133  25.956 -31.597 -27.056
  956    HE2  HIS 133           2HE      HIS 133  23.492 -32.063 -27.305
  957    H    HIS 134           H        HIS 134  23.254 -26.936 -30.276
  958    HA   HIS 134           HA       HIS 134  25.059 -27.840 -32.378
  959   1HB   HIS 134          2HB       HIS 134  23.211 -29.589 -31.002
  960   2HB   HIS 134          1HB       HIS 134  22.793 -29.464 -32.707
  961    HD1  HIS 134           1HD      HIS 134  26.388 -29.160 -31.953
  962    HD2  HIS 134           2HD      HIS 134  23.701 -32.177 -32.921
  963    HE1  HIS 134           1HE      HIS 134  27.802 -31.133 -32.610
  964    HE2  HIS 134           2HE      HIS 134  26.154 -32.919 -33.274
  965    H    HIS 135           H        HIS 135  23.540 -28.249 -34.448
  966    HA   HIS 135           HA       HIS 135  21.771 -25.898 -34.617
  967   1HB   HIS 135          2HB       HIS 135  22.404 -26.210 -37.180
  968   2HB   HIS 135          1HB       HIS 135  23.423 -25.284 -36.084
  969    HD1  HIS 135           1HD      HIS 135  23.327 -29.060 -36.355
  970    HD2  HIS 135           2HD      HIS 135  25.874 -25.874 -37.139
  971    HE1  HIS 135           1HE      HIS 135  25.529 -30.099 -36.983
  972    HE2  HIS 135           2HE      HIS 135  27.053 -28.152 -37.467
  Start of MODEL    8
    1   1H    ASP   1          1HT       ASP   1 -10.798  -8.143  10.111
    2   2H    ASP   1          2HT       ASP   1  -9.577  -7.618   9.065
    3   3H    ASP   1          3HT       ASP   1  -9.498  -9.163   9.746
    4    HA   ASP   1           HA       ASP   1 -11.488  -9.825   8.549
    5   1HB   ASP   1          2HB       ASP   1 -11.539  -6.949   8.102
    6   2HB   ASP   1          1HB       ASP   1 -11.734  -7.848   6.599
    7    H    VAL   2           H        VAL   2  -9.766  -7.600   6.410
    8    HA   VAL   2           HA       VAL   2  -8.835  -9.848   4.831
    9    HB   VAL   2           HB       VAL   2  -8.070  -8.175   3.220
   10   1HG1  VAL   2          1HG1      VAL   2 -10.262  -8.734   2.780
   11   2HG1  VAL   2          2HG1      VAL   2 -10.365  -6.981   2.945
   12   3HG1  VAL   2          3HG1      VAL   2 -10.856  -8.024   4.281
   13   1HG2  VAL   2          1HG2      VAL   2  -7.329  -6.431   4.710
   14   2HG2  VAL   2          2HG2      VAL   2  -8.978  -6.170   5.280
   15   3HG2  VAL   2          3HG2      VAL   2  -8.547  -5.781   3.614
   16    H    GLN   3           H        GLN   3  -6.799 -10.599   4.737
   17    HA   GLN   3           HA       GLN   3  -4.708  -9.087   6.157
   18   1HB   GLN   3          2HB       GLN   3  -5.733 -11.573   6.897
   19   2HB   GLN   3          1HB       GLN   3  -4.216 -11.947   6.088
   20   1HG   GLN   3          2HG       GLN   3  -3.911  -9.724   7.901
   21   2HG   GLN   3          1HG       GLN   3  -4.560 -11.144   8.723
   22   1HE2  GLN   3          1HE2      GLN   3  -1.841  -9.750   7.132
   23   2HE2  GLN   3          2HE2      GLN   3  -0.716 -11.017   7.472
   24    H    LEU   4           H        LEU   4  -2.659  -9.072   5.252
   25    HA   LEU   4           HA       LEU   4  -2.397 -10.379   2.628
   26   1HB   LEU   4          2HB       LEU   4  -0.986  -7.835   2.845
   27   2HB   LEU   4          1HB       LEU   4  -2.003  -8.447   1.554
   28    HG   LEU   4           HG       LEU   4  -3.158  -7.315   4.094
   29   1HD1  LEU   4          1HD1      LEU   4  -1.623  -5.739   2.710
   30   2HD1  LEU   4          2HD1      LEU   4  -3.211  -5.182   3.238
   31   3HD1  LEU   4          3HD1      LEU   4  -2.974  -5.727   1.577
   32   1HD2  LEU   4          1HD2      LEU   4  -5.161  -7.592   3.143
   33   2HD2  LEU   4          2HD2      LEU   4  -4.330  -8.732   2.083
   34   3HD2  LEU   4          3HD2      LEU   4  -4.591  -7.068   1.559
   35    H    GLN   5           H        GLN   5   0.039 -10.079   1.884
   36    HA   GLN   5           HA       GLN   5   1.877 -10.366   4.132
   37   1HB   GLN   5          2HB       GLN   5   2.612 -12.431   2.366
   38   2HB   GLN   5          1HB       GLN   5   1.999 -12.590   4.005
   39   1HG   GLN   5          2HG       GLN   5  -0.201 -12.146   2.258
   40   2HG   GLN   5          1HG       GLN   5   0.806 -13.430   1.590
   41   1HE2  GLN   5          1HE2      GLN   5  -0.252 -15.239   2.057
   42   2HE2  GLN   5          2HE2      GLN   5  -0.779 -15.714   3.632
   43    H    ALA   6           H        ALA   6   3.624  -9.196   3.732
   44    HA   ALA   6           HA       ALA   6   4.247  -8.492   0.955
   45   1HB   ALA   6          1HB       ALA   6   4.407  -7.099   3.493
   46   2HB   ALA   6          2HB       ALA   6   4.376  -6.458   1.850
   47   3HB   ALA   6          3HB       ALA   6   5.901  -6.979   2.565
   48    H    SER   7           H        SER   7   6.281  -8.743   0.071
   49    HA   SER   7           HA       SER   7   8.528  -9.731   1.496
   50   1HB   SER   7          2HB       SER   7   7.060 -11.783   1.410
   51   2HB   SER   7          1HB       SER   7   7.215 -11.739  -0.346
   52    HG   SER   7           HG       SER   7   9.609 -11.578   0.985
   53    H    GLY   8           H        GLY   8  10.164 -10.706  -0.264
   54   1HA   GLY   8          2HA       GLY   8  10.914 -10.551  -2.547
   55   2HA   GLY   8          1HA       GLY   8   9.880  -9.145  -2.745
   56    H    GLY   9           H        GLY   9  10.917  -8.268   0.022
   57   1HA   GLY   9          2HA       GLY   9  12.717  -6.344  -0.787
   58   2HA   GLY   9          1HA       GLY   9  12.592  -6.942   0.861
   59    H    GLY  10           H        GLY  10  14.993  -6.070  -0.222
   60   1HA   GLY  10          2HA       GLY  10  16.651  -8.341   0.281
   61   2HA   GLY  10          1HA       GLY  10  16.647  -7.922  -1.425
   62    H    LEU  11           H        LEU  11  19.015  -7.734  -0.702
   63    HA   LEU  11           HA       LEU  11  19.589  -5.125   0.490
   64   1HB   LEU  11          2HB       LEU  11  21.629  -7.178  -0.317
   65   2HB   LEU  11          1HB       LEU  11  21.795  -5.879   0.849
   66    HG   LEU  11           HG       LEU  11  20.043  -8.310   1.216
   67   1HD1  LEU  11          1HD1      LEU  11  22.874  -7.805   1.767
   68   2HD1  LEU  11          2HD1      LEU  11  21.996  -9.327   1.627
   69   3HD1  LEU  11          3HD1      LEU  11  21.958  -8.423   3.141
   70   1HD2  LEU  11          1HD2      LEU  11  20.304  -5.779   2.632
   71   2HD2  LEU  11          2HD2      LEU  11  20.521  -7.187   3.673
   72   3HD2  LEU  11          3HD2      LEU  11  19.041  -7.008   2.727
   73    H    VAL  12           H        VAL  12  20.176  -3.429  -0.695
   74    HA   VAL  12           HA       VAL  12  20.845  -3.878  -3.532
   75    HB   VAL  12           HB       VAL  12  19.811  -1.880  -4.118
   76   1HG1  VAL  12          1HG1      VAL  12  18.358  -3.491  -2.147
   77   2HG1  VAL  12          2HG1      VAL  12  17.901  -3.006  -3.780
   78   3HG1  VAL  12          3HG1      VAL  12  17.683  -1.887  -2.435
   79   1HG2  VAL  12          1HG2      VAL  12  19.311  -0.049  -2.673
   80   2HG2  VAL  12          2HG2      VAL  12  20.969  -0.545  -2.327
   81   3HG2  VAL  12          3HG2      VAL  12  19.662  -1.009  -1.235
   82    H    GLN  13           H        GLN  13  21.891  -1.595  -4.319
   83    HA   GLN  13           HA       GLN  13  24.302  -1.283  -2.665
   84   1HB   GLN  13          2HB       GLN  13  24.486  -0.208  -5.367
   85   2HB   GLN  13          1HB       GLN  13  25.554  -1.326  -4.532
   86   1HG   GLN  13          2HG       GLN  13  24.783  -3.026  -5.714
   87   2HG   GLN  13          1HG       GLN  13  23.123  -2.661  -5.246
   88   1HE2  GLN  13          1HE2      GLN  13  22.080  -2.915  -7.131
   89   2HE2  GLN  13          2HE2      GLN  13  22.413  -2.015  -8.568
   90    HA   PRO  14           HA       PRO  14  22.855   2.699  -1.294
   91   1HB   PRO  14          2HB       PRO  14  25.758   3.220  -1.860
   92   2HB   PRO  14          1HB       PRO  14  24.770   3.770  -0.500
   93   1HG   PRO  14          2HG       PRO  14  26.379   1.647  -0.259
   94   2HG   PRO  14          1HG       PRO  14  24.800   1.701   0.537
   95   1HD   PRO  14          2HD       PRO  14  25.692   0.074  -1.751
   96   2HD   PRO  14          1HD       PRO  14  24.318  -0.176  -0.656
   97    H    GLY  15           H        GLY  15  21.560   3.232  -3.071
   98   1HA   GLY  15          2HA       GLY  15  21.278   5.209  -4.472
   99   2HA   GLY  15          1HA       GLY  15  22.902   4.924  -5.084
  100    H    GLY  16           H        GLY  16  21.051   2.091  -4.641
  101   1HA   GLY  16          2HA       GLY  16  20.793   1.833  -7.547
  102   2HA   GLY  16          1HA       GLY  16  20.747   0.517  -6.386
  103    H    SER  17           H        SER  17  18.840  -0.436  -6.679
  104    HA   SER  17           HA       SER  17  16.441   1.002  -6.008
  105   1HB   SER  17          2HB       SER  17  15.603  -0.211  -8.373
  106   2HB   SER  17          1HB       SER  17  15.835   1.517  -8.112
  107    HG   SER  17           HG       SER  17  17.076   0.987  -9.851
  108    H    LEU  18           H        LEU  18  14.581  -0.426  -5.782
  109    HA   LEU  18           HA       LEU  18  15.053  -3.283  -5.936
  110   1HB   LEU  18          2HB       LEU  18  15.812  -2.103  -3.623
  111   2HB   LEU  18          1HB       LEU  18  14.128  -2.431  -3.262
  112    HG   LEU  18           HG       LEU  18  16.296  -4.417  -3.916
  113   1HD1  LEU  18          1HD1      LEU  18  16.204  -5.025  -1.747
  114   2HD1  LEU  18          2HD1      LEU  18  14.473  -4.710  -1.618
  115   3HD1  LEU  18          3HD1      LEU  18  15.622  -3.374  -1.544
  116   1HD2  LEU  18          1HD2      LEU  18  13.312  -4.815  -3.844
  117   2HD2  LEU  18          2HD2      LEU  18  14.468  -6.133  -3.648
  118   3HD2  LEU  18          3HD2      LEU  18  14.432  -5.209  -5.150
  119    H    ARG  19           H        ARG  19  13.244  -4.236  -6.576
  120    HA   ARG  19           HA       ARG  19  10.698  -2.829  -6.153
  121   1HB   ARG  19          2HB       ARG  19  11.108  -3.190  -8.485
  122   2HB   ARG  19          1HB       ARG  19  11.535  -4.873  -8.212
  123   1HG   ARG  19          2HG       ARG  19   9.205  -5.309  -7.502
  124   2HG   ARG  19          1HG       ARG  19   8.804  -3.640  -7.910
  125   1HD   ARG  19          2HD       ARG  19   8.660  -4.110 -10.085
  126   2HD   ARG  19          1HD       ARG  19  10.184  -4.995 -10.072
  127    HE   ARG  19           HE       ARG  19   7.559  -6.151  -9.395
  128   1HH1  ARG  19          1HH1      ARG  19  10.840  -6.459 -10.523
  129   2HH1  ARG  19          2HH1      ARG  19  10.676  -8.131 -10.943
  130   1HH2  ARG  19          1HH2      ARG  19   7.329  -8.350  -9.946
  131   2HH2  ARG  19          2HH2      ARG  19   8.678  -9.207 -10.615
  132    H    VAL  20           H        VAL  20   9.363  -3.609  -4.680
  133    HA   VAL  20           HA       VAL  20   9.620  -6.448  -3.933
  134    HB   VAL  20           HB       VAL  20   9.084  -5.942  -1.695
  135   1HG1  VAL  20          1HG1      VAL  20  10.811  -3.622  -2.514
  136   2HG1  VAL  20          2HG1      VAL  20  11.381  -5.291  -2.503
  137   3HG1  VAL  20          3HG1      VAL  20  10.848  -4.530  -1.004
  138   1HG2  VAL  20          1HG2      VAL  20   7.255  -4.424  -1.976
  139   2HG2  VAL  20          2HG2      VAL  20   8.311  -3.196  -2.673
  140   3HG2  VAL  20          3HG2      VAL  20   8.464  -3.629  -0.970
  141    H    SER  21           H        SER  21   7.598  -7.444  -3.095
  142    HA   SER  21           HA       SER  21   5.164  -6.218  -4.172
  143   1HB   SER  21          2HB       SER  21   4.501  -8.197  -5.340
  144   2HB   SER  21          1HB       SER  21   6.155  -7.843  -5.838
  145    HG   SER  21           HG       SER  21   6.743  -9.686  -5.040
  146    H    CYS  22           H        CYS  22   3.184  -7.237  -3.395
  147    HA   CYS  22           HA       CYS  22   3.503  -8.697  -0.868
  148   1HB   CYS  22          2HB       CYS  22   3.169  -6.314  -0.346
  149   2HB   CYS  22          1HB       CYS  22   1.691  -6.313  -1.301
  150    H    ALA  23           H        ALA  23   2.504 -10.574  -1.127
  151    HA   ALA  23           HA       ALA  23   0.396 -10.873  -3.073
  152   1HB   ALA  23          1HB       ALA  23   0.491 -13.301  -2.168
  153   2HB   ALA  23          2HB       ALA  23   1.963 -12.755  -1.365
  154   3HB   ALA  23          3HB       ALA  23   1.836 -12.676  -3.122
  155    H    ALA  24           H        ALA  24  -1.372  -9.760  -2.272
  156    HA   ALA  24           HA       ALA  24  -2.455 -10.519   0.332
  157   1HB   ALA  24          1HB       ALA  24  -4.125  -8.734  -0.133
  158   2HB   ALA  24          2HB       ALA  24  -3.304  -8.421  -1.661
  159   3HB   ALA  24          3HB       ALA  24  -2.456  -8.162  -0.137
  160    H    SER  25           H        SER  25  -5.002 -10.683   0.269
  161    HA   SER  25           HA       SER  25  -6.327 -11.703  -1.966
  162   1HB   SER  25          2HB       SER  25  -4.553 -13.604  -0.725
  163   2HB   SER  25          1HB       SER  25  -6.223 -14.142  -0.551
  164    HG   SER  25           HG       SER  25  -5.838 -14.852  -2.516
  165    H    GLY  26           H        GLY  26  -8.338 -11.123  -1.443
  166   1HA   GLY  26          2HA       GLY  26 -10.137 -12.175   0.109
  167   2HA   GLY  26          1HA       GLY  26  -9.185 -11.393   1.357
  168    H    PHE  27           H        PHE  27  -9.009  -9.396  -1.290
  169    HA   PHE  27           HA       PHE  27 -11.587  -8.148  -0.945
  170   1HB   PHE  27          2HB       PHE  27 -10.965  -6.193   0.132
  171   2HB   PHE  27          1HB       PHE  27 -10.033  -7.412   0.983
  172    HD1  PHE  27           1HD      PHE  27  -7.751  -7.808  -0.876
  173    HD2  PHE  27           2HD      PHE  27  -9.759  -4.259   0.348
  174    HE1  PHE  27           1HE      PHE  27  -5.710  -6.503  -1.308
  175    HE2  PHE  27           2HE      PHE  27  -7.726  -2.952  -0.086
  176    HZ   PHE  27           HZ       PHE  27  -5.702  -4.069  -0.923
  177    H    THR  28           H        THR  28  -8.534  -8.366  -2.565
  178    HA   THR  28           HA       THR  28  -7.860  -7.764  -4.656
  179    HB   THR  28           HB       THR  28 -10.734  -7.120  -5.302
  180    HG1  THR  28           1HG      THR  28 -11.187  -9.153  -4.978
  181   1HG2  THR  28          1HG2      THR  28  -9.920  -8.261  -7.488
  182   2HG2  THR  28          2HG2      THR  28  -8.305  -7.920  -6.866
  183   3HG2  THR  28          3HG2      THR  28  -9.437  -6.597  -7.159
  184    H    PHE  29           H        PHE  29  -7.610  -5.919  -6.148
  185    HA   PHE  29           HA       PHE  29  -8.011  -3.383  -4.717
  186   1HB   PHE  29          2HB       PHE  29  -6.180  -3.573  -7.061
  187   2HB   PHE  29          1HB       PHE  29  -6.043  -2.592  -5.608
  188    HD1  PHE  29           1HD      PHE  29  -5.898  -4.201  -3.391
  189    HD2  PHE  29           2HD      PHE  29  -4.547  -5.129  -7.317
  190    HE1  PHE  29           1HE      PHE  29  -4.297  -5.815  -2.453
  191    HE2  PHE  29           2HE      PHE  29  -2.944  -6.745  -6.386
  192    HZ   PHE  29           HZ       PHE  29  -2.818  -7.091  -3.951
  193    H    SER  30           H        SER  30  -7.460  -1.713  -6.930
  194    HA   SER  30           HA       SER  30  -8.458  -0.593  -8.628
  195   1HB   SER  30          2HB       SER  30  -8.555  -2.055 -10.335
  196   2HB   SER  30          1HB       SER  30  -8.947  -3.395  -9.259
  197    HG   SER  30           HG       SER  30 -10.543  -2.349 -10.969
  198    H    SER  31           H        SER  31 -10.097  -1.950  -6.085
  199    HA   SER  31           HA       SER  31 -12.404  -0.195  -6.529
  200   1HB   SER  31          2HB       SER  31 -12.461  -3.078  -5.620
  201   2HB   SER  31          1HB       SER  31 -13.801  -1.967  -5.333
  202    HG   SER  31           HG       SER  31 -14.365  -2.713  -7.244
  203    H    TYR  32           H        TYR  32 -10.116  -1.727  -4.429
  204    HA   TYR  32           HA       TYR  32 -11.118  -0.189  -2.131
  205   1HB   TYR  32          2HB       TYR  32  -9.562  -2.734  -2.394
  206   2HB   TYR  32          1HB       TYR  32  -9.355  -1.752  -0.949
  207    HD1  TYR  32           1HD      TYR  32 -11.659  -1.006   0.176
  208    HD2  TYR  32           2HD      TYR  32 -11.158  -4.386  -2.357
  209    HE1  TYR  32           1HE      TYR  32 -13.663  -2.036   1.162
  210    HE2  TYR  32           2HE      TYR  32 -13.159  -5.424  -1.382
  211    HH   TYR  32           HH       TYR  32 -14.399  -5.136   1.015
  212    H    HIS  33           H        HIS  33  -9.258   0.503  -0.627
  213    HA   HIS  33           HA       HIS  33  -7.254   1.855  -2.288
  214   1HB   HIS  33          2HB       HIS  33  -8.790   2.612   0.060
  215   2HB   HIS  33          1HB       HIS  33  -7.066   2.869   0.307
  216    HD1  HIS  33           1HD      HIS  33  -5.898   4.627  -1.212
  217    HD2  HIS  33           2HD      HIS  33 -10.004   4.325  -1.775
  218    HE1  HIS  33           1HE      HIS  33  -6.542   6.648  -2.563
  219    HE2  HIS  33           2HE      HIS  33  -9.027   6.427  -2.922
  220    H    MET  34           H        MET  34  -5.130   1.420  -2.101
  221    HA   MET  34           HA       MET  34  -4.269  -0.307   0.126
  222   1HB   MET  34          2HB       MET  34  -3.998  -0.711  -2.782
  223   2HB   MET  34          1HB       MET  34  -2.528  -0.979  -1.854
  224   1HG   MET  34          2HG       MET  34  -5.138  -2.260  -1.124
  225   2HG   MET  34          1HG       MET  34  -4.014  -2.986  -2.273
  226   1HE   MET  34          1HE       MET  34  -1.887  -5.030  -0.328
  227   2HE   MET  34          2HE       MET  34  -2.886  -4.691  -1.741
  228   3HE   MET  34          3HE       MET  34  -3.619  -5.365  -0.285
  229    H    ALA  35           H        ALA  35  -1.810  -0.285   0.350
  230    HA   ALA  35           HA       ALA  35  -0.435   2.032  -0.627
  231   1HB   ALA  35          1HB       ALA  35  -1.934   2.261   1.801
  232   2HB   ALA  35          2HB       ALA  35  -0.995   3.485   0.947
  233   3HB   ALA  35          3HB       ALA  35  -0.212   2.446   2.137
  234    H    TRP  36           H        TRP  36   1.761   2.048  -0.170
  235    HA   TRP  36           HA       TRP  36   2.808  -0.464   0.939
  236   1HB   TRP  36          2HB       TRP  36   3.663   1.347  -1.246
  237   2HB   TRP  36          1HB       TRP  36   4.956   0.676  -0.258
  238    HD1  TRP  36           HD       TRP  36   2.859  -0.128  -3.181
  239    HE1  TRP  36           1HE      TRP  36   3.126  -2.599  -3.842
  240    HE3  TRP  36           3HE      TRP  36   5.262  -1.818   1.001
  241    HZ2  TRP  36           2HZ      TRP  36   4.223  -4.958  -2.729
  242    HZ3  TRP  36           3HZ      TRP  36   5.885  -4.195   1.124
  243    HH2  TRP  36           HH       TRP  36   5.376  -5.732  -0.704
  244    H    VAL  37           H        VAL  37   3.309  -0.229   3.020
  245    HA   VAL  37           HA       VAL  37   4.330   2.351   3.965
  246    HB   VAL  37           HB       VAL  37   3.570   1.805   6.111
  247   1HG1  VAL  37          1HG1      VAL  37   1.600   0.468   4.266
  248   2HG1  VAL  37          2HG1      VAL  37   1.756   2.210   4.482
  249   3HG1  VAL  37          3HG1      VAL  37   1.251   1.195   5.833
  250   1HG2  VAL  37          1HG2      VAL  37   4.150  -0.224   6.851
  251   2HG2  VAL  37          2HG2      VAL  37   4.049  -0.943   5.243
  252   3HG2  VAL  37          3HG2      VAL  37   2.590  -0.744   6.214
  253    H    ARG  38           H        ARG  38   5.933   2.285   5.734
  254    HA   ARG  38           HA       ARG  38   7.803   0.046   5.634
  255   1HB   ARG  38          2HB       ARG  38   8.845   1.324   4.001
  256   2HB   ARG  38          1HB       ARG  38   8.344   2.844   4.722
  257   1HG   ARG  38          2HG       ARG  38   9.953   2.055   6.658
  258   2HG   ARG  38          1HG       ARG  38  10.678   1.123   5.345
  259   1HD   ARG  38          2HD       ARG  38  11.800   3.243   5.505
  260   2HD   ARG  38          1HD       ARG  38  10.846   3.211   4.022
  261    HE   ARG  38           HE       ARG  38   9.158   4.388   5.737
  262   1HH1  ARG  38          1HH1      ARG  38  12.523   4.970   5.039
  263   2HH1  ARG  38          2HH1      ARG  38  12.437   6.662   5.394
  264   1HH2  ARG  38          1HH2      ARG  38   9.037   6.616   6.209
  265   2HH2  ARG  38          2HH2      ARG  38  10.456   7.599   6.061
  266    H    GLN  39           H        GLN  39   9.133  -0.116   7.467
  267    HA   GLN  39           HA       GLN  39   8.662   1.823   9.614
  268   1HB   GLN  39          2HB       GLN  39   7.113   0.024  10.044
  269   2HB   GLN  39          1HB       GLN  39   8.379  -1.176   9.819
  270   1HG   GLN  39          2HG       GLN  39   9.372  -0.701  11.854
  271   2HG   GLN  39          1HG       GLN  39   8.631   0.896  11.957
  272   1HE2  GLN  39          1HE2      GLN  39   6.844   1.115  13.124
  273   2HE2  GLN  39          2HE2      GLN  39   5.890  -0.181  13.753
  274    H    ALA  40           H        ALA  40  10.592   2.609  10.131
  275    HA   ALA  40           HA       ALA  40  13.017   1.142   9.642
  276   1HB   ALA  40          1HB       ALA  40  12.636   3.686   9.452
  277   2HB   ALA  40          2HB       ALA  40  14.157   3.110  10.135
  278   3HB   ALA  40          3HB       ALA  40  12.879   3.699  11.199
  279    HA   PRO  41           HA       PRO  41  13.684  -0.968  13.452
  280   1HB   PRO  41          2HB       PRO  41  16.347   0.383  13.500
  281   2HB   PRO  41          1HB       PRO  41  15.952  -1.331  13.671
  282   1HG   PRO  41          2HG       PRO  41  16.953  -0.401  11.391
  283   2HG   PRO  41          1HG       PRO  41  15.676  -1.631  11.385
  284   1HD   PRO  41          2HD       PRO  41  15.502   1.286  10.790
  285   2HD   PRO  41          1HD       PRO  41  14.608  -0.070  10.073
  286    H    GLY  42           H        GLY  42  12.280   0.070  14.854
  287   1HA   GLY  42          2HA       GLY  42  12.015   1.082  16.956
  288   2HA   GLY  42          1HA       GLY  42  13.543   1.918  16.723
  289    H    LYS  43           H        LYS  43  10.582   1.791  14.751
  290    HA   LYS  43           HA       LYS  43  10.287   4.693  15.128
  291   1HB   LYS  43          2HB       LYS  43  11.218   3.550  12.795
  292   2HB   LYS  43          1HB       LYS  43   9.502   3.747  12.474
  293   1HG   LYS  43          2HG       LYS  43   9.710   6.135  13.117
  294   2HG   LYS  43          1HG       LYS  43  11.453   5.896  13.262
  295   1HD   LYS  43          2HD       LYS  43  10.687   4.844  10.761
  296   2HD   LYS  43          1HD       LYS  43   9.891   6.411  10.920
  297   1HE   LYS  43          2HE       LYS  43  12.232   7.214  11.720
  298   2HE   LYS  43          1HE       LYS  43  12.809   5.752  10.920
  299   1HZ   LYS  43          1HZ       LYS  43  11.148   6.871   9.085
  300   2HZ   LYS  43          2HZ       LYS  43  12.835   6.993   9.087
  301   3HZ   LYS  43          3HZ       LYS  43  11.900   8.220   9.777
  302    H    GLY  44           H        GLY  44   8.080   5.001  13.417
  303   1HA   GLY  44          2HA       GLY  44   6.054   3.314  14.754
  304   2HA   GLY  44          1HA       GLY  44   5.834   5.040  14.512
  305    H    LEU  45           H        LEU  45   7.365   3.178  12.034
  306    HA   LEU  45           HA       LEU  45   6.764   2.589   9.926
  307   1HB   LEU  45          2HB       LEU  45   5.070   1.241  11.213
  308   2HB   LEU  45          1HB       LEU  45   3.925   2.541  10.938
  309    HG   LEU  45           HG       LEU  45   5.170   1.592   8.472
  310   1HD1  LEU  45          1HD1      LEU  45   4.508  -0.582   8.418
  311   2HD1  LEU  45          2HD1      LEU  45   3.218  -0.338   9.596
  312   3HD1  LEU  45          3HD1      LEU  45   4.894  -0.451  10.134
  313   1HD2  LEU  45          1HD2      LEU  45   2.671   1.376   7.929
  314   2HD2  LEU  45          2HD2      LEU  45   3.316   2.988   8.244
  315   3HD2  LEU  45          3HD2      LEU  45   2.406   2.141   9.496
  316    H    GLU  46           H        GLU  46   5.469   3.273   8.008
  317    HA   GLU  46           HA       GLU  46   4.188   5.855   8.117
  318   1HB   GLU  46          2HB       GLU  46   6.433   6.657   8.029
  319   2HB   GLU  46          1HB       GLU  46   6.884   5.468   6.818
  320   1HG   GLU  46          2HG       GLU  46   6.503   6.988   5.265
  321   2HG   GLU  46          1HG       GLU  46   4.791   6.932   5.687
  322    H    TRP  47           H        TRP  47   2.590   5.845   6.664
  323    HA   TRP  47           HA       TRP  47   2.006   3.692   5.030
  324   1HB   TRP  47          2HB       TRP  47   0.074   4.813   4.978
  325   2HB   TRP  47          1HB       TRP  47   0.867   6.254   5.597
  326    HD1  TRP  47           HD       TRP  47   0.336   4.548   2.140
  327    HE1  TRP  47           1HE      TRP  47   0.027   6.407   0.389
  328    HE3  TRP  47           3HE      TRP  47   0.981   8.625   5.159
  329    HZ2  TRP  47           2HZ      TRP  47   0.035   9.226   0.302
  330    HZ3  TRP  47           3HZ      TRP  47   0.807  10.868   4.162
  331    HH2  TRP  47           HH       TRP  47   0.342  11.158   1.782
  332    H    VAL  48           H        VAL  48   4.094   6.375   4.441
  333    HA   VAL  48           HA       VAL  48   5.473   6.933   2.735
  334    HB   VAL  48           HB       VAL  48   5.178   3.983   2.239
  335   1HG1  VAL  48          1HG1      VAL  48   6.090   5.927   0.341
  336   2HG1  VAL  48          2HG1      VAL  48   5.977   4.175   0.173
  337   3HG1  VAL  48          3HG1      VAL  48   7.438   4.905   0.841
  338   1HG2  VAL  48          1HG2      VAL  48   6.707   3.934   3.858
  339   2HG2  VAL  48          2HG2      VAL  48   6.894   5.689   3.819
  340   3HG2  VAL  48          3HG2      VAL  48   7.833   4.677   2.719
  341    H    SER  49           H        SER  49   3.561   4.528   0.890
  342    HA   SER  49           HA       SER  49   2.549   6.770  -0.739
  343   1HB   SER  49          2HB       SER  49   2.981   5.472  -2.786
  344   2HB   SER  49          1HB       SER  49   4.467   5.814  -1.901
  345    HG   SER  49           HG       SER  49   4.754   3.741  -2.000
  346    H    THR  50           H        THR  50   0.603   6.487  -1.798
  347    HA   THR  50           HA       THR  50  -0.932   4.051  -1.206
  348    HB   THR  50           HB       THR  50  -1.621   6.854  -0.452
  349    HG1  THR  50           1HG      THR  50  -2.914   5.012   0.942
  350   1HG2  THR  50          1HG2      THR  50  -3.749   4.849  -1.205
  351   2HG2  THR  50          2HG2      THR  50  -3.328   6.272  -2.158
  352   3HG2  THR  50          3HG2      THR  50  -4.004   6.462  -0.540
  353    H    ILE  51           H        ILE  51  -2.447   3.483  -2.773
  354    HA   ILE  51           HA       ILE  51  -2.393   5.115  -5.223
  355    HB   ILE  51           HB       ILE  51  -1.088   3.006  -5.413
  356   1HG1  ILE  51          2HG1      ILE  51  -3.408   2.611  -7.246
  357   2HG1  ILE  51          1HG1      ILE  51  -2.650   4.202  -7.253
  358   1HG2  ILE  51          1HG2      ILE  51  -3.338   1.233  -5.728
  359   2HG2  ILE  51          2HG2      ILE  51  -3.276   1.891  -4.093
  360   3HG2  ILE  51          3HG2      ILE  51  -1.879   1.041  -4.755
  361   1HD1  ILE  51          1HD1      ILE  51  -0.449   2.773  -7.474
  362   2HD1  ILE  51          2HD1      ILE  51  -1.438   3.178  -8.876
  363   3HD1  ILE  51          3HD1      ILE  51  -1.575   1.585  -8.132
  364    H    ASN  52           H        ASN  52  -4.289   5.421  -6.316
  365    HA   ASN  52           HA       ASN  52  -6.720   4.867  -4.825
  366   1HB   ASN  52          2HB       ASN  52  -6.136   7.117  -5.874
  367   2HB   ASN  52          1HB       ASN  52  -6.490   6.372  -7.430
  368   1HD2  ASN  52          1HD2      ASN  52  -7.848   7.174  -4.290
  369   2HD2  ASN  52          2HD2      ASN  52  -9.489   7.271  -4.820
  370    HA   PRO  53           HA       PRO  53  -8.166   1.296  -6.989
  371   1HB   PRO  53          2HB       PRO  53 -10.705   2.851  -7.233
  372   2HB   PRO  53          1HB       PRO  53 -10.451   1.195  -6.672
  373   1HG   PRO  53          2HG       PRO  53 -10.900   3.171  -4.940
  374   2HG   PRO  53          1HG       PRO  53  -9.753   1.871  -4.571
  375   1HD   PRO  53          2HD       PRO  53  -9.233   4.698  -5.324
  376   2HD   PRO  53          1HD       PRO  53  -8.281   3.607  -4.298
  377    H    GLY  54           H        GLY  54  -8.069   0.676  -9.068
  378   1HA   GLY  54          2HA       GLY  54  -8.524   0.792 -11.375
  379   2HA   GLY  54          1HA       GLY  54  -8.965   2.483 -11.180
  380    H    ASP  55           H        ASP  55  -6.152   1.987  -9.519
  381    HA   ASP  55           HA       ASP  55  -3.997   2.629  -9.847
  382   1HB   ASP  55          2HB       ASP  55  -4.690   0.990 -12.190
  383   2HB   ASP  55          1HB       ASP  55  -3.321   2.068 -12.443
  384    H    GLY  56           H        GLY  56  -4.544   4.863  -9.628
  385   1HA   GLY  56          2HA       GLY  56  -3.857   6.379 -11.995
  386   2HA   GLY  56          1HA       GLY  56  -5.486   6.656 -11.404
  387    H    SER  57           H        SER  57  -5.789   7.720  -9.417
  388    HA   SER  57           HA       SER  57  -4.004   9.783  -8.847
  389   1HB   SER  57          2HB       SER  57  -6.526   8.819  -7.796
  390   2HB   SER  57          1HB       SER  57  -5.477   9.382  -6.495
  391    HG   SER  57           HG       SER  57  -5.193  11.321  -7.818
  392    H    THR  58           H        THR  58  -2.417  10.090  -7.331
  393    HA   THR  58           HA       THR  58  -1.764   7.844  -5.561
  394    HB   THR  58           HB       THR  58   0.683   8.979  -6.511
  395    HG1  THR  58           1HG      THR  58  -0.298   9.449  -8.457
  396   1HG2  THR  58          1HG2      THR  58   1.056   6.874  -5.817
  397   2HG2  THR  58          2HG2      THR  58   0.603   6.425  -7.461
  398   3HG2  THR  58          3HG2      THR  58  -0.595   6.360  -6.169
  399    H    TYR  59           H        TYR  59  -0.871   8.379  -3.634
  400    HA   TYR  59           HA       TYR  59  -0.180  11.189  -3.137
  401   1HB   TYR  59          2HB       TYR  59  -1.605   9.736  -0.968
  402   2HB   TYR  59          1HB       TYR  59  -1.628  11.447  -1.376
  403    HD1  TYR  59           1HD      TYR  59  -3.131  12.281  -3.138
  404    HD2  TYR  59           2HD      TYR  59  -3.184   8.202  -1.928
  405    HE1  TYR  59           1HE      TYR  59  -5.306  11.987  -4.246
  406    HE2  TYR  59           2HE      TYR  59  -5.358   7.897  -3.036
  407    HH   TYR  59           HH       TYR  59  -7.328  10.345  -3.926
  408    H    TYR  60           H        TYR  60   1.623  11.455  -1.933
  409    HA   TYR  60           HA       TYR  60   2.754   9.052  -0.654
  410   1HB   TYR  60          2HB       TYR  60   4.145  11.261  -2.167
  411   2HB   TYR  60          1HB       TYR  60   5.002  10.122  -1.137
  412    HD1  TYR  60           1HD      TYR  60   2.493  10.049  -3.918
  413    HD2  TYR  60           2HD      TYR  60   5.956   8.299  -2.171
  414    HE1  TYR  60           1HE      TYR  60   2.635   8.467  -5.794
  415    HE2  TYR  60           2HE      TYR  60   6.106   6.715  -4.043
  416    HH   TYR  60           HH       TYR  60   5.261   6.779  -6.583
  417    H    ALA  61           H        ALA  61   4.400   9.589   1.055
  418    HA   ALA  61           HA       ALA  61   3.202  11.292   3.004
  419   1HB   ALA  61          1HB       ALA  61   4.300   9.933   4.374
  420   2HB   ALA  61          2HB       ALA  61   5.839  10.560   3.784
  421   3HB   ALA  61          3HB       ALA  61   5.087   9.178   2.988
  422    H    ASP  62           H        ASP  62   4.622  12.303   0.401
  423    HA   ASP  62           HA       ASP  62   5.525  14.286  -0.236
  424   1HB   ASP  62          2HB       ASP  62   5.724  15.031   2.682
  425   2HB   ASP  62          1HB       ASP  62   5.738  16.117   1.296
  426    H    SER  63           H        SER  63   7.050  12.333   2.174
  427    HA   SER  63           HA       SER  63   9.680  13.455   1.547
  428   1HB   SER  63          2HB       SER  63   8.518  12.296   3.893
  429   2HB   SER  63          1HB       SER  63   9.901  11.316   3.404
  430    HG   SER  63           HG       SER  63  10.201  14.090   3.397
  431    H    VAL  64           H        VAL  64   7.653  11.138   0.389
  432    HA   VAL  64           HA       VAL  64   9.895   9.440  -0.494
  433    HB   VAL  64           HB       VAL  64   7.921   7.768  -0.959
  434   1HG1  VAL  64          1HG1      VAL  64   9.375   8.337   1.583
  435   2HG1  VAL  64          2HG1      VAL  64   9.562   6.994   0.455
  436   3HG1  VAL  64          3HG1      VAL  64   8.174   7.046   1.541
  437   1HG2  VAL  64          1HG2      VAL  64   5.926   8.417  -0.230
  438   2HG2  VAL  64          2HG2      VAL  64   6.616   9.873   0.487
  439   3HG2  VAL  64          3HG2      VAL  64   6.555   8.375   1.417
  440    H    LYS  65           H        LYS  65   7.845  11.803  -1.514
  441    HA   LYS  65           HA       LYS  65   6.882  10.871  -3.979
  442   1HB   LYS  65          2HB       LYS  65   7.495  13.571  -2.854
  443   2HB   LYS  65          1HB       LYS  65   7.198  13.431  -4.582
  444   1HG   LYS  65          2HG       LYS  65   5.307  12.468  -2.448
  445   2HG   LYS  65          1HG       LYS  65   5.192  14.030  -3.261
  446   1HD   LYS  65          2HD       LYS  65   5.291  11.499  -4.858
  447   2HD   LYS  65          1HD       LYS  65   3.775  12.029  -4.126
  448   1HE   LYS  65          2HE       LYS  65   3.946  14.162  -5.296
  449   2HE   LYS  65          1HE       LYS  65   5.481  13.661  -6.006
  450   1HZ   LYS  65          1HZ       LYS  65   3.709  13.342  -7.577
  451   2HZ   LYS  65          2HZ       LYS  65   2.832  12.405  -6.476
  452   3HZ   LYS  65          3HZ       LYS  65   4.295  11.828  -7.098
  453    H    GLY  66           H        GLY  66   8.003  10.104  -5.636
  454   1HA   GLY  66          2HA       GLY  66   9.585  10.238  -7.381
  455   2HA   GLY  66          1HA       GLY  66  10.471  11.442  -6.450
  456    H    ARG  67           H        ARG  67  10.290   9.801  -4.019
  457    HA   ARG  67           HA       ARG  67  12.735   8.404  -4.243
  458   1HB   ARG  67          2HB       ARG  67  11.838   9.420  -2.148
  459   2HB   ARG  67          1HB       ARG  67  10.618   8.160  -2.096
  460   1HG   ARG  67          2HG       ARG  67  12.032   6.985  -0.864
  461   2HG   ARG  67          1HG       ARG  67  13.014   6.785  -2.320
  462   1HD   ARG  67          2HD       ARG  67  14.630   7.792  -1.147
  463   2HD   ARG  67          1HD       ARG  67  13.742   9.278  -1.482
  464    HE   ARG  67           HE       ARG  67  13.314   7.712   0.980
  465   1HH1  ARG  67          1HH1      ARG  67  13.887  10.728  -0.670
  466   2HH1  ARG  67          2HH1      ARG  67  13.754  11.687   0.767
  467   1HH2  ARG  67          1HH2      ARG  67  13.133   8.966   2.875
  468   2HH2  ARG  67          2HH2      ARG  67  13.326  10.684   2.784
  469    H    PHE  68           H        PHE  68   9.463   7.182  -3.560
  470    HA   PHE  68           HA       PHE  68  10.241   4.621  -4.794
  471   1HB   PHE  68          2HB       PHE  68   8.162   5.099  -2.649
  472   2HB   PHE  68          1HB       PHE  68   8.591   3.542  -3.342
  473    HD1  PHE  68           1HD      PHE  68  11.676   4.522  -3.324
  474    HD2  PHE  68           2HD      PHE  68   8.572   4.111  -0.442
  475    HE1  PHE  68           1HE      PHE  68  13.360   4.191  -1.563
  476    HE2  PHE  68           2HE      PHE  68  10.251   3.788   1.325
  477    HZ   PHE  68           HZ       PHE  68  12.645   3.826   0.763
  478    H    THR  69           H        THR  69   8.385   3.392  -5.713
  479    HA   THR  69           HA       THR  69   6.330   5.175  -6.842
  480    HB   THR  69           HB       THR  69   7.945   3.072  -8.290
  481    HG1  THR  69           1HG      THR  69   7.715   5.862  -8.369
  482   1HG2  THR  69          1HG2      THR  69   6.442   3.718 -10.257
  483   2HG2  THR  69          2HG2      THR  69   5.329   4.355  -9.046
  484   3HG2  THR  69          3HG2      THR  69   5.753   2.642  -9.042
  485    H    ILE  70           H        ILE  70   4.365   4.521  -6.306
  486    HA   ILE  70           HA       ILE  70   3.973   1.739  -5.476
  487    HB   ILE  70           HB       ILE  70   3.279   3.245  -3.778
  488   1HG1  ILE  70          2HG1      ILE  70   0.554   2.930  -4.722
  489   2HG1  ILE  70          1HG1      ILE  70   1.497   1.470  -4.995
  490   1HG2  ILE  70          1HG2      ILE  70   3.141   5.300  -4.958
  491   2HG2  ILE  70          2HG2      ILE  70   1.553   5.010  -4.249
  492   3HG2  ILE  70          3HG2      ILE  70   1.821   4.708  -5.965
  493   1HD1  ILE  70          1HD1      ILE  70   1.458   0.954  -2.842
  494   2HD1  ILE  70          2HD1      ILE  70   0.206   2.188  -2.695
  495   3HD1  ILE  70          3HD1      ILE  70   1.891   2.593  -2.355
  496    H    SER  71           H        SER  71   3.069   0.395  -6.816
  497    HA   SER  71           HA       SER  71   0.826   1.177  -8.475
  498   1HB   SER  71          2HB       SER  71   2.313   1.603 -10.187
  499   2HB   SER  71          1HB       SER  71   3.519   0.481  -9.560
  500    HG   SER  71           HG       SER  71   1.304  -0.001 -11.189
  501    H    ARG  72           H        ARG  72  -0.116  -0.782  -9.578
  502    HA   ARG  72           HA       ARG  72   0.632  -3.365  -8.559
  503   1HB   ARG  72          2HB       ARG  72  -1.152  -3.804  -7.130
  504   2HB   ARG  72          1HB       ARG  72  -0.700  -2.161  -6.706
  505   1HG   ARG  72          2HG       ARG  72  -2.593  -1.835  -8.697
  506   2HG   ARG  72          1HG       ARG  72  -3.197  -3.191  -7.742
  507   1HD   ARG  72          2HD       ARG  72  -3.193  -1.909  -5.751
  508   2HD   ARG  72          1HD       ARG  72  -2.259  -0.617  -6.502
  509    HE   ARG  72           HE       ARG  72  -4.412  -0.524  -8.004
  510   1HH1  ARG  72          1HH1      ARG  72  -4.190  -0.954  -4.553
  511   2HH1  ARG  72          2HH1      ARG  72  -5.718  -0.205  -4.233
  512   1HH2  ARG  72          1HH2      ARG  72  -6.423   0.456  -7.594
  513   2HH2  ARG  72          2HH2      ARG  72  -6.990   0.596  -5.963
  514    H    ASP  73           H        ASP  73  -1.272  -4.978  -9.104
  515    HA   ASP  73           HA       ASP  73  -2.036  -4.394 -11.877
  516   1HB   ASP  73          2HB       ASP  73  -0.673  -6.520 -10.995
  517   2HB   ASP  73          1HB       ASP  73  -2.305  -7.137 -10.752
  518    H    ASN  74           H        ASN  74  -4.083  -6.033 -12.365
  519    HA   ASN  74           HA       ASN  74  -6.135  -5.303 -10.381
  520   1HB   ASN  74          2HB       ASN  74  -7.643  -5.285 -12.552
  521   2HB   ASN  74          1HB       ASN  74  -6.719  -3.862 -12.079
  522   1HD2  ASN  74          1HD2      ASN  74  -5.239  -3.070 -13.439
  523   2HD2  ASN  74          2HD2      ASN  74  -4.782  -3.800 -14.936
  524    H    ALA  75           H        ALA  75  -4.979  -7.636 -12.721
  525    HA   ALA  75           HA       ALA  75  -7.179  -9.451 -12.336
  526   1HB   ALA  75          1HB       ALA  75  -5.620 -11.029 -13.612
  527   2HB   ALA  75          2HB       ALA  75  -4.565  -9.628 -13.797
  528   3HB   ALA  75          3HB       ALA  75  -6.202  -9.593 -14.455
  529    H    LYS  76           H        LYS  76  -3.970  -9.005 -11.022
  530    HA   LYS  76           HA       LYS  76  -4.286 -11.431  -9.394
  531   1HB   LYS  76          2HB       LYS  76  -1.892  -9.832 -10.250
  532   2HB   LYS  76          1HB       LYS  76  -1.799 -10.921  -8.872
  533   1HG   LYS  76          2HG       LYS  76  -2.993 -12.381 -10.957
  534   2HG   LYS  76          1HG       LYS  76  -1.628 -11.511 -11.663
  535   1HD   LYS  76          2HD       LYS  76  -0.178 -12.395  -9.870
  536   2HD   LYS  76          1HD       LYS  76  -1.548 -13.317  -9.247
  537   1HE   LYS  76          2HE       LYS  76  -1.045 -13.708 -12.103
  538   2HE   LYS  76          1HE       LYS  76   0.281 -14.228 -11.065
  539   1HZ   LYS  76          1HZ       LYS  76  -0.860 -16.050 -10.598
  540   2HZ   LYS  76          2HZ       LYS  76  -2.145 -15.534 -11.570
  541   3HZ   LYS  76          3HZ       LYS  76  -2.110 -15.124  -9.930
  542    H    ASN  77           H        ASN  77  -3.470 -11.277  -7.133
  543    HA   ASN  77           HA       ASN  77  -4.365  -8.746  -5.933
  544   1HB   ASN  77          2HB       ASN  77  -4.606 -11.581  -5.181
  545   2HB   ASN  77          1HB       ASN  77  -4.183 -10.507  -3.851
  546   1HD2  ASN  77          1HD2      ASN  77  -6.438 -11.595  -3.422
  547   2HD2  ASN  77          2HD2      ASN  77  -7.788 -10.588  -3.807
  548    H    THR  78           H        THR  78  -2.084  -8.043  -6.649
  549    HA   THR  78           HA       THR  78  -0.333  -8.375  -4.327
  550    HB   THR  78           HB       THR  78   1.541  -8.187  -6.281
  551    HG1  THR  78           1HG      THR  78   0.610 -10.169  -7.602
  552   1HG2  THR  78          1HG2      THR  78   2.269 -10.166  -5.455
  553   2HG2  THR  78          2HG2      THR  78   0.703 -10.950  -5.655
  554   3HG2  THR  78          3HG2      THR  78   0.990  -9.894  -4.272
  555    H    LEU  79           H        LEU  79   0.908  -6.638  -3.810
  556    HA   LEU  79           HA       LEU  79   0.405  -4.168  -5.332
  557   1HB   LEU  79          2HB       LEU  79  -0.209  -4.499  -2.782
  558   2HB   LEU  79          1HB       LEU  79   1.497  -4.177  -2.544
  559    HG   LEU  79           HG       LEU  79   1.241  -1.998  -3.663
  560   1HD1  LEU  79          1HD1      LEU  79  -1.272  -1.277  -3.824
  561   2HD1  LEU  79          2HD1      LEU  79  -1.530  -3.006  -4.062
  562   3HD1  LEU  79          3HD1      LEU  79  -0.482  -2.110  -5.162
  563   1HD2  LEU  79          1HD2      LEU  79  -0.846  -2.229  -1.516
  564   2HD2  LEU  79          2HD2      LEU  79   0.233  -0.877  -1.862
  565   3HD2  LEU  79          3HD2      LEU  79   0.878  -2.367  -1.171
  566    H    TYR  80           H        TYR  80   2.171  -2.916  -5.982
  567    HA   TYR  80           HA       TYR  80   4.820  -4.091  -5.447
  568   1HB   TYR  80          2HB       TYR  80   3.733  -3.084  -8.076
  569   2HB   TYR  80          1HB       TYR  80   5.438  -3.416  -7.793
  570    HD1  TYR  80           1HD      TYR  80   2.090  -5.043  -7.635
  571    HD2  TYR  80           2HD      TYR  80   6.275  -5.541  -8.206
  572    HE1  TYR  80           1HE      TYR  80   1.718  -7.392  -8.243
  573    HE2  TYR  80           2HE      TYR  80   5.920  -7.894  -8.818
  574    HH   TYR  80           HH       TYR  80   4.441  -9.541  -9.033
  575    H    LEU  81           H        LEU  81   6.614  -2.683  -5.576
  576    HA   LEU  81           HA       LEU  81   6.167   0.150  -5.829
  577   1HB   LEU  81          2HB       LEU  81   5.592  -0.283  -3.460
  578   2HB   LEU  81          1HB       LEU  81   7.197  -0.950  -3.215
  579    HG   LEU  81           HG       LEU  81   7.823   1.487  -4.240
  580   1HD1  LEU  81          1HD1      LEU  81   5.079   1.665  -3.467
  581   2HD1  LEU  81          2HD1      LEU  81   6.132   2.903  -4.156
  582   3HD1  LEU  81          3HD1      LEU  81   6.062   2.679  -2.408
  583   1HD2  LEU  81          1HD2      LEU  81   8.995   1.304  -2.367
  584   2HD2  LEU  81          2HD2      LEU  81   7.806   0.216  -1.651
  585   3HD2  LEU  81          3HD2      LEU  81   7.598   1.962  -1.517
  586    H    GLN  82           H        GLN  82   7.909   1.163  -6.593
  587    HA   GLN  82           HA       GLN  82  10.383  -0.401  -6.835
  588   1HB   GLN  82          2HB       GLN  82   9.070   0.559  -8.873
  589   2HB   GLN  82          1HB       GLN  82   9.795   2.091  -8.405
  590   1HG   GLN  82          2HG       GLN  82  11.221   1.226 -10.034
  591   2HG   GLN  82          1HG       GLN  82  12.030   0.886  -8.504
  592   1HE2  GLN  82          1HE2      GLN  82  13.007  -0.996  -8.597
  593   2HE2  GLN  82          2HE2      GLN  82  12.381  -2.439  -9.310
  594    H    MET  83           H        MET  83  11.699   0.064  -5.205
  595    HA   MET  83           HA       MET  83  11.807   2.711  -4.050
  596   1HB   MET  83          2HB       MET  83  13.495   0.290  -3.408
  597   2HB   MET  83          1HB       MET  83  13.324   1.739  -2.429
  598   1HG   MET  83          2HG       MET  83  11.414   1.040  -1.511
  599   2HG   MET  83          1HG       MET  83  10.792   0.420  -3.040
  600   1HE   MET  83          1HE       MET  83  10.671  -2.533  -0.343
  601   2HE   MET  83          2HE       MET  83   9.723  -1.278  -1.141
  602   3HE   MET  83          3HE       MET  83  10.807  -0.855   0.184
  603    H    ASN  84           H        ASN  84  12.682   4.049  -5.599
  604    HA   ASN  84           HA       ASN  84  15.372   3.378  -6.582
  605   1HB   ASN  84          2HB       ASN  84  13.092   4.825  -7.701
  606   2HB   ASN  84          1HB       ASN  84  14.607   5.707  -7.864
  607   1HD2  ASN  84          1HD2      ASN  84  12.682   3.914  -9.582
  608   2HD2  ASN  84          2HD2      ASN  84  13.798   2.993 -10.525
  609    H    SER  85           H        SER  85  16.430   3.894  -4.605
  610    HA   SER  85           HA       SER  85  17.428   6.513  -4.469
  611   1HB   SER  85          2HB       SER  85  16.482   6.973  -2.088
  612   2HB   SER  85          1HB       SER  85  15.471   7.331  -3.489
  613    HG   SER  85           HG       SER  85  15.356   4.833  -2.179
  614    H    LEU  86           H        LEU  86  16.695   4.922  -1.456
  615    HA   LEU  86           HA       LEU  86  18.028   4.027   0.148
  616   1HB   LEU  86          2HB       LEU  86  19.508   2.736  -2.128
  617   2HB   LEU  86          1HB       LEU  86  19.433   2.186  -0.469
  618    HG   LEU  86           HG       LEU  86  17.966   0.726  -1.422
  619   1HD1  LEU  86          1HD1      LEU  86  15.783   2.684  -1.299
  620   2HD1  LEU  86          2HD1      LEU  86  16.790   2.589   0.145
  621   3HD1  LEU  86          3HD1      LEU  86  15.982   1.143  -0.463
  622   1HD2  LEU  86          1HD2      LEU  86  17.777   2.774  -3.486
  623   2HD2  LEU  86          2HD2      LEU  86  16.261   1.921  -3.198
  624   3HD2  LEU  86          3HD2      LEU  86  17.716   1.017  -3.619
  625    H    LYS  87           H        LYS  87  19.026   5.786   0.950
  626    HA   LYS  87           HA       LYS  87  21.688   6.438  -0.130
  627   1HB   LYS  87          2HB       LYS  87  21.200   8.629   1.258
  628   2HB   LYS  87          1HB       LYS  87  20.568   8.432  -0.371
  629   1HG   LYS  87          2HG       LYS  87  18.798   7.394   1.709
  630   2HG   LYS  87          1HG       LYS  87  19.103   9.129   1.824
  631   1HD   LYS  87          2HD       LYS  87  18.662   8.893  -0.828
  632   2HD   LYS  87          1HD       LYS  87  17.641   7.587  -0.224
  633   1HE   LYS  87          2HE       LYS  87  16.115   9.023   0.537
  634   2HE   LYS  87          1HE       LYS  87  17.341   9.984   1.362
  635   1HZ   LYS  87          1HZ       LYS  87  17.791  11.151  -0.682
  636   2HZ   LYS  87          2HZ       LYS  87  16.138  11.250  -0.335
  637   3HZ   LYS  87          3HZ       LYS  87  16.688  10.186  -1.528
  638    H    SER  88           H        SER  88  21.459   4.286   1.606
  639    HA   SER  88           HA       SER  88  22.314   3.424   3.545
  640   1HB   SER  88          2HB       SER  88  23.782   6.039   3.881
  641   2HB   SER  88          1HB       SER  88  24.282   4.434   4.418
  642    HG   SER  88           HG       SER  88  24.897   3.931   2.419
  643    H    GLU  89           H        GLU  89  20.009   5.434   3.480
  644    HA   GLU  89           HA       GLU  89  19.958   5.991   6.368
  645   1HB   GLU  89          2HB       GLU  89  20.060   8.088   5.336
  646   2HB   GLU  89          1HB       GLU  89  19.014   7.592   4.013
  647   1HG   GLU  89          2HG       GLU  89  17.599   8.920   5.206
  648   2HG   GLU  89          1HG       GLU  89  17.226   7.337   5.889
  649    H    ASP  90           H        ASP  90  18.196   4.911   3.542
  650    HA   ASP  90           HA       ASP  90  15.656   4.602   4.674
  651   1HB   ASP  90          2HB       ASP  90  17.044   3.711   2.263
  652   2HB   ASP  90          1HB       ASP  90  15.873   2.529   2.842
  653    H    THR  91           H        THR  91  17.010   1.585   3.630
  654    HA   THR  91           HA       THR  91  16.984  -0.475   4.635
  655    HB   THR  91           HB       THR  91  18.329   0.896   6.947
  656    HG1  THR  91           1HG      THR  91  19.942   0.060   4.869
  657   1HG2  THR  91          1HG2      THR  91  18.371  -1.831   5.726
  658   2HG2  THR  91          2HG2      THR  91  18.230  -1.362   7.420
  659   3HG2  THR  91          3HG2      THR  91  19.785  -1.243   6.599
  660    H    ALA  92           H        ALA  92  14.784  -0.833   5.058
  661    HA   ALA  92           HA       ALA  92  14.122  -1.078   7.833
  662   1HB   ALA  92          1HB       ALA  92  12.098   0.331   7.766
  663   2HB   ALA  92          2HB       ALA  92  12.581   0.913   6.173
  664   3HB   ALA  92          3HB       ALA  92  13.583   1.264   7.582
  665    H    VAL  93           H        VAL  93  11.755  -1.854   8.055
  666    HA   VAL  93           HA       VAL  93  11.388  -3.978   6.111
  667    HB   VAL  93           HB       VAL  93   9.707  -3.392   8.555
  668   1HG1  VAL  93          1HG1      VAL  93  10.016  -5.805   6.778
  669   2HG1  VAL  93          2HG1      VAL  93   8.558  -4.861   7.084
  670   3HG1  VAL  93          3HG1      VAL  93   9.244  -5.862   8.363
  671   1HG2  VAL  93          1HG2      VAL  93  11.807  -3.727   9.484
  672   2HG2  VAL  93          2HG2      VAL  93  12.281  -4.890   8.244
  673   3HG2  VAL  93          3HG2      VAL  93  11.116  -5.350   9.487
  674    H    TYR  94           H        TYR  94   9.564  -4.248   4.808
  675    HA   TYR  94           HA       TYR  94   7.776  -1.913   4.670
  676   1HB   TYR  94          2HB       TYR  94   9.091  -3.436   2.427
  677   2HB   TYR  94          1HB       TYR  94   7.671  -2.430   2.166
  678    HD1  TYR  94           1HD      TYR  94  11.086  -2.247   3.664
  679    HD2  TYR  94           2HD      TYR  94   7.981  -0.195   1.603
  680    HE1  TYR  94           1HE      TYR  94  12.541  -0.276   3.448
  681    HE2  TYR  94           2HE      TYR  94   9.429   1.782   1.383
  682    HH   TYR  94           HH       TYR  94  12.354   1.938   1.446
  683    H    TYR  95           H        TYR  95   5.643  -2.264   4.421
  684    HA   TYR  95           HA       TYR  95   4.700  -5.003   3.964
  685   1HB   TYR  95          2HB       TYR  95   3.151  -3.414   5.929
  686   2HB   TYR  95          1HB       TYR  95   3.448  -5.144   5.868
  687    HD1  TYR  95           1HD      TYR  95   5.020  -6.124   7.290
  688    HD2  TYR  95           2HD      TYR  95   5.047  -1.907   6.755
  689    HE1  TYR  95           1HE      TYR  95   6.647  -5.909   9.122
  690    HE2  TYR  95           2HE      TYR  95   6.679  -1.678   8.579
  691    HH   TYR  95           HH       TYR  95   7.655  -4.446  10.529
  692    H    CYS  96           H        CYS  96   2.331  -5.032   3.488
  693    HA   CYS  96           HA       CYS  96   1.498  -2.563   2.127
  694   1HB   CYS  96          2HB       CYS  96   0.822  -3.715   0.251
  695   2HB   CYS  96          1HB       CYS  96   2.190  -4.709   0.737
  696    H    ALA  97           H        ALA  97  -0.563  -1.886   2.509
  697    HA   ALA  97           HA       ALA  97  -2.397  -3.667   3.924
  698   1HB   ALA  97          1HB       ALA  97  -1.054  -1.317   5.103
  699   2HB   ALA  97          2HB       ALA  97  -1.652  -2.792   5.866
  700   3HB   ALA  97          3HB       ALA  97  -2.775  -1.499   5.446
  701    H    LYS  98           H        LYS  98  -4.564  -2.806   4.141
  702    HA   LYS  98           HA       LYS  98  -5.304  -1.228   1.797
  703   1HB   LYS  98          2HB       LYS  98  -6.548  -3.220   1.895
  704   2HB   LYS  98          1HB       LYS  98  -6.788  -3.094   3.631
  705   1HG   LYS  98          2HG       LYS  98  -7.946  -0.901   2.065
  706   2HG   LYS  98          1HG       LYS  98  -8.651  -2.492   1.769
  707   1HD   LYS  98          2HD       LYS  98  -8.197  -1.642   4.585
  708   2HD   LYS  98          1HD       LYS  98  -9.541  -0.924   3.697
  709   1HE   LYS  98          2HE       LYS  98  -9.117  -3.734   4.570
  710   2HE   LYS  98          1HE       LYS  98 -10.579  -2.749   4.610
  711   1HZ   LYS  98          1HZ       LYS  98 -10.604  -2.940   2.131
  712   2HZ   LYS  98          2HZ       LYS  98 -10.887  -4.389   2.957
  713   3HZ   LYS  98          3HZ       LYS  98  -9.374  -4.094   2.261
  714    H    TYR  99           H        TYR  99  -5.987   0.812   1.933
  715    HA   TYR  99           HA       TYR  99  -6.108   2.099   4.518
  716   1HB   TYR  99          2HB       TYR  99  -5.597   2.900   1.812
  717   2HB   TYR  99          1HB       TYR  99  -6.894   3.892   2.468
  718    HD1  TYR  99           1HD      TYR  99  -6.464   5.062   4.712
  719    HD2  TYR  99           2HD      TYR  99  -3.371   3.360   2.338
  720    HE1  TYR  99           1HE      TYR  99  -4.808   6.455   5.878
  721    HE2  TYR  99           2HE      TYR  99  -1.707   4.748   3.497
  722    HH   TYR  99           HH       TYR  99  -2.169   6.194   6.328
  723    H    SER 100           H        SER 100  -7.887   3.236   5.341
  724    HA   SER 100           HA       SER 100 -10.471   2.235   4.380
  725   1HB   SER 100          2HB       SER 100  -9.371   2.901   7.041
  726   2HB   SER 100          1HB       SER 100 -11.050   3.368   6.778
  727    HG   SER 100           HG       SER 100 -10.767   0.928   5.818
  728    H    GLY 101           H        GLY 101  -9.164   5.212   5.865
  729   1HA   GLY 101          2HA       GLY 101 -10.615   6.791   3.881
  730   2HA   GLY 101          1HA       GLY 101 -11.057   7.033   5.564
  731    H    GLY 102           H        GLY 102  -8.353   6.670   6.576
  732   1HA   GLY 102          2HA       GLY 102  -6.582   8.503   5.324
  733   2HA   GLY 102          1HA       GLY 102  -7.472   9.302   6.611
  734    H    ALA 103           H        ALA 103  -7.040   6.010   7.212
  735    HA   ALA 103           HA       ALA 103  -4.478   6.348   8.563
  736   1HB   ALA 103          1HB       ALA 103  -6.966   5.501  10.044
  737   2HB   ALA 103          2HB       ALA 103  -6.131   7.044  10.228
  738   3HB   ALA 103          3HB       ALA 103  -5.331   5.546  10.701
  739    H    LEU 104           H        LEU 104  -3.362   4.717   7.674
  740    HA   LEU 104           HA       LEU 104  -4.563   2.313   6.760
  741   1HB   LEU 104          2HB       LEU 104  -2.367   3.448   5.990
  742   2HB   LEU 104          1HB       LEU 104  -1.629   2.603   7.336
  743    HG   LEU 104           HG       LEU 104  -2.037   0.481   6.379
  744   1HD1  LEU 104          1HD1      LEU 104  -4.254   0.550   5.646
  745   2HD1  LEU 104          2HD1      LEU 104  -3.311   0.351   4.170
  746   3HD1  LEU 104          3HD1      LEU 104  -3.955   1.935   4.597
  747   1HD2  LEU 104          1HD2      LEU 104  -1.518   1.475   3.757
  748   2HD2  LEU 104          2HD2      LEU 104  -0.418   0.695   4.898
  749   3HD2  LEU 104          3HD2      LEU 104  -0.640   2.446   4.942
  750    H    ASP 105           H        ASP 105  -3.816   0.132   7.487
  751    HA   ASP 105           HA       ASP 105  -3.842   0.018  10.425
  752   1HB   ASP 105          2HB       ASP 105  -5.369  -1.333   8.405
  753   2HB   ASP 105          1HB       ASP 105  -4.448  -2.523   9.323
  754    H    ALA 106           H        ALA 106  -2.166  -0.956   7.556
  755    HA   ALA 106           HA       ALA 106  -0.165  -1.947   7.176
  756   1HB   ALA 106          1HB       ALA 106   1.455  -1.966   9.158
  757   2HB   ALA 106          2HB       ALA 106   0.204  -1.055  10.005
  758   3HB   ALA 106          3HB       ALA 106   0.919  -0.408   8.528
  759    H    TRP 107           H        TRP 107  -0.287  -4.010   6.700
  760    HA   TRP 107           HA       TRP 107  -0.390  -5.953   8.901
  761   1HB   TRP 107          2HB       TRP 107  -1.727  -6.356   6.223
  762   2HB   TRP 107          1HB       TRP 107  -1.828  -7.404   7.633
  763    HD1  TRP 107           HD       TRP 107  -2.685  -5.477   9.883
  764    HE1  TRP 107           1HE      TRP 107  -4.966  -4.282   9.825
  765    HE3  TRP 107           3HE      TRP 107  -3.613  -5.776   4.879
  766    HZ2  TRP 107           2HZ      TRP 107  -6.906  -3.564   7.893
  767    HZ3  TRP 107           3HZ      TRP 107  -5.703  -4.821   3.998
  768    HH2  TRP 107           HH       TRP 107  -7.310  -3.738   5.475
  769    H    GLY 108           H        GLY 108  -0.422  -7.752   6.261
  770   1HA   GLY 108          2HA       GLY 108   1.123  -8.837   4.964
  771   2HA   GLY 108          1HA       GLY 108   2.183  -7.450   5.178
  772    H    GLN 109           H        GLN 109   3.480  -9.701   5.084
  773    HA   GLN 109           HA       GLN 109   3.748 -10.912   7.702
  774   1HB   GLN 109          2HB       GLN 109   4.352 -11.662   5.023
  775   2HB   GLN 109          1HB       GLN 109   5.848 -11.704   5.944
  776   1HG   GLN 109          2HG       GLN 109   5.043 -13.320   7.414
  777   2HG   GLN 109          1HG       GLN 109   3.364 -13.013   6.974
  778   1HE2  GLN 109          1HE2      GLN 109   2.630 -13.726   4.906
  779   2HE2  GLN 109          2HE2      GLN 109   3.397 -15.060   4.120
  780    H    GLY 110           H        GLY 110   5.540  -8.702   5.621
  781   1HA   GLY 110          2HA       GLY 110   6.870  -6.964   6.657
  782   2HA   GLY 110          1HA       GLY 110   7.286  -8.108   7.922
  783    H    THR 111           H        THR 111   8.038  -6.928   4.763
  784    HA   THR 111           HA       THR 111  10.108  -8.954   4.376
  785    HB   THR 111           HB       THR 111   8.761  -8.371   2.420
  786    HG1  THR 111           1HG      THR 111  11.377  -8.454   2.539
  787   1HG2  THR 111          1HG2      THR 111   9.309  -6.050   1.395
  788   2HG2  THR 111          2HG2      THR 111   9.720  -5.601   3.050
  789   3HG2  THR 111          3HG2      THR 111   8.091  -6.155   2.665
  790    H    GLN 112           H        GLN 112  12.244  -8.589   4.594
  791    HA   GLN 112           HA       GLN 112  13.044  -6.133   5.893
  792   1HB   GLN 112          2HB       GLN 112  13.951  -8.101   6.854
  793   2HB   GLN 112          1HB       GLN 112  14.465  -8.721   5.292
  794   1HG   GLN 112          2HG       GLN 112  16.479  -7.938   5.813
  795   2HG   GLN 112          1HG       GLN 112  15.817  -6.341   5.471
  796   1HE2  GLN 112          1HE2      GLN 112  15.438  -4.936   7.124
  797   2HE2  GLN 112          2HE2      GLN 112  15.900  -5.240   8.761
  798    H    VAL 113           H        VAL 113  13.352  -4.426   4.608
  799    HA   VAL 113           HA       VAL 113  14.814  -4.808   2.084
  800    HB   VAL 113           HB       VAL 113  12.968  -2.611   3.016
  801   1HG1  VAL 113          1HG1      VAL 113  15.031  -2.572   0.859
  802   2HG1  VAL 113          2HG1      VAL 113  14.565  -1.302   1.992
  803   3HG1  VAL 113          3HG1      VAL 113  13.514  -1.701   0.631
  804   1HG2  VAL 113          1HG2      VAL 113  12.406  -3.465   0.401
  805   2HG2  VAL 113          2HG2      VAL 113  11.475  -3.785   1.866
  806   3HG2  VAL 113          3HG2      VAL 113  12.715  -4.925   1.342
  807    H    THR 114           H        THR 114  16.930  -4.449   2.258
  808    HA   THR 114           HA       THR 114  17.823  -2.177   3.903
  809    HB   THR 114           HB       THR 114  18.960  -4.969   3.885
  810    HG1  THR 114           1HG      THR 114  17.411  -4.728   5.447
  811   1HG2  THR 114          1HG2      THR 114  20.847  -3.469   3.715
  812   2HG2  THR 114          2HG2      THR 114  20.745  -4.083   5.365
  813   3HG2  THR 114          3HG2      THR 114  20.195  -2.448   4.997
  814    H    VAL 115           H        VAL 115  19.677  -1.109   3.201
  815    HA   VAL 115           HA       VAL 115  20.449  -1.718   0.430
  816    HB   VAL 115           HB       VAL 115  19.583   0.431   0.374
  817   1HG1  VAL 115          1HG1      VAL 115  19.800   2.117   2.014
  818   2HG1  VAL 115          2HG1      VAL 115  21.096   1.249   2.839
  819   3HG1  VAL 115          3HG1      VAL 115  19.448   0.621   2.881
  820   1HG2  VAL 115          1HG2      VAL 115  21.710   0.455  -0.712
  821   2HG2  VAL 115          2HG2      VAL 115  22.546   0.719   0.819
  822   3HG2  VAL 115          3HG2      VAL 115  21.517   1.984   0.148
  823    H    SER 116           H        SER 116  22.196  -2.960   0.497
  824    HA   SER 116           HA       SER 116  24.655  -1.897   1.534
  825   1HB   SER 116          2HB       SER 116  23.150  -3.551   3.248
  826   2HB   SER 116          1HB       SER 116  24.461  -4.558   2.635
  827    HG   SER 116           HG       SER 116  25.248  -3.512   4.412
  828    H    SER 117           H        SER 117  25.862  -2.197  -0.229
  829    HA   SER 117           HA       SER 117  26.522  -4.832  -1.105
  830   1HB   SER 117          2HB       SER 117  24.266  -4.121  -2.275
  831   2HB   SER 117          1HB       SER 117  25.345  -3.189  -3.312
  832    HG   SER 117           HG       SER 117  25.754  -4.981  -4.304
  833    H    GLN 118           H        GLN 118  28.647  -4.562  -1.156
  834    HA   GLN 118           HA       GLN 118  30.719  -3.754  -1.588
  835   1HB   GLN 118          2HB       GLN 118  31.162  -3.379  -3.788
  836   2HB   GLN 118          1HB       GLN 118  29.527  -3.998  -3.959
  837   1HG   GLN 118          2HG       GLN 118  29.075  -1.332  -3.629
  838   2HG   GLN 118          1HG       GLN 118  30.606  -1.335  -4.503
  839   1HE2  GLN 118          1HE2      GLN 118  27.266  -1.575  -4.749
  840   2HE2  GLN 118          2HE2      GLN 118  27.167  -2.080  -6.399
  841    H    SER 119           H        SER 119  31.947  -1.606  -2.279
  842    HA   SER 119           HA       SER 119  30.642   0.627  -0.865
  843   1HB   SER 119          2HB       SER 119  32.264   0.159   0.682
  844   2HB   SER 119          1HB       SER 119  33.335  -0.584  -0.507
  845    HG   SER 119           HG       SER 119  33.680   1.722   0.499
  846    H    GLU 120           H        GLU 120  33.216  -0.209  -3.174
  847    HA   GLU 120           HA       GLU 120  33.400   2.444  -4.222
  848   1HB   GLU 120          2HB       GLU 120  34.418  -0.198  -5.278
  849   2HB   GLU 120          1HB       GLU 120  34.801   1.364  -5.987
  850   1HG   GLU 120          2HG       GLU 120  36.194   1.956  -4.281
  851   2HG   GLU 120          1HG       GLU 120  35.349   0.958  -3.097
  852    H    GLN 121           H        GLN 121  33.195   2.723  -6.695
  853    HA   GLN 121           HA       GLN 121  30.934   1.285  -7.835
  854   1HB   GLN 121          2HB       GLN 121  30.108   3.312  -6.506
  855   2HB   GLN 121          1HB       GLN 121  30.878   4.296  -7.744
  856   1HG   GLN 121          2HG       GLN 121  29.316   3.815  -9.299
  857   2HG   GLN 121          1HG       GLN 121  29.050   2.182  -8.689
  858   1HE2  GLN 121          1HE2      GLN 121  28.739   5.473  -7.389
  859   2HE2  GLN 121          2HE2      GLN 121  27.134   5.265  -6.783
  860    H    LYS 122           H        LYS 122  33.819   3.044  -8.107
  861    HA   LYS 122           HA       LYS 122  33.577   3.351 -11.007
  862   1HB   LYS 122          2HB       LYS 122  35.146   4.638  -8.897
  863   2HB   LYS 122          1HB       LYS 122  36.095   4.243 -10.324
  864   1HG   LYS 122          2HG       LYS 122  34.461   5.458 -11.713
  865   2HG   LYS 122          1HG       LYS 122  33.586   5.906 -10.247
  866   1HD   LYS 122          2HD       LYS 122  36.495   6.554 -10.659
  867   2HD   LYS 122          1HD       LYS 122  35.199   7.631 -11.184
  868   1HE   LYS 122          2HE       LYS 122  35.311   6.613  -8.368
  869   2HE   LYS 122          1HE       LYS 122  36.274   8.005  -8.863
  870   1HZ   LYS 122          1HZ       LYS 122  33.733   8.468  -9.825
  871   2HZ   LYS 122          2HZ       LYS 122  34.476   9.230  -8.510
  872   3HZ   LYS 122          3HZ       LYS 122  33.506   7.869  -8.259
  873    H    LEU 123           H        LEU 123  35.340   2.626 -12.388
  874    HA   LEU 123           HA       LEU 123  36.297  -0.004 -11.552
  875   1HB   LEU 123          2HB       LEU 123  36.369   1.292 -14.278
  876   2HB   LEU 123          1HB       LEU 123  36.767  -0.377 -13.915
  877    HG   LEU 123           HG       LEU 123  34.110   0.232 -12.979
  878   1HD1  LEU 123          1HD1      LEU 123  33.384   1.602 -14.579
  879   2HD1  LEU 123          2HD1      LEU 123  33.550   0.238 -15.684
  880   3HD1  LEU 123          3HD1      LEU 123  34.860   1.407 -15.524
  881   1HD2  LEU 123          1HD2      LEU 123  33.588  -1.785 -13.997
  882   2HD2  LEU 123          2HD2      LEU 123  35.296  -1.979 -13.600
  883   3HD2  LEU 123          3HD2      LEU 123  34.814  -1.585 -15.250
  884    H    ILE 124           H        ILE 124  38.504  -0.643 -12.341
  885    HA   ILE 124           HA       ILE 124  40.471   0.874 -11.116
  886    HB   ILE 124           HB       ILE 124  40.654  -1.264 -13.227
  887   1HG1  ILE 124          2HG1      ILE 124  41.784  -2.410 -11.201
  888   2HG1  ILE 124          1HG1      ILE 124  41.081  -1.104 -10.253
  889   1HG2  ILE 124          1HG2      ILE 124  42.629  -0.190 -13.719
  890   2HG2  ILE 124          2HG2      ILE 124  43.145  -1.284 -12.436
  891   3HG2  ILE 124          3HG2      ILE 124  42.836   0.415 -12.076
  892   1HD1  ILE 124          1HD1      ILE 124  38.858  -1.761 -10.979
  893   2HD1  ILE 124          2HD1      ILE 124  39.699  -3.102 -10.203
  894   3HD1  ILE 124          3HD1      ILE 124  39.551  -3.053 -11.960
  895    H    SER 125           H        SER 125  40.869   2.928 -11.627
  896    HA   SER 125           HA       SER 125  42.181   3.590 -14.047
  897   1HB   SER 125          2HB       SER 125  39.385   3.682 -14.224
  898   2HB   SER 125          1HB       SER 125  39.889   5.361 -14.026
  899    HG   SER 125           HG       SER 125  40.450   3.555 -16.087
  900    H    GLU 126           H        GLU 126  41.732   3.956 -10.920
  901    HA   GLU 126           HA       GLU 126  42.973   6.600 -10.888
  902   1HB   GLU 126          2HB       GLU 126  40.282   6.115 -10.074
  903   2HB   GLU 126          1HB       GLU 126  41.232   6.479  -8.639
  904   1HG   GLU 126          2HG       GLU 126  42.116   8.443 -10.174
  905   2HG   GLU 126          1HG       GLU 126  40.558   8.195 -10.960
  906    H    GLU 127           H        GLU 127  41.696   4.319  -8.464
  907    HA   GLU 127           HA       GLU 127  43.857   4.639  -6.694
  908   1HB   GLU 127          2HB       GLU 127  42.969   2.381  -5.772
  909   2HB   GLU 127          1HB       GLU 127  41.942   3.805  -5.681
  910   1HG   GLU 127          2HG       GLU 127  41.526   2.411  -8.162
  911   2HG   GLU 127          1HG       GLU 127  41.317   1.327  -6.788
  912    H    ASP 128           H        ASP 128  43.122   2.008  -8.979
  913    HA   ASP 128           HA       ASP 128  45.806   0.925  -8.574
  914   1HB   ASP 128          2HB       ASP 128  43.300  -0.249  -9.060
  915   2HB   ASP 128          1HB       ASP 128  44.234  -0.505 -10.530
  916    H    LEU 129           H        LEU 129  46.074   3.290  -9.739
  917    HA   LEU 129           HA       LEU 129  46.999   2.591 -12.409
  918   1HB   LEU 129          2HB       LEU 129  44.760   3.488 -12.786
  919   2HB   LEU 129          1HB       LEU 129  45.166   4.927 -11.870
  920    HG   LEU 129           HG       LEU 129  47.062   5.158 -13.693
  921   1HD1  LEU 129          1HD1      LEU 129  45.223   4.242 -15.697
  922   2HD1  LEU 129          2HD1      LEU 129  45.690   2.910 -14.637
  923   3HD1  LEU 129          3HD1      LEU 129  46.928   3.847 -15.475
  924   1HD2  LEU 129          1HD2      LEU 129  45.858   6.920 -14.342
  925   2HD2  LEU 129          2HD2      LEU 129  44.632   6.353 -13.207
  926   3HD2  LEU 129          3HD2      LEU 129  44.529   5.908 -14.911
  927    H    ASN 130           H        ASN 130  46.921   4.801  -9.698
  928    HA   ASN 130           HA       ASN 130  48.465   6.213  -8.815
  929   1HB   ASN 130          2HB       ASN 130  50.028   4.189 -10.205
  930   2HB   ASN 130          1HB       ASN 130  50.865   5.737 -10.135
  931   1HD2  ASN 130          1HD2      ASN 130  50.653   6.802  -7.885
  932   2HD2  ASN 130          2HD2      ASN 130  50.991   5.761  -6.549
  933    H    HIS 131           H        HIS 131  48.178   8.282  -9.308
  934    HA   HIS 131           HA       HIS 131  48.845   9.190 -12.027
  935   1HB   HIS 131          2HB       HIS 131  47.350  11.108 -11.574
  936   2HB   HIS 131          1HB       HIS 131  46.510   9.565 -11.454
  937    HD1  HIS 131           1HD      HIS 131  46.228   8.676  -8.877
  938    HD2  HIS 131           2HD      HIS 131  47.026  12.718  -9.417
  939    HE1  HIS 131           1HE      HIS 131  45.565   9.787  -6.721
  940    HE2  HIS 131           2HE      HIS 131  46.017  12.238  -7.084
  941    H    HIS 132           H        HIS 132  50.923   8.816 -10.213
  942    HA   HIS 132           HA       HIS 132  51.586  11.204  -8.819
  943   1HB   HIS 132          2HB       HIS 132  52.602   8.611  -8.952
  944   2HB   HIS 132          1HB       HIS 132  53.894   9.619  -9.598
  945    HD1  HIS 132           1HD      HIS 132  53.485  12.090  -7.746
  946    HD2  HIS 132           2HD      HIS 132  53.604   8.143  -6.452
  947    HE1  HIS 132           1HE      HIS 132  54.162  12.195  -5.325
  948    HE2  HIS 132           2HE      HIS 132  54.307   9.790  -4.587
  949    H    HIS 133           H        HIS 133  54.262  11.629  -9.581
  950    HA   HIS 133           HA       HIS 133  53.859  13.423 -11.776
  951   1HB   HIS 133          2HB       HIS 133  55.948  12.904  -9.777
  952   2HB   HIS 133          1HB       HIS 133  56.566  13.420 -11.343
  953    HD1  HIS 133           1HD      HIS 133  57.328  15.606 -10.010
  954    HD2  HIS 133           2HD      HIS 133  53.229  15.081 -10.440
  955    HE1  HIS 133           1HE      HIS 133  56.305  17.846  -9.499
  956    HE2  HIS 133           2HE      HIS 133  53.831  17.525  -9.853
  957    H    HIS 134           H        HIS 134  55.544  10.356 -11.310
  958    HA   HIS 134           HA       HIS 134  55.752  10.116 -14.227
  959   1HB   HIS 134          2HB       HIS 134  57.956  10.460 -12.451
  960   2HB   HIS 134          1HB       HIS 134  58.011   8.814 -13.074
  961    HD1  HIS 134           1HD      HIS 134  56.873   9.535 -15.938
  962    HD2  HIS 134           2HD      HIS 134  60.006  11.460 -14.000
  963    HE1  HIS 134           1HE      HIS 134  58.242  10.595 -17.762
  964    HE2  HIS 134           2HE      HIS 134  60.089  11.818 -16.561
  965    H    HIS 135           H        HIS 135  54.857   8.298 -14.910
  966    HA   HIS 135           HA       HIS 135  55.266   5.777 -13.671
  967   1HB   HIS 135          2HB       HIS 135  53.540   6.877 -12.154
  968   2HB   HIS 135          1HB       HIS 135  52.423   6.776 -13.512
  969    HD1  HIS 135           1HD      HIS 135  51.517   4.447 -14.132
  970    HD2  HIS 135           2HD      HIS 135  54.131   4.434 -10.904
  971    HE1  HIS 135           1HE      HIS 135  51.279   2.174 -13.085
  972    HE2  HIS 135           2HE      HIS 135  52.949   2.152 -11.198
  Start of MODEL    9
    1   1H    ASP   1          1HT       ASP   1  -6.188  -7.462   7.265
    2   2H    ASP   1          2HT       ASP   1  -6.567  -7.698   8.896
    3   3H    ASP   1          3HT       ASP   1  -6.582  -6.137   8.243
    4    HA   ASP   1           HA       ASP   1  -8.790  -7.442   8.600
    5   1HB   ASP   1          2HB       ASP   1  -8.557  -5.186   7.655
    6   2HB   ASP   1          1HB       ASP   1  -8.118  -5.876   6.096
    7    H    VAL   2           H        VAL   2  -6.844  -7.992   5.677
    8    HA   VAL   2           HA       VAL   2  -8.362 -10.470   5.247
    9    HB   VAL   2           HB       VAL   2  -8.422 -10.166   2.885
   10   1HG1  VAL   2          1HG1      VAL   2  -9.847  -8.604   4.584
   11   2HG1  VAL   2          2HG1      VAL   2 -10.111  -8.683   2.842
   12   3HG1  VAL   2          3HG1      VAL   2  -9.127  -7.387   3.527
   13   1HG2  VAL   2          1HG2      VAL   2  -7.358  -7.500   2.619
   14   2HG2  VAL   2          2HG2      VAL   2  -6.933  -8.969   1.743
   15   3HG2  VAL   2          3HG2      VAL   2  -6.145  -8.598   3.277
   16    H    GLN   3           H        GLN   3  -5.780  -9.897   6.516
   17    HA   GLN   3           HA       GLN   3  -3.702 -10.810   6.674
   18   1HB   GLN   3          2HB       GLN   3  -3.607 -13.017   6.223
   19   2HB   GLN   3          1HB       GLN   3  -5.294 -12.827   5.769
   20   1HG   GLN   3          2HG       GLN   3  -4.734 -13.676   3.798
   21   2HG   GLN   3          1HG       GLN   3  -3.923 -12.141   3.476
   22   1HE2  GLN   3          1HE2      GLN   3  -1.894 -12.292   2.880
   23   2HE2  GLN   3          2HE2      GLN   3  -0.807 -13.582   3.254
   24    H    LEU   4           H        LEU   4  -1.631 -11.078   5.552
   25    HA   LEU   4           HA       LEU   4  -1.476 -10.134   2.813
   26   1HB   LEU   4          2HB       LEU   4  -0.178  -8.605   5.069
   27   2HB   LEU   4          1HB       LEU   4   0.071  -8.304   3.360
   28    HG   LEU   4           HG       LEU   4  -2.627  -8.094   4.654
   29   1HD1  LEU   4          1HD1      LEU   4  -1.100  -6.526   5.762
   30   2HD1  LEU   4          2HD1      LEU   4  -2.302  -5.691   4.769
   31   3HD1  LEU   4          3HD1      LEU   4  -0.645  -5.876   4.187
   32   1HD2  LEU   4          1HD2      LEU   4  -3.383  -7.438   2.662
   33   2HD2  LEU   4          2HD2      LEU   4  -1.915  -8.178   2.024
   34   3HD2  LEU   4          3HD2      LEU   4  -1.961  -6.444   2.345
   35    H    GLN   5           H        GLN   5   0.625 -10.384   1.870
   36    HA   GLN   5           HA       GLN   5   2.690 -11.704   3.416
   37   1HB   GLN   5          2HB       GLN   5   1.132 -13.531   2.693
   38   2HB   GLN   5          1HB       GLN   5   1.488 -13.107   1.024
   39   1HG   GLN   5          2HG       GLN   5   2.780 -15.037   1.792
   40   2HG   GLN   5          1HG       GLN   5   3.811 -13.684   1.331
   41   1HE2  GLN   5          1HE2      GLN   5   2.823 -15.784   3.849
   42   2HE2  GLN   5          2HE2      GLN   5   3.874 -15.174   5.076
   43    H    ALA   6           H        ALA   6   4.046 -10.023   2.895
   44    HA   ALA   6           HA       ALA   6   4.542  -9.501   0.054
   45   1HB   ALA   6          1HB       ALA   6   4.034  -7.617   1.671
   46   2HB   ALA   6          2HB       ALA   6   5.475  -7.423   0.672
   47   3HB   ALA   6          3HB       ALA   6   5.632  -7.910   2.360
   48    H    SER   7           H        SER   7   6.503  -9.763  -0.886
   49    HA   SER   7           HA       SER   7   8.767 -10.650   0.720
   50   1HB   SER   7          2HB       SER   7   8.066 -12.802   0.253
   51   2HB   SER   7          1HB       SER   7   7.298 -12.334  -1.264
   52    HG   SER   7           HG       SER   7   9.305 -13.569  -1.440
   53    H    GLY   8           H        GLY   8  10.768 -10.276  -0.249
   54   1HA   GLY   8          2HA       GLY   8  11.727  -9.876  -2.625
   55   2HA   GLY   8          1HA       GLY   8  10.636  -8.502  -2.587
   56    H    GLY   9           H        GLY   9  11.615  -8.887   0.513
   57   1HA   GLY   9          2HA       GLY   9  13.146  -6.550   0.605
   58   2HA   GLY   9          1HA       GLY   9  13.106  -7.778   1.864
   59    H    GLY  10           H        GLY  10  14.818  -6.529  -0.881
   60   1HA   GLY  10          2HA       GLY  10  16.901  -8.586  -0.525
   61   2HA   GLY  10          1HA       GLY  10  16.683  -7.611  -1.967
   62    H    LEU  11           H        LEU  11  19.091  -7.554  -1.462
   63    HA   LEU  11           HA       LEU  11  19.727  -5.334   0.363
   64   1HB   LEU  11          2HB       LEU  11  21.035  -7.845  -0.294
   65   2HB   LEU  11          1HB       LEU  11  22.114  -6.482  -0.512
   66    HG   LEU  11           HG       LEU  11  22.366  -7.446   1.706
   67   1HD1  LEU  11          1HD1      LEU  11  22.938  -5.291   1.995
   68   2HD1  LEU  11          2HD1      LEU  11  21.467  -5.246   2.963
   69   3HD1  LEU  11          3HD1      LEU  11  21.440  -4.683   1.292
   70   1HD2  LEU  11          1HD2      LEU  11  19.452  -6.763   2.062
   71   2HD2  LEU  11          2HD2      LEU  11  20.538  -7.310   3.340
   72   3HD2  LEU  11          3HD2      LEU  11  20.151  -8.381   1.994
   73    H    VAL  12           H        VAL  12  20.117  -3.417  -0.571
   74    HA   VAL  12           HA       VAL  12  21.250  -3.413  -3.293
   75    HB   VAL  12           HB       VAL  12  19.955  -1.469  -3.888
   76   1HG1  VAL  12          1HG1      VAL  12  18.046  -2.571  -4.406
   77   2HG1  VAL  12          2HG1      VAL  12  17.816  -3.178  -2.765
   78   3HG1  VAL  12          3HG1      VAL  12  18.992  -3.945  -3.833
   79   1HG2  VAL  12          1HG2      VAL  12  18.081  -1.447  -1.684
   80   2HG2  VAL  12          2HG2      VAL  12  18.967  -0.114  -2.425
   81   3HG2  VAL  12          3HG2      VAL  12  19.720  -1.073  -1.150
   82    H    GLN  13           H        GLN  13  21.845  -0.952  -3.781
   83    HA   GLN  13           HA       GLN  13  23.338   0.115  -1.488
   84   1HB   GLN  13          2HB       GLN  13  25.192  -0.684  -2.514
   85   2HB   GLN  13          1HB       GLN  13  24.373  -0.886  -4.054
   86   1HG   GLN  13          2HG       GLN  13  24.738   1.904  -3.496
   87   2HG   GLN  13          1HG       GLN  13  26.271   1.046  -3.348
   88   1HE2  GLN  13          1HE2      GLN  13  23.554   1.668  -5.488
   89   2HE2  GLN  13          2HE2      GLN  13  24.407   1.376  -6.961
   90    HA   PRO  14           HA       PRO  14  21.541   4.051  -2.294
   91   1HB   PRO  14          2HB       PRO  14  24.374   5.022  -2.412
   92   2HB   PRO  14          1HB       PRO  14  22.990   5.698  -1.541
   93   1HG   PRO  14          2HG       PRO  14  24.803   4.277  -0.231
   94   2HG   PRO  14          1HG       PRO  14  23.076   4.071   0.124
   95   1HD   PRO  14          2HD       PRO  14  24.924   2.288  -1.388
   96   2HD   PRO  14          1HD       PRO  14  23.543   1.872  -0.354
   97    H    GLY  15           H        GLY  15  20.751   3.639  -4.373
   98   1HA   GLY  15          2HA       GLY  15  20.792   4.986  -6.464
   99   2HA   GLY  15          1HA       GLY  15  22.495   4.568  -6.572
  100    H    GLY  16           H        GLY  16  20.600   2.017  -5.391
  101   1HA   GLY  16          2HA       GLY  16  20.946   0.579  -7.900
  102   2HA   GLY  16          1HA       GLY  16  20.503  -0.120  -6.352
  103    H    SER  17           H        SER  17  18.733  -1.256  -7.005
  104    HA   SER  17           HA       SER  17  16.297   0.207  -7.291
  105   1HB   SER  17          2HB       SER  17  15.645  -0.443  -9.486
  106   2HB   SER  17          1HB       SER  17  17.276   0.211  -9.642
  107    HG   SER  17           HG       SER  17  17.687  -1.629 -10.566
  108    H    LEU  18           H        LEU  18  15.078  -0.892  -5.914
  109    HA   LEU  18           HA       LEU  18  15.207  -3.835  -5.955
  110   1HB   LEU  18          2HB       LEU  18  15.907  -2.709  -3.836
  111   2HB   LEU  18          1HB       LEU  18  14.285  -2.061  -3.695
  112    HG   LEU  18           HG       LEU  18  13.419  -4.407  -3.616
  113   1HD1  LEU  18          1HD1      LEU  18  16.319  -5.148  -3.268
  114   2HD1  LEU  18          2HD1      LEU  18  15.388  -5.426  -4.741
  115   3HD1  LEU  18          3HD1      LEU  18  14.926  -6.231  -3.241
  116   1HD2  LEU  18          1HD2      LEU  18  14.513  -2.851  -1.621
  117   2HD2  LEU  18          2HD2      LEU  18  15.258  -4.429  -1.365
  118   3HD2  LEU  18          3HD2      LEU  18  13.501  -4.276  -1.392
  119    H    ARG  19           H        ARG  19  13.287  -5.024  -5.867
  120    HA   ARG  19           HA       ARG  19  10.815  -3.503  -6.353
  121   1HB   ARG  19          2HB       ARG  19  11.618  -4.379  -8.489
  122   2HB   ARG  19          1HB       ARG  19  11.717  -5.996  -7.807
  123   1HG   ARG  19          2HG       ARG  19   9.326  -6.099  -7.562
  124   2HG   ARG  19          1HG       ARG  19   9.167  -4.416  -8.072
  125   1HD   ARG  19          2HD       ARG  19   9.788  -6.845  -9.682
  126   2HD   ARG  19          1HD       ARG  19   8.668  -5.526 -10.023
  127    HE   ARG  19           HE       ARG  19  10.779  -4.168 -10.390
  128   1HH1  ARG  19          1HH1      ARG  19  10.601  -7.600 -10.949
  129   2HH1  ARG  19          2HH1      ARG  19  11.847  -7.601 -12.152
  130   1HH2  ARG  19          1HH2      ARG  19  12.420  -4.156 -11.977
  131   2HH2  ARG  19          2HH2      ARG  19  12.881  -5.642 -12.736
  132    H    VAL  20           H        VAL  20   9.651  -3.835  -4.568
  133    HA   VAL  20           HA       VAL  20   9.595  -6.533  -3.406
  134    HB   VAL  20           HB       VAL  20   8.801  -5.564  -1.367
  135   1HG1  VAL  20          1HG1      VAL  20  10.982  -3.784  -2.435
  136   2HG1  VAL  20          2HG1      VAL  20  11.223  -5.430  -1.851
  137   3HG1  VAL  20          3HG1      VAL  20  10.659  -4.176  -0.747
  138   1HG2  VAL  20          1HG2      VAL  20   8.408  -3.132  -1.138
  139   2HG2  VAL  20          2HG2      VAL  20   7.272  -3.901  -2.246
  140   3HG2  VAL  20          3HG2      VAL  20   8.619  -2.957  -2.880
  141    H    SER  21           H        SER  21   7.641  -7.576  -2.969
  142    HA   SER  21           HA       SER  21   5.278  -6.441  -4.314
  143   1HB   SER  21          2HB       SER  21   4.671  -8.796  -4.931
  144   2HB   SER  21          1HB       SER  21   6.131  -8.198  -5.718
  145    HG   SER  21           HG       SER  21   6.838  -9.319  -3.419
  146    H    CYS  22           H        CYS  22   3.214  -7.465  -3.633
  147    HA   CYS  22           HA       CYS  22   3.178  -8.527  -0.915
  148   1HB   CYS  22          2HB       CYS  22   2.800  -6.409  -0.150
  149   2HB   CYS  22          1HB       CYS  22   2.250  -5.834  -1.718
  150    H    ALA  23           H        ALA  23   1.689 -10.113  -0.742
  151    HA   ALA  23           HA       ALA  23  -0.478 -10.147  -2.737
  152   1HB   ALA  23          1HB       ALA  23  -0.368 -12.558  -2.808
  153   2HB   ALA  23          2HB       ALA  23   0.917 -12.563  -1.598
  154   3HB   ALA  23          3HB       ALA  23   1.211 -11.875  -3.196
  155    H    ALA  24           H        ALA  24  -2.494 -10.367  -2.018
  156    HA   ALA  24           HA       ALA  24  -2.943 -11.297   0.730
  157   1HB   ALA  24          1HB       ALA  24  -4.845  -9.329   0.409
  158   2HB   ALA  24          2HB       ALA  24  -3.395  -8.617  -0.299
  159   3HB   ALA  24          3HB       ALA  24  -3.367  -9.201   1.366
  160    H    SER  25           H        SER  25  -5.448 -11.470   1.076
  161    HA   SER  25           HA       SER  25  -7.013 -12.076  -1.247
  162   1HB   SER  25          2HB       SER  25  -5.904 -14.330   0.432
  163   2HB   SER  25          1HB       SER  25  -7.339 -14.510  -0.577
  164    HG   SER  25           HG       SER  25  -6.107 -14.622  -2.273
  165    H    GLY  26           H        GLY  26  -9.061 -11.612  -0.746
  166   1HA   GLY  26          2HA       GLY  26 -10.786 -12.468   1.016
  167   2HA   GLY  26          1HA       GLY  26  -9.793 -11.499   2.093
  168    H    PHE  27           H        PHE  27  -9.672  -9.901  -0.760
  169    HA   PHE  27           HA       PHE  27 -12.255  -8.634  -0.694
  170   1HB   PHE  27          2HB       PHE  27 -11.597  -6.460   0.016
  171   2HB   PHE  27          1HB       PHE  27 -11.012  -7.586   1.229
  172    HD1  PHE  27           1HD      PHE  27  -8.565  -8.532  -0.401
  173    HD2  PHE  27           2HD      PHE  27 -10.132  -4.682   0.513
  174    HE1  PHE  27           1HE      PHE  27  -6.314  -7.569  -0.613
  175    HE2  PHE  27           2HE      PHE  27  -7.881  -3.713   0.300
  176    HZ   PHE  27           HZ       PHE  27  -5.967  -5.157  -0.260
  177    H    THR  28           H        THR  28  -9.294  -9.332  -2.144
  178    HA   THR  28           HA       THR  28  -8.513  -9.106  -4.267
  179    HB   THR  28           HB       THR  28 -11.260  -7.993  -4.872
  180    HG1  THR  28           1HG      THR  28 -11.568 -10.188  -5.659
  181   1HG2  THR  28          1HG2      THR  28 -10.082  -7.374  -6.742
  182   2HG2  THR  28          2HG2      THR  28 -10.527  -9.021  -7.190
  183   3HG2  THR  28          3HG2      THR  28  -8.911  -8.682  -6.570
  184    H    PHE  29           H        PHE  29  -7.408  -7.616  -5.498
  185    HA   PHE  29           HA       PHE  29  -7.297  -4.926  -4.401
  186   1HB   PHE  29          2HB       PHE  29  -5.545  -6.582  -6.172
  187   2HB   PHE  29          1HB       PHE  29  -5.384  -4.831  -6.224
  188    HD1  PHE  29           1HD      PHE  29  -6.091  -6.990  -3.274
  189    HD2  PHE  29           2HD      PHE  29  -3.307  -4.463  -5.271
  190    HE1  PHE  29           1HE      PHE  29  -4.603  -7.085  -1.317
  191    HE2  PHE  29           2HE      PHE  29  -1.818  -4.554  -3.317
  192    HZ   PHE  29           HZ       PHE  29  -2.463  -5.868  -1.338
  193    H    SER  30           H        SER  30  -6.600  -3.298  -6.350
  194    HA   SER  30           HA       SER  30  -7.375  -1.959  -8.012
  195   1HB   SER  30          2HB       SER  30  -8.019  -4.693  -9.061
  196   2HB   SER  30          1HB       SER  30  -8.541  -3.263  -9.953
  197    HG   SER  30           HG       SER  30  -5.945  -3.095  -9.150
  198    H    SER  31           H        SER  31  -9.315  -3.285  -5.836
  199    HA   SER  31           HA       SER  31 -11.707  -1.933  -6.892
  200   1HB   SER  31          2HB       SER  31 -11.849  -4.315  -5.047
  201   2HB   SER  31          1HB       SER  31 -13.134  -3.611  -6.030
  202    HG   SER  31           HG       SER  31 -12.052  -4.364  -7.877
  203    H    TYR  32           H        TYR  32  -9.516  -2.497  -4.315
  204    HA   TYR  32           HA       TYR  32 -11.051  -0.693  -2.558
  205   1HB   TYR  32          2HB       TYR  32  -9.428  -3.127  -2.012
  206   2HB   TYR  32          1HB       TYR  32  -9.336  -1.822  -0.837
  207    HD1  TYR  32           1HD      TYR  32 -11.187  -1.315   0.599
  208    HD2  TYR  32           2HD      TYR  32 -11.554  -4.290  -2.419
  209    HE1  TYR  32           1HE      TYR  32 -13.268  -2.106   1.642
  210    HE2  TYR  32           2HE      TYR  32 -13.636  -5.090  -1.386
  211    HH   TYR  32           HH       TYR  32 -14.889  -3.626   1.599
  212    H    HIS  33           H        HIS  33  -9.318   0.211  -0.837
  213    HA   HIS  33           HA       HIS  33  -7.379   1.677  -2.459
  214   1HB   HIS  33          2HB       HIS  33  -8.177   2.106   0.432
  215   2HB   HIS  33          1HB       HIS  33  -7.202   3.189  -0.556
  216    HD1  HIS  33           1HD      HIS  33 -10.631   2.519   0.434
  217    HD2  HIS  33           2HD      HIS  33  -8.733   4.345  -2.780
  218    HE1  HIS  33           1HE      HIS  33 -12.402   3.902  -0.697
  219    HE2  HIS  33           2HE      HIS  33 -11.226   5.018  -2.625
  220    H    MET  34           H        MET  34  -5.174   1.543  -2.138
  221    HA   MET  34           HA       MET  34  -4.230  -0.221   0.005
  222   1HB   MET  34          2HB       MET  34  -3.659  -0.521  -2.933
  223   2HB   MET  34          1HB       MET  34  -2.636  -1.244  -1.699
  224   1HG   MET  34          2HG       MET  34  -5.560  -1.783  -2.153
  225   2HG   MET  34          1HG       MET  34  -4.222  -2.864  -2.538
  226   1HE   MET  34          1HE       MET  34  -2.997  -4.129   0.843
  227   2HE   MET  34          2HE       MET  34  -2.402  -2.533   0.389
  228   3HE   MET  34          3HE       MET  34  -2.608  -3.781  -0.842
  229    H    ALA  35           H        ALA  35  -1.923  -0.061   0.422
  230    HA   ALA  35           HA       ALA  35  -0.392   2.055  -0.739
  231   1HB   ALA  35          1HB       ALA  35  -0.212   3.369   1.397
  232   2HB   ALA  35          2HB       ALA  35  -1.608   2.466   1.982
  233   3HB   ALA  35          3HB       ALA  35  -1.759   3.496   0.559
  234    H    TRP  36           H        TRP  36   1.749   2.197   0.131
  235    HA   TRP  36           HA       TRP  36   2.545  -0.245   1.551
  236   1HB   TRP  36          2HB       TRP  36   3.862   1.429  -0.544
  237   2HB   TRP  36          1HB       TRP  36   4.876   0.528   0.579
  238    HD1  TRP  36           HD       TRP  36   2.219  -0.013  -2.136
  239    HE1  TRP  36           1HE      TRP  36   2.404  -2.415  -3.024
  240    HE3  TRP  36           3HE      TRP  36   5.727  -1.806   1.128
  241    HZ2  TRP  36           2HZ      TRP  36   3.861  -4.760  -2.429
  242    HZ3  TRP  36           3HZ      TRP  36   6.457  -4.150   0.898
  243    HH2  TRP  36           HH       TRP  36   5.543  -5.590  -0.845
  244    H    VAL  37           H        VAL  37   3.858  -0.177   3.303
  245    HA   VAL  37           HA       VAL  37   4.466   2.474   4.425
  246    HB   VAL  37           HB       VAL  37   4.055   1.504   6.686
  247   1HG1  VAL  37          1HG1      VAL  37   2.160   2.634   6.441
  248   2HG1  VAL  37          2HG1      VAL  37   1.403   1.140   5.880
  249   3HG1  VAL  37          3HG1      VAL  37   2.104   2.268   4.716
  250   1HG2  VAL  37          1HG2      VAL  37   2.288  -0.604   5.856
  251   2HG2  VAL  37          2HG2      VAL  37   3.631  -0.651   6.998
  252   3HG2  VAL  37          3HG2      VAL  37   3.926  -0.908   5.278
  253    H    ARG  38           H        ARG  38   6.140   2.356   6.164
  254    HA   ARG  38           HA       ARG  38   8.014   0.139   5.912
  255   1HB   ARG  38          2HB       ARG  38   8.940   1.537   4.272
  256   2HB   ARG  38          1HB       ARG  38   8.580   2.999   5.176
  257   1HG   ARG  38          2HG       ARG  38  10.271   1.987   6.896
  258   2HG   ARG  38          1HG       ARG  38  10.825   1.070   5.494
  259   1HD   ARG  38          2HD       ARG  38  12.126   3.090   5.704
  260   2HD   ARG  38          1HD       ARG  38  11.115   3.187   4.263
  261    HE   ARG  38           HE       ARG  38   9.650   4.392   6.236
  262   1HH1  ARG  38          1HH1      ARG  38  12.804   4.868   4.831
  263   2HH1  ARG  38          2HH1      ARG  38  12.830   6.570   5.150
  264   1HH2  ARG  38          1HH2      ARG  38   9.676   6.633   6.656
  265   2HH2  ARG  38          2HH2      ARG  38  11.054   7.573   6.187
  266    H    GLN  39           H        GLN  39   9.483  -0.017   7.669
  267    HA   GLN  39           HA       GLN  39   8.946   1.770   9.933
  268   1HB   GLN  39          2HB       GLN  39   7.846  -0.691   9.832
  269   2HB   GLN  39          1HB       GLN  39   9.394  -1.087  10.566
  270   1HG   GLN  39          2HG       GLN  39   8.085   1.232  11.770
  271   2HG   GLN  39          1HG       GLN  39   7.156  -0.264  11.894
  272   1HE2  GLN  39          1HE2      GLN  39  10.357   1.105  12.474
  273   2HE2  GLN  39          2HE2      GLN  39  10.740   0.095  13.822
  274    H    ALA  40           H        ALA  40  10.843   2.779  10.102
  275    HA   ALA  40           HA       ALA  40  13.357   1.481   9.608
  276   1HB   ALA  40          1HB       ALA  40  14.122   3.776  10.724
  277   2HB   ALA  40          2HB       ALA  40  12.465   4.218  10.310
  278   3HB   ALA  40          3HB       ALA  40  13.574   3.674   9.051
  279    HA   PRO  41           HA       PRO  41  14.496  -0.282  13.483
  280   1HB   PRO  41          2HB       PRO  41  16.888   1.508  13.301
  281   2HB   PRO  41          1HB       PRO  41  16.803  -0.222  13.659
  282   1HG   PRO  41          2HG       PRO  41  17.538   0.627  11.246
  283   2HG   PRO  41          1HG       PRO  41  16.509  -0.804  11.435
  284   1HD   PRO  41          2HD       PRO  41  15.800   1.928  10.505
  285   2HD   PRO  41          1HD       PRO  41  15.087   0.363  10.068
  286    H    GLY  42           H        GLY  42  13.244   0.408  15.130
  287   1HA   GLY  42          2HA       GLY  42  13.035   1.532  17.189
  288   2HA   GLY  42          1HA       GLY  42  14.119   2.780  16.593
  289    H    LYS  43           H        LYS  43  11.091   1.436  15.301
  290    HA   LYS  43           HA       LYS  43   9.697   3.932  15.787
  291   1HB   LYS  43          2HB       LYS  43  11.020   3.664  13.384
  292   2HB   LYS  43          1HB       LYS  43   9.399   3.114  12.989
  293   1HG   LYS  43          2HG       LYS  43   8.475   5.168  13.286
  294   2HG   LYS  43          1HG       LYS  43   9.651   5.643  14.514
  295   1HD   LYS  43          2HD       LYS  43  10.828   5.197  11.876
  296   2HD   LYS  43          1HD       LYS  43   9.630   6.492  11.902
  297   1HE   LYS  43          2HE       LYS  43  11.581   7.617  12.421
  298   2HE   LYS  43          1HE       LYS  43  10.903   7.288  14.014
  299   1HZ   LYS  43          1HZ       LYS  43  12.801   5.387  12.811
  300   2HZ   LYS  43          2HZ       LYS  43  12.467   5.674  14.443
  301   3HZ   LYS  43          3HZ       LYS  43  13.380   6.790  13.560
  302    H    GLY  44           H        GLY  44   7.465   3.637  14.341
  303   1HA   GLY  44          2HA       GLY  44   6.430   1.021  15.240
  304   2HA   GLY  44          1HA       GLY  44   5.476   2.496  15.164
  305    H    LEU  45           H        LEU  45   6.274   3.408  12.655
  306    HA   LEU  45           HA       LEU  45   6.351   1.855  10.469
  307   1HB   LEU  45          2HB       LEU  45   4.201   0.851  11.630
  308   2HB   LEU  45          1HB       LEU  45   3.416   2.228  10.885
  309    HG   LEU  45           HG       LEU  45   3.838   1.444   8.709
  310   1HD1  LEU  45          1HD1      LEU  45   5.336  -0.376   8.163
  311   2HD1  LEU  45          2HD1      LEU  45   5.725  -0.598   9.869
  312   3HD1  LEU  45          3HD1      LEU  45   6.207   0.882   9.041
  313   1HD2  LEU  45          1HD2      LEU  45   3.226  -0.896  10.501
  314   2HD2  LEU  45          2HD2      LEU  45   3.032  -0.910   8.748
  315   3HD2  LEU  45          3HD2      LEU  45   2.074   0.197   9.732
  316    H    GLU  46           H        GLU  46   5.391   2.873   8.491
  317    HA   GLU  46           HA       GLU  46   4.411   5.572   8.736
  318   1HB   GLU  46          2HB       GLU  46   6.462   6.516   8.762
  319   2HB   GLU  46          1HB       GLU  46   7.253   5.029   8.261
  320   1HG   GLU  46          2HG       GLU  46   7.275   5.616   6.087
  321   2HG   GLU  46          1HG       GLU  46   5.693   6.395   6.170
  322    H    TRP  47           H        TRP  47   3.129   6.024   7.036
  323    HA   TRP  47           HA       TRP  47   2.954   4.076   4.908
  324   1HB   TRP  47          2HB       TRP  47   0.810   4.754   5.393
  325   2HB   TRP  47          1HB       TRP  47   1.309   6.391   5.816
  326    HD1  TRP  47           HD       TRP  47   0.727   4.215   2.659
  327    HE1  TRP  47           1HE      TRP  47   0.086   5.789   0.731
  328    HE3  TRP  47           3HE      TRP  47   1.294   8.712   5.038
  329    HZ2  TRP  47           2HZ      TRP  47  -0.152   8.565   0.271
  330    HZ3  TRP  47           3HZ      TRP  47   0.841  10.777   3.781
  331    HH2  TRP  47           HH       TRP  47   0.133  10.704   1.446
  332    H    VAL  48           H        VAL  48   4.409   4.183   3.309
  333    HA   VAL  48           HA       VAL  48   5.717   6.660   2.667
  334    HB   VAL  48           HB       VAL  48   6.706   5.248   0.754
  335   1HG1  VAL  48          1HG1      VAL  48   7.415   5.664   3.392
  336   2HG1  VAL  48          2HG1      VAL  48   8.465   5.063   2.108
  337   3HG1  VAL  48          3HG1      VAL  48   7.622   3.927   3.163
  338   1HG2  VAL  48          1HG2      VAL  48   5.402   3.375   0.529
  339   2HG2  VAL  48          2HG2      VAL  48   5.200   3.181   2.275
  340   3HG2  VAL  48          3HG2      VAL  48   6.738   2.774   1.513
  341    H    SER  49           H        SER  49   3.848   4.367   0.688
  342    HA   SER  49           HA       SER  49   2.908   6.700  -0.859
  343   1HB   SER  49          2HB       SER  49   3.344   4.117  -2.272
  344   2HB   SER  49          1HB       SER  49   3.466   5.769  -2.880
  345    HG   SER  49           HG       SER  49   5.502   4.590  -2.571
  346    H    THR  50           H        THR  50   0.916   6.539  -1.915
  347    HA   THR  50           HA       THR  50  -0.827   4.319  -1.079
  348    HB   THR  50           HB       THR  50  -1.131   7.175  -0.483
  349    HG1  THR  50           1HG      THR  50  -2.889   5.280   0.528
  350   1HG2  THR  50          1HG2      THR  50  -2.714   7.043  -2.373
  351   2HG2  THR  50          2HG2      THR  50  -3.534   7.303  -0.834
  352   3HG2  THR  50          3HG2      THR  50  -3.533   5.702  -1.572
  353    H    ILE  51           H        ILE  51  -2.554   3.849  -2.533
  354    HA   ILE  51           HA       ILE  51  -2.367   5.151  -5.159
  355    HB   ILE  51           HB       ILE  51  -1.119   3.003  -5.183
  356   1HG1  ILE  51          2HG1      ILE  51  -3.362   2.358  -6.954
  357   2HG1  ILE  51          1HG1      ILE  51  -2.845   4.039  -7.053
  358   1HG2  ILE  51          1HG2      ILE  51  -3.259   1.167  -5.344
  359   2HG2  ILE  51          2HG2      ILE  51  -3.444   2.064  -3.837
  360   3HG2  ILE  51          3HG2      ILE  51  -1.939   1.209  -4.174
  361   1HD1  ILE  51          1HD1      ILE  51  -1.577   2.982  -8.672
  362   2HD1  ILE  51          2HD1      ILE  51  -1.304   1.557  -7.671
  363   3HD1  ILE  51          3HD1      ILE  51  -0.479   3.070  -7.295
  364    H    ASN  52           H        ASN  52  -4.272   5.488  -6.200
  365    HA   ASN  52           HA       ASN  52  -6.705   4.428  -4.922
  366   1HB   ASN  52          2HB       ASN  52  -6.505   6.759  -4.314
  367   2HB   ASN  52          1HB       ASN  52  -6.224   7.216  -5.992
  368   1HD2  ASN  52          1HD2      ASN  52  -7.924   8.414  -6.511
  369   2HD2  ASN  52          2HD2      ASN  52  -9.576   7.940  -6.338
  370    HA   PRO  53           HA       PRO  53  -7.183   2.960  -9.166
  371   1HB   PRO  53          2HB       PRO  53  -9.370   1.426  -8.674
  372   2HB   PRO  53          1HB       PRO  53  -7.726   0.906  -8.288
  373   1HG   PRO  53          2HG       PRO  53  -9.806   2.096  -6.490
  374   2HG   PRO  53          1HG       PRO  53  -8.725   0.721  -6.193
  375   1HD   PRO  53          2HD       PRO  53  -8.224   3.183  -5.206
  376   2HD   PRO  53          1HD       PRO  53  -6.923   2.082  -5.704
  377    H    GLY  54           H        GLY  54  -9.060   2.911 -10.714
  378   1HA   GLY  54          2HA       GLY  54 -10.993   3.811 -11.633
  379   2HA   GLY  54          1HA       GLY  54 -11.324   4.597 -10.097
  380    H    ASP  55           H        ASP  55  -8.187   5.278 -10.926
  381    HA   ASP  55           HA       ASP  55  -8.659   7.398 -12.798
  382   1HB   ASP  55          2HB       ASP  55  -9.358   8.134 -10.327
  383   2HB   ASP  55          1HB       ASP  55  -7.629   8.443 -10.210
  384    H    GLY  56           H        GLY  56  -6.388   6.723 -10.114
  385   1HA   GLY  56          2HA       GLY  56  -4.251   5.628 -10.793
  386   2HA   GLY  56          1HA       GLY  56  -4.217   6.785 -12.117
  387    H    SER  57           H        SER  57  -5.482   8.493  -9.676
  388    HA   SER  57           HA       SER  57  -3.247  10.116  -9.278
  389   1HB   SER  57          2HB       SER  57  -5.856   9.795  -7.822
  390   2HB   SER  57          1HB       SER  57  -4.613  10.867  -7.180
  391    HG   SER  57           HG       SER  57  -4.623  11.865  -9.318
  392    H    THR  58           H        THR  58  -1.578  10.086  -7.881
  393    HA   THR  58           HA       THR  58  -1.583   7.993  -5.806
  394    HB   THR  58           HB       THR  58   1.099   8.585  -6.532
  395    HG1  THR  58           1HG      THR  58   0.267   7.443  -8.803
  396   1HG2  THR  58          1HG2      THR  58   1.063   6.163  -7.201
  397   2HG2  THR  58          2HG2      THR  58  -0.673   6.169  -6.882
  398   3HG2  THR  58          3HG2      THR  58   0.467   6.492  -5.574
  399    H    TYR  59           H        TYR  59  -0.933   8.551  -3.810
  400    HA   TYR  59           HA       TYR  59   0.170  11.254  -3.420
  401   1HB   TYR  59          2HB       TYR  59  -1.643   9.954  -1.403
  402   2HB   TYR  59          1HB       TYR  59  -1.238  11.658  -1.586
  403    HD1  TYR  59           1HD      TYR  59  -3.256   8.888  -2.939
  404    HD2  TYR  59           2HD      TYR  59  -2.463  13.067  -3.089
  405    HE1  TYR  59           1HE      TYR  59  -5.311   9.227  -4.249
  406    HE2  TYR  59           2HE      TYR  59  -4.516  13.416  -4.399
  407    HH   TYR  59           HH       TYR  59  -5.996  12.095  -5.893
  408    H    TYR  60           H        TYR  60   1.912  11.403  -2.115
  409    HA   TYR  60           HA       TYR  60   2.766   8.946  -0.728
  410   1HB   TYR  60          2HB       TYR  60   4.373  11.061  -2.157
  411   2HB   TYR  60          1HB       TYR  60   5.108   9.943  -1.015
  412    HD1  TYR  60           1HD      TYR  60   6.294   8.284  -2.074
  413    HD2  TYR  60           2HD      TYR  60   2.639   9.597  -3.812
  414    HE1  TYR  60           1HE      TYR  60   6.557   6.624  -3.870
  415    HE2  TYR  60           2HE      TYR  60   2.891   7.941  -5.611
  416    HH   TYR  60           HH       TYR  60   4.779   6.686  -6.708
  417    H    ALA  61           H        ALA  61   4.488   9.519   1.009
  418    HA   ALA  61           HA       ALA  61   3.189  11.221   2.922
  419   1HB   ALA  61          1HB       ALA  61   4.814   9.000   3.089
  420   2HB   ALA  61          2HB       ALA  61   4.303  10.014   4.439
  421   3HB   ALA  61          3HB       ALA  61   5.855  10.307   3.655
  422    H    ASP  62           H        ASP  62   4.774  12.144   0.380
  423    HA   ASP  62           HA       ASP  62   5.724  14.118  -0.234
  424   1HB   ASP  62          2HB       ASP  62   4.569  14.841   2.104
  425   2HB   ASP  62          1HB       ASP  62   6.264  15.112   2.498
  426    H    SER  63           H        SER  63   7.187  12.563   2.592
  427    HA   SER  63           HA       SER  63   9.847  13.359   1.723
  428   1HB   SER  63          2HB       SER  63   8.699  12.812   4.219
  429   2HB   SER  63          1HB       SER  63   9.805  11.471   3.923
  430    HG   SER  63           HG       SER  63  10.456  14.232   3.777
  431    H    VAL  64           H        VAL  64   7.968  11.330   0.370
  432    HA   VAL  64           HA       VAL  64  10.055   9.323  -0.066
  433    HB   VAL  64           HB       VAL  64   8.078   7.631  -0.283
  434   1HG1  VAL  64          1HG1      VAL  64   8.270   7.586   2.449
  435   2HG1  VAL  64          2HG1      VAL  64   9.716   8.481   1.981
  436   3HG1  VAL  64          3HG1      VAL  64   9.429   6.868   1.330
  437   1HG2  VAL  64          1HG2      VAL  64   6.934   9.623   1.671
  438   2HG2  VAL  64          2HG2      VAL  64   6.270   8.032   1.297
  439   3HG2  VAL  64          3HG2      VAL  64   6.308   9.285   0.057
  440    H    LYS  65           H        LYS  65   7.917  11.535  -1.327
  441    HA   LYS  65           HA       LYS  65   7.103  10.242  -3.718
  442   1HB   LYS  65          2HB       LYS  65   6.176  12.414  -2.714
  443   2HB   LYS  65          1HB       LYS  65   7.565  13.209  -3.444
  444   1HG   LYS  65          2HG       LYS  65   6.159  13.500  -5.170
  445   2HG   LYS  65          1HG       LYS  65   6.627  11.847  -5.570
  446   1HD   LYS  65          2HD       LYS  65   4.503  11.215  -5.377
  447   2HD   LYS  65          1HD       LYS  65   4.527  11.695  -3.678
  448   1HE   LYS  65          2HE       LYS  65   2.781  12.953  -4.530
  449   2HE   LYS  65          1HE       LYS  65   4.133  14.081  -4.598
  450   1HZ   LYS  65          1HZ       LYS  65   2.575  12.981  -6.730
  451   2HZ   LYS  65          2HZ       LYS  65   4.235  12.797  -6.993
  452   3HZ   LYS  65          3HZ       LYS  65   3.587  14.336  -6.724
  453    H    GLY  66           H        GLY  66   8.102  10.066  -5.690
  454   1HA   GLY  66          2HA       GLY  66   9.787  10.210  -7.271
  455   2HA   GLY  66          1HA       GLY  66  10.486  11.528  -6.339
  456    H    ARG  67           H        ARG  67   9.985   9.149  -4.194
  457    HA   ARG  67           HA       ARG  67  12.762   8.225  -4.349
  458   1HB   ARG  67          2HB       ARG  67  11.568   9.267  -2.244
  459   2HB   ARG  67          1HB       ARG  67  10.924   7.640  -2.054
  460   1HG   ARG  67          2HG       ARG  67  12.834   7.691  -0.717
  461   2HG   ARG  67          1HG       ARG  67  13.339   6.847  -2.184
  462   1HD   ARG  67          2HD       ARG  67  15.036   8.433  -1.574
  463   2HD   ARG  67          1HD       ARG  67  14.236   8.979  -3.048
  464    HE   ARG  67           HE       ARG  67  13.425  10.065  -0.441
  465   1HH1  ARG  67          1HH1      ARG  67  14.760  10.521  -3.629
  466   2HH1  ARG  67          2HH1      ARG  67  14.658  12.248  -3.564
  467   1HH2  ARG  67          1HH2      ARG  67  13.280  12.339  -0.353
  468   2HH2  ARG  67          2HH2      ARG  67  13.817  13.280  -1.704
  469    H    PHE  68           H        PHE  68   9.673   6.856  -3.286
  470    HA   PHE  68           HA       PHE  68  10.480   4.265  -4.412
  471   1HB   PHE  68          2HB       PHE  68   8.416   4.976  -2.321
  472   2HB   PHE  68          1HB       PHE  68   8.687   3.347  -2.926
  473    HD1  PHE  68           1HD      PHE  68   8.785   3.795  -0.101
  474    HD2  PHE  68           2HD      PHE  68  11.864   4.345  -2.996
  475    HE1  PHE  68           1HE      PHE  68  10.491   3.460   1.644
  476    HE2  PHE  68           2HE      PHE  68  13.567   4.005  -1.250
  477    HZ   PHE  68           HZ       PHE  68  12.877   3.562   1.069
  478    H    THR  69           H        THR  69   8.768   2.963  -5.433
  479    HA   THR  69           HA       THR  69   6.755   4.651  -6.773
  480    HB   THR  69           HB       THR  69   8.409   2.411  -7.942
  481    HG1  THR  69           1HG      THR  69   8.044   5.157  -8.621
  482   1HG2  THR  69          1HG2      THR  69   7.075   2.488  -9.927
  483   2HG2  THR  69          2HG2      THR  69   6.124   3.837  -9.305
  484   3HG2  THR  69          3HG2      THR  69   5.974   2.241  -8.570
  485    H    ILE  70           H        ILE  70   4.818   4.133  -6.108
  486    HA   ILE  70           HA       ILE  70   4.253   1.376  -5.300
  487    HB   ILE  70           HB       ILE  70   3.800   3.232  -3.696
  488   1HG1  ILE  70          2HG1      ILE  70   1.992   1.106  -4.517
  489   2HG1  ILE  70          1HG1      ILE  70   2.498   1.594  -2.905
  490   1HG2  ILE  70          1HG2      ILE  70   3.067   4.857  -5.446
  491   2HG2  ILE  70          2HG2      ILE  70   2.008   4.770  -4.038
  492   3HG2  ILE  70          3HG2      ILE  70   1.540   3.979  -5.544
  493   1HD1  ILE  70          1HD1      ILE  70   0.313   2.919  -4.484
  494   2HD1  ILE  70          2HD1      ILE  70   0.772   3.258  -2.815
  495   3HD1  ILE  70          3HD1      ILE  70   0.067   1.697  -3.237
  496    H    SER  71           H        SER  71   3.189   0.111  -6.647
  497    HA   SER  71           HA       SER  71   0.986   1.069  -8.232
  498   1HB   SER  71          2HB       SER  71   2.763   1.685  -9.745
  499   2HB   SER  71          1HB       SER  71   3.525   0.103  -9.569
  500    HG   SER  71           HG       SER  71   2.233   0.372 -11.500
  501    H    ARG  72           H        ARG  72  -0.164  -0.666  -9.296
  502    HA   ARG  72           HA       ARG  72   0.568  -3.377  -8.469
  503   1HB   ARG  72          2HB       ARG  72  -1.928  -3.672  -7.830
  504   2HB   ARG  72          1HB       ARG  72  -0.836  -2.921  -6.675
  505   1HG   ARG  72          2HG       ARG  72  -1.619  -0.696  -7.532
  506   2HG   ARG  72          1HG       ARG  72  -2.851  -1.568  -8.447
  507   1HD   ARG  72          2HD       ARG  72  -3.334  -2.656  -6.094
  508   2HD   ARG  72          1HD       ARG  72  -2.583  -1.172  -5.508
  509    HE   ARG  72           HE       ARG  72  -4.396  -0.237  -7.249
  510   1HH1  ARG  72          1HH1      ARG  72  -4.633  -2.547  -4.652
  511   2HH1  ARG  72          2HH1      ARG  72  -6.294  -2.189  -4.314
  512   1HH2  ARG  72          1HH2      ARG  72  -6.585   0.238  -6.813
  513   2HH2  ARG  72          2HH2      ARG  72  -7.403  -0.610  -5.543
  514    H    ASP  73           H        ASP  73  -1.160  -4.965  -9.385
  515    HA   ASP  73           HA       ASP  73  -1.619  -4.191 -12.182
  516   1HB   ASP  73          2HB       ASP  73  -0.405  -6.463 -11.033
  517   2HB   ASP  73          1HB       ASP  73  -1.936  -7.015 -11.708
  518    H    ASN  74           H        ASN  74  -3.474  -5.646 -13.160
  519    HA   ASN  74           HA       ASN  74  -5.823  -5.188 -11.455
  520   1HB   ASN  74          2HB       ASN  74  -6.361  -5.784 -14.261
  521   2HB   ASN  74          1HB       ASN  74  -6.912  -4.433 -13.274
  522   1HD2  ASN  74          1HD2      ASN  74  -4.479  -5.598 -15.446
  523   2HD2  ASN  74          2HD2      ASN  74  -3.718  -4.075 -15.741
  524    H    ALA  75           H        ALA  75  -7.571  -6.723 -11.519
  525    HA   ALA  75           HA       ALA  75  -8.430  -8.811 -11.266
  526   1HB   ALA  75          1HB       ALA  75  -6.812  -9.061 -13.755
  527   2HB   ALA  75          2HB       ALA  75  -8.558  -9.166 -13.528
  528   3HB   ALA  75          3HB       ALA  75  -7.522 -10.510 -13.046
  529    H    LYS  76           H        LYS  76  -5.990  -8.068  -9.798
  530    HA   LYS  76           HA       LYS  76  -5.374 -10.687  -8.776
  531   1HB   LYS  76          2HB       LYS  76  -3.700  -9.749 -10.770
  532   2HB   LYS  76          1HB       LYS  76  -2.860  -9.299  -9.294
  533   1HG   LYS  76          2HG       LYS  76  -2.885 -11.591  -8.532
  534   2HG   LYS  76          1HG       LYS  76  -3.828 -12.075  -9.943
  535   1HD   LYS  76          2HD       LYS  76  -1.935 -11.236 -11.368
  536   2HD   LYS  76          1HD       LYS  76  -0.998 -11.041  -9.886
  537   1HE   LYS  76          2HE       LYS  76  -0.350 -13.138 -10.642
  538   2HE   LYS  76          1HE       LYS  76  -1.594 -13.511  -9.449
  539   1HZ   LYS  76          1HZ       LYS  76  -2.318 -13.205 -12.287
  540   2HZ   LYS  76          2HZ       LYS  76  -3.102 -14.086 -11.075
  541   3HZ   LYS  76          3HZ       LYS  76  -1.657 -14.663 -11.736
  542    H    ASN  77           H        ASN  77  -4.821 -10.629  -6.662
  543    HA   ASN  77           HA       ASN  77  -4.891  -8.044  -5.340
  544   1HB   ASN  77          2HB       ASN  77  -4.519  -9.854  -3.334
  545   2HB   ASN  77          1HB       ASN  77  -6.092  -9.374  -3.955
  546   1HD2  ASN  77          1HD2      ASN  77  -7.294 -11.136  -3.937
  547   2HD2  ASN  77          2HD2      ASN  77  -6.859 -12.663  -4.617
  548    H    THR  78           H        THR  78  -2.827  -7.265  -6.121
  549    HA   THR  78           HA       THR  78  -0.657  -8.123  -4.396
  550    HB   THR  78           HB       THR  78   0.568  -7.861  -6.928
  551    HG1  THR  78           1HG      THR  78  -0.916  -8.658  -8.211
  552   1HG2  THR  78          1HG2      THR  78   0.460  -9.687  -4.700
  553   2HG2  THR  78          2HG2      THR  78   1.773  -9.394  -5.842
  554   3HG2  THR  78          3HG2      THR  78   0.519 -10.575  -6.224
  555    H    LEU  79           H        LEU  79   0.835  -6.584  -3.968
  556    HA   LEU  79           HA       LEU  79   0.528  -3.972  -5.300
  557   1HB   LEU  79          2HB       LEU  79   0.154  -4.626  -2.570
  558   2HB   LEU  79          1HB       LEU  79   1.655  -3.729  -2.665
  559    HG   LEU  79           HG       LEU  79  -1.067  -2.806  -3.556
  560   1HD1  LEU  79          1HD1      LEU  79  -1.221  -2.126  -1.451
  561   2HD1  LEU  79          2HD1      LEU  79   0.035  -0.950  -1.833
  562   3HD1  LEU  79          3HD1      LEU  79   0.469  -2.508  -1.130
  563   1HD2  LEU  79          1HD2      LEU  79   0.953  -0.766  -3.568
  564   2HD2  LEU  79          2HD2      LEU  79  -0.186  -1.228  -4.832
  565   3HD2  LEU  79          3HD2      LEU  79   1.359  -2.067  -4.688
  566    H    TYR  80           H        TYR  80   2.395  -3.013  -5.997
  567    HA   TYR  80           HA       TYR  80   4.921  -4.348  -5.286
  568   1HB   TYR  80          2HB       TYR  80   4.030  -3.367  -7.997
  569   2HB   TYR  80          1HB       TYR  80   5.682  -3.844  -7.625
  570    HD1  TYR  80           1HD      TYR  80   6.315  -6.120  -7.611
  571    HD2  TYR  80           2HD      TYR  80   2.201  -5.073  -7.847
  572    HE1  TYR  80           1HE      TYR  80   5.760  -8.456  -8.132
  573    HE2  TYR  80           2HE      TYR  80   1.628  -7.404  -8.367
  574    HH   TYR  80           HH       TYR  80   2.949  -9.794  -7.803
  575    H    LEU  81           H        LEU  81   6.686  -3.090  -4.931
  576    HA   LEU  81           HA       LEU  81   6.415  -0.205  -5.356
  577   1HB   LEU  81          2HB       LEU  81   5.960  -0.827  -2.945
  578   2HB   LEU  81          1HB       LEU  81   7.624  -1.369  -2.855
  579    HG   LEU  81           HG       LEU  81   8.108   1.086  -3.749
  580   1HD1  LEU  81          1HD1      LEU  81   6.114   2.123  -1.985
  581   2HD1  LEU  81          2HD1      LEU  81   5.338   1.202  -3.280
  582   3HD1  LEU  81          3HD1      LEU  81   6.436   2.527  -3.674
  583   1HD2  LEU  81          1HD2      LEU  81   9.027   1.360  -1.745
  584   2HD2  LEU  81          2HD2      LEU  81   8.361  -0.227  -1.353
  585   3HD2  LEU  81          3HD2      LEU  81   7.474   1.236  -0.920
  586    H    GLN  82           H        GLN  82   8.131   0.694  -6.286
  587    HA   GLN  82           HA       GLN  82  10.545  -0.950  -6.574
  588   1HB   GLN  82          2HB       GLN  82   9.183   0.004  -8.587
  589   2HB   GLN  82          1HB       GLN  82   9.977   1.520  -8.186
  590   1HG   GLN  82          2HG       GLN  82  11.314   0.577  -9.839
  591   2HG   GLN  82          1HG       GLN  82  12.163   0.224  -8.335
  592   1HE2  GLN  82          1HE2      GLN  82  13.222  -1.582  -8.951
  593   2HE2  GLN  82          2HE2      GLN  82  12.447  -3.053  -9.419
  594    H    MET  83           H        MET  83  11.900  -0.490  -4.965
  595    HA   MET  83           HA       MET  83  12.058   2.168  -3.850
  596   1HB   MET  83          2HB       MET  83  13.360  -0.463  -3.243
  597   2HB   MET  83          1HB       MET  83  13.990   1.018  -2.531
  598   1HG   MET  83          2HG       MET  83  11.811   1.469  -1.531
  599   2HG   MET  83          1HG       MET  83  11.173  -0.007  -2.253
  600   1HE   MET  83          1HE       MET  83  10.352  -0.924   0.181
  601   2HE   MET  83          2HE       MET  83  11.423  -2.251   0.632
  602   3HE   MET  83          3HE       MET  83  10.938  -2.041  -1.051
  603    H    ASN  84           H        ASN  84  12.954   3.617  -5.174
  604    HA   ASN  84           HA       ASN  84  15.644   3.028  -6.233
  605   1HB   ASN  84          2HB       ASN  84  14.377   5.334  -7.454
  606   2HB   ASN  84          1HB       ASN  84  15.055   3.899  -8.215
  607   1HD2  ASN  84          1HD2      ASN  84  13.725   2.309  -8.904
  608   2HD2  ASN  84          2HD2      ASN  84  12.002   2.383  -8.814
  609    H    SER  85           H        SER  85  16.915   5.165  -6.588
  610    HA   SER  85           HA       SER  85  18.089   6.837  -5.578
  611   1HB   SER  85          2HB       SER  85  15.228   7.557  -5.144
  612   2HB   SER  85          1HB       SER  85  16.450   8.490  -4.280
  613    HG   SER  85           HG       SER  85  17.464   8.665  -6.467
  614    H    LEU  86           H        LEU  86  18.259   4.531  -4.181
  615    HA   LEU  86           HA       LEU  86  17.513   4.740  -1.451
  616   1HB   LEU  86          2HB       LEU  86  19.733   3.077  -2.642
  617   2HB   LEU  86          1HB       LEU  86  18.966   2.831  -1.087
  618    HG   LEU  86           HG       LEU  86  17.984   1.194  -2.390
  619   1HD1  LEU  86          1HD1      LEU  86  16.348   2.971  -1.374
  620   2HD1  LEU  86          2HD1      LEU  86  15.745   1.673  -2.405
  621   3HD1  LEU  86          3HD1      LEU  86  15.981   3.290  -3.069
  622   1HD2  LEU  86          1HD2      LEU  86  18.148   3.189  -4.611
  623   2HD2  LEU  86          2HD2      LEU  86  17.057   1.808  -4.722
  624   3HD2  LEU  86          3HD2      LEU  86  18.792   1.549  -4.529
  625    H    LYS  87           H        LYS  87  18.894   5.030   0.379
  626    HA   LYS  87           HA       LYS  87  21.504   6.213  -0.020
  627   1HB   LYS  87          2HB       LYS  87  20.918   8.257   1.294
  628   2HB   LYS  87          1HB       LYS  87  20.170   8.185  -0.296
  629   1HG   LYS  87          2HG       LYS  87  18.450   6.991   1.674
  630   2HG   LYS  87          1HG       LYS  87  18.916   8.623   2.158
  631   1HD   LYS  87          2HD       LYS  87  18.342   8.751  -0.589
  632   2HD   LYS  87          1HD       LYS  87  17.055   7.787   0.139
  633   1HE   LYS  87          2HE       LYS  87  16.678  10.292   0.047
  634   2HE   LYS  87          1HE       LYS  87  16.453   9.520   1.616
  635   1HZ   LYS  87          1HZ       LYS  87  17.991  11.692   1.152
  636   2HZ   LYS  87          2HZ       LYS  87  19.137  10.448   1.159
  637   3HZ   LYS  87          3HZ       LYS  87  18.127  10.676   2.497
  638    H    SER  88           H        SER  88  18.898   5.631   2.337
  639    HA   SER  88           HA       SER  88  20.465   3.952   3.970
  640   1HB   SER  88          2HB       SER  88  21.300   6.470   4.359
  641   2HB   SER  88          1HB       SER  88  19.930   6.466   5.472
  642    HG   SER  88           HG       SER  88  21.198   5.454   6.792
  643    H    GLU  89           H        GLU  89  17.919   6.415   4.137
  644    HA   GLU  89           HA       GLU  89  16.387   5.271   6.156
  645   1HB   GLU  89          2HB       GLU  89  14.801   6.863   5.658
  646   2HB   GLU  89          1HB       GLU  89  16.232   7.580   4.939
  647   1HG   GLU  89          2HG       GLU  89  15.556   6.779   2.746
  648   2HG   GLU  89          1HG       GLU  89  14.138   6.008   3.453
  649    H    ASP  90           H        ASP  90  16.779   4.281   2.891
  650    HA   ASP  90           HA       ASP  90  14.318   2.976   2.457
  651   1HB   ASP  90          2HB       ASP  90  16.483   1.550   1.200
  652   2HB   ASP  90          1HB       ASP  90  15.238   2.551   0.462
  653    H    THR  91           H        THR  91  17.234   2.030   4.143
  654    HA   THR  91           HA       THR  91  16.697  -0.735   4.360
  655    HB   THR  91           HB       THR  91  18.273   0.955   6.309
  656    HG1  THR  91           1HG      THR  91  20.043   0.524   4.955
  657   1HG2  THR  91          1HG2      THR  91  19.409  -1.055   6.886
  658   2HG2  THR  91          2HG2      THR  91  18.644  -1.943   5.567
  659   3HG2  THR  91          3HG2      THR  91  17.683  -1.413   6.948
  660    H    ALA  92           H        ALA  92  14.733  -1.333   5.121
  661    HA   ALA  92           HA       ALA  92  14.205  -1.310   7.870
  662   1HB   ALA  92          1HB       ALA  92  13.693   1.147   7.034
  663   2HB   ALA  92          2HB       ALA  92  12.694   0.357   8.254
  664   3HB   ALA  92          3HB       ALA  92  12.158   0.410   6.575
  665    H    VAL  93           H        VAL  93  11.703  -1.838   8.225
  666    HA   VAL  93           HA       VAL  93  11.160  -4.055   6.410
  667    HB   VAL  93           HB       VAL  93   9.588  -3.353   8.884
  668   1HG1  VAL  93          1HG1      VAL  93   8.427  -4.960   7.652
  669   2HG1  VAL  93          2HG1      VAL  93   9.334  -5.910   8.830
  670   3HG1  VAL  93          3HG1      VAL  93   9.905  -5.790   7.165
  671   1HG2  VAL  93          1HG2      VAL  93  12.016  -3.538   9.400
  672   2HG2  VAL  93          2HG2      VAL  93  11.989  -5.175   8.742
  673   3HG2  VAL  93          3HG2      VAL  93  11.032  -4.782  10.171
  674    H    TYR  94           H        TYR  94   9.498  -4.132   4.989
  675    HA   TYR  94           HA       TYR  94   7.681  -1.817   4.954
  676   1HB   TYR  94          2HB       TYR  94   8.815  -3.427   2.670
  677   2HB   TYR  94          1HB       TYR  94   7.520  -2.249   2.481
  678    HD1  TYR  94           1HD      TYR  94  10.995  -2.540   3.815
  679    HD2  TYR  94           2HD      TYR  94   8.065  -0.044   2.005
  680    HE1  TYR  94           1HE      TYR  94  12.665  -0.749   3.595
  681    HE2  TYR  94           2HE      TYR  94   9.727   1.752   1.779
  682    HH   TYR  94           HH       TYR  94  12.602   1.596   1.666
  683    H    TYR  95           H        TYR  95   5.557  -2.102   4.201
  684    HA   TYR  95           HA       TYR  95   4.484  -4.811   4.047
  685   1HB   TYR  95          2HB       TYR  95   3.131  -2.814   5.850
  686   2HB   TYR  95          1HB       TYR  95   2.877  -4.550   5.755
  687    HD1  TYR  95           1HD      TYR  95   5.236  -1.935   6.918
  688    HD2  TYR  95           2HD      TYR  95   4.105  -6.034   7.125
  689    HE1  TYR  95           1HE      TYR  95   6.749  -2.251   8.827
  690    HE2  TYR  95           2HE      TYR  95   5.620  -6.358   9.035
  691    HH   TYR  95           HH       TYR  95   6.802  -4.008  10.868
  692    H    CYS  96           H        CYS  96   2.151  -4.754   3.383
  693    HA   CYS  96           HA       CYS  96   1.415  -2.319   1.923
  694   1HB   CYS  96          2HB       CYS  96   1.870  -3.319  -0.035
  695   2HB   CYS  96          1HB       CYS  96   2.199  -4.853   0.761
  696    H    ALA  97           H        ALA  97  -0.394  -1.715   2.941
  697    HA   ALA  97           HA       ALA  97  -2.454  -3.765   3.436
  698   1HB   ALA  97          1HB       ALA  97  -1.235  -1.879   5.292
  699   2HB   ALA  97          2HB       ALA  97  -2.161  -3.358   5.597
  700   3HB   ALA  97          3HB       ALA  97  -3.002  -1.839   5.294
  701    H    LYS  98           H        LYS  98  -4.667  -2.760   3.807
  702    HA   LYS  98           HA       LYS  98  -5.196  -1.071   1.508
  703   1HB   LYS  98          2HB       LYS  98  -6.797  -2.739   1.679
  704   2HB   LYS  98          1HB       LYS  98  -6.892  -2.611   3.427
  705   1HG   LYS  98          2HG       LYS  98  -7.832  -0.189   2.741
  706   2HG   LYS  98          1HG       LYS  98  -8.341  -1.131   1.338
  707   1HD   LYS  98          2HD       LYS  98 -10.109  -1.708   2.586
  708   2HD   LYS  98          1HD       LYS  98  -8.988  -2.779   3.431
  709   1HE   LYS  98          2HE       LYS  98  -8.598  -1.149   5.128
  710   2HE   LYS  98          1HE       LYS  98  -9.492   0.079   4.232
  711   1HZ   LYS  98          1HZ       LYS  98 -10.469  -1.794   6.086
  712   2HZ   LYS  98          2HZ       LYS  98 -11.190  -2.099   4.587
  713   3HZ   LYS  98          3HZ       LYS  98 -11.311  -0.564   5.287
  714    H    TYR  99           H        TYR  99  -5.916   0.975   1.471
  715    HA   TYR  99           HA       TYR  99  -5.443   2.566   3.842
  716   1HB   TYR  99          2HB       TYR  99  -5.156   3.001   1.123
  717   2HB   TYR  99          1HB       TYR  99  -6.565   3.969   1.539
  718    HD1  TYR  99           1HD      TYR  99  -5.979   6.185   1.738
  719    HD2  TYR  99           2HD      TYR  99  -3.349   3.233   3.304
  720    HE1  TYR  99           1HE      TYR  99  -4.510   7.960   2.595
  721    HE2  TYR  99           2HE      TYR  99  -1.871   5.000   4.170
  722    HH   TYR  99           HH       TYR  99  -1.596   7.191   4.468
  723    H    SER 100           H        SER 100  -7.009   4.334   4.402
  724    HA   SER 100           HA       SER 100  -9.792   3.410   4.139
  725   1HB   SER 100          2HB       SER 100  -8.222   4.044   6.584
  726   2HB   SER 100          1HB       SER 100  -9.903   4.574   6.551
  727    HG   SER 100           HG       SER 100  -9.288   1.950   5.782
  728    H    GLY 101           H        GLY 101  -8.143   6.225   5.593
  729   1HA   GLY 101          2HA       GLY 101  -9.596   7.954   3.711
  730   2HA   GLY 101          1HA       GLY 101  -9.766   8.239   5.435
  731    H    GLY 102           H        GLY 102  -6.839   7.369   5.708
  732   1HA   GLY 102          2HA       GLY 102  -5.149   9.065   4.301
  733   2HA   GLY 102          1HA       GLY 102  -5.749   9.992   5.667
  734    H    ALA 103           H        ALA 103  -5.250   6.540   5.851
  735    HA   ALA 103           HA       ALA 103  -2.601   6.606   6.864
  736   1HB   ALA 103          1HB       ALA 103  -4.122   5.783   9.163
  737   2HB   ALA 103          2HB       ALA 103  -4.537   7.435   8.709
  738   3HB   ALA 103          3HB       ALA 103  -2.857   7.006   9.036
  739    H    LEU 104           H        LEU 104  -1.756   4.552   7.073
  740    HA   LEU 104           HA       LEU 104  -3.497   2.408   6.162
  741   1HB   LEU 104          2HB       LEU 104  -1.072   2.961   5.332
  742   2HB   LEU 104          1HB       LEU 104  -0.587   2.023   6.732
  743    HG   LEU 104           HG       LEU 104  -1.688   0.059   5.898
  744   1HD1  LEU 104          1HD1      LEU 104  -3.261  -0.003   4.289
  745   2HD1  LEU 104          2HD1      LEU 104  -2.494   1.272   3.340
  746   3HD1  LEU 104          3HD1      LEU 104  -3.474   1.688   4.746
  747   1HD2  LEU 104          1HD2      LEU 104   0.185   1.516   4.147
  748   2HD2  LEU 104          2HD2      LEU 104  -0.647   0.136   3.430
  749   3HD2  LEU 104          3HD2      LEU 104   0.324  -0.079   4.886
  750    H    ASP 105           H        ASP 105  -3.547   0.331   7.174
  751    HA   ASP 105           HA       ASP 105  -3.393   0.543  10.094
  752   1HB   ASP 105          2HB       ASP 105  -5.529  -0.141   8.718
  753   2HB   ASP 105          1HB       ASP 105  -4.756  -1.721   8.684
  754    H    ALA 106           H        ALA 106  -2.275  -1.365   7.371
  755    HA   ALA 106           HA       ALA 106  -0.628  -2.921   7.158
  756   1HB   ALA 106          1HB       ALA 106   0.702  -1.268   8.417
  757   2HB   ALA 106          2HB       ALA 106   1.199  -2.931   8.735
  758   3HB   ALA 106          3HB       ALA 106   0.222  -2.060   9.919
  759    H    TRP 107           H        TRP 107  -1.104  -5.013   7.151
  760    HA   TRP 107           HA       TRP 107  -2.238  -6.176   9.584
  761   1HB   TRP 107          2HB       TRP 107  -2.626  -7.253   6.810
  762   2HB   TRP 107          1HB       TRP 107  -3.531  -7.659   8.264
  763    HD1  TRP 107           HD       TRP 107  -4.131  -4.656   9.232
  764    HE1  TRP 107           1HE      TRP 107  -5.824  -3.235   7.928
  765    HE3  TRP 107           3HE      TRP 107  -4.049  -7.186   4.804
  766    HZ2  TRP 107           2HZ      TRP 107  -6.963  -3.191   5.351
  767    HZ3  TRP 107           3HZ      TRP 107  -5.447  -6.375   2.973
  768    HH2  TRP 107           HH       TRP 107  -6.869  -4.430   3.237
  769    H    GLY 108           H        GLY 108  -1.009  -7.909   6.834
  770   1HA   GLY 108          2HA       GLY 108   0.767  -9.370   8.663
  771   2HA   GLY 108          1HA       GLY 108   0.164  -9.981   7.134
  772    H    GLN 109           H        GLN 109   2.119 -10.554   6.333
  773    HA   GLN 109           HA       GLN 109   3.920 -10.291   4.983
  774   1HB   GLN 109          2HB       GLN 109   3.520  -7.323   5.349
  775   2HB   GLN 109          1HB       GLN 109   4.605  -8.081   4.192
  776   1HG   GLN 109          2HG       GLN 109   2.964  -8.534   2.755
  777   2HG   GLN 109          1HG       GLN 109   1.831  -8.985   4.029
  778   1HE2  GLN 109          1HE2      GLN 109   1.718  -7.201   1.598
  779   2HE2  GLN 109          2HE2      GLN 109   1.048  -5.727   2.193
  780    H    GLY 110           H        GLY 110   5.577  -7.679   5.621
  781   1HA   GLY 110          2HA       GLY 110   6.936  -7.061   7.537
  782   2HA   GLY 110          1HA       GLY 110   6.880  -8.747   8.039
  783    H    THR 111           H        THR 111   7.693  -7.028   5.007
  784    HA   THR 111           HA       THR 111   9.852  -8.901   4.538
  785    HB   THR 111           HB       THR 111   8.492  -8.168   2.640
  786    HG1  THR 111           1HG      THR 111  10.250  -8.423   1.504
  787   1HG2  THR 111          1HG2      THR 111   9.690  -5.437   3.117
  788   2HG2  THR 111          2HG2      THR 111   8.008  -5.881   3.402
  789   3HG2  THR 111          3HG2      THR 111   8.659  -5.900   1.764
  790    H    GLN 112           H        GLN 112  11.941  -8.600   4.928
  791    HA   GLN 112           HA       GLN 112  12.755  -6.107   6.196
  792   1HB   GLN 112          2HB       GLN 112  13.419  -7.979   7.455
  793   2HB   GLN 112          1HB       GLN 112  13.958  -8.857   6.030
  794   1HG   GLN 112          2HG       GLN 112  15.883  -8.179   7.241
  795   2HG   GLN 112          1HG       GLN 112  15.794  -7.200   5.779
  796   1HE2  GLN 112          1HE2      GLN 112  13.518  -6.383   8.174
  797   2HE2  GLN 112          2HE2      GLN 112  14.331  -4.997   8.805
  798    H    VAL 113           H        VAL 113  13.400  -4.565   4.860
  799    HA   VAL 113           HA       VAL 113  15.012  -5.284   2.504
  800    HB   VAL 113           HB       VAL 113  13.475  -2.756   3.138
  801   1HG1  VAL 113          1HG1      VAL 113  14.139  -2.262   0.673
  802   2HG1  VAL 113          2HG1      VAL 113  15.469  -3.372   0.997
  803   3HG1  VAL 113          3HG1      VAL 113  15.282  -1.913   1.969
  804   1HG2  VAL 113          1HG2      VAL 113  13.018  -4.393   0.701
  805   2HG2  VAL 113          2HG2      VAL 113  11.883  -3.437   1.651
  806   3HG2  VAL 113          3HG2      VAL 113  12.415  -5.013   2.238
  807    H    THR 114           H        THR 114  17.135  -4.750   2.441
  808    HA   THR 114           HA       THR 114  18.096  -2.742   4.363
  809    HB   THR 114           HB       THR 114  19.487  -5.374   3.868
  810    HG1  THR 114           1HG      THR 114  17.442  -5.379   5.149
  811   1HG2  THR 114          1HG2      THR 114  21.206  -4.026   4.538
  812   2HG2  THR 114          2HG2      THR 114  20.570  -4.471   6.122
  813   3HG2  THR 114          3HG2      THR 114  20.143  -2.917   5.404
  814    H    VAL 115           H        VAL 115  19.858  -1.547   3.769
  815    HA   VAL 115           HA       VAL 115  20.748  -1.853   0.975
  816    HB   VAL 115           HB       VAL 115  20.670   0.697   2.588
  817   1HG1  VAL 115          1HG1      VAL 115  22.358   0.400   0.686
  818   2HG1  VAL 115          2HG1      VAL 115  21.332   1.834   0.664
  819   3HG1  VAL 115          3HG1      VAL 115  20.958   0.467  -0.386
  820   1HG2  VAL 115          1HG2      VAL 115  18.865   1.152   0.687
  821   2HG2  VAL 115          2HG2      VAL 115  18.437   0.442   2.244
  822   3HG2  VAL 115          3HG2      VAL 115  18.661  -0.594   0.834
  823    H    SER 116           H        SER 116  22.727  -2.668   0.916
  824    HA   SER 116           HA       SER 116  24.571  -2.361   3.116
  825   1HB   SER 116          2HB       SER 116  24.235  -4.184   0.925
  826   2HB   SER 116          1HB       SER 116  25.879  -3.546   0.897
  827    HG   SER 116           HG       SER 116  26.254  -4.901   2.448
  828    H    SER 117           H        SER 117  24.808  -0.049   3.001
  829    HA   SER 117           HA       SER 117  26.099   1.088   0.673
  830   1HB   SER 117          2HB       SER 117  26.226   3.030   2.606
  831   2HB   SER 117          1HB       SER 117  24.877   2.806   1.492
  832    HG   SER 117           HG       SER 117  23.997   1.361   3.140
  833    H    GLN 118           H        GLN 118  27.906   2.844   1.626
  834    HA   GLN 118           HA       GLN 118  29.889   1.220   3.070
  835   1HB   GLN 118          2HB       GLN 118  30.709   3.082   0.864
  836   2HB   GLN 118          1HB       GLN 118  31.597   1.733   1.559
  837   1HG   GLN 118          2HG       GLN 118  29.062   1.296   0.030
  838   2HG   GLN 118          1HG       GLN 118  30.612   1.473  -0.790
  839   1HE2  GLN 118          1HE2      GLN 118  29.581  -0.788  -1.341
  840   2HE2  GLN 118          2HE2      GLN 118  30.218  -2.097  -0.410
  841    H    SER 119           H        SER 119  29.781   4.506   1.702
  842    HA   SER 119           HA       SER 119  30.190   6.550   2.601
  843   1HB   SER 119          2HB       SER 119  28.540   5.143   4.533
  844   2HB   SER 119          1HB       SER 119  29.585   6.327   5.320
  845    HG   SER 119           HG       SER 119  28.723   7.645   3.337
  846    H    GLU 120           H        GLU 120  30.818   5.059   5.711
  847    HA   GLU 120           HA       GLU 120  32.672   4.967   7.019
  848   1HB   GLU 120          2HB       GLU 120  33.313   3.648   4.725
  849   2HB   GLU 120          1HB       GLU 120  34.587   4.858   4.782
  850   1HG   GLU 120          2HG       GLU 120  35.574   3.168   5.945
  851   2HG   GLU 120          1HG       GLU 120  34.811   4.054   7.265
  852    H    GLN 121           H        GLN 121  35.144   5.909   7.013
  853    HA   GLN 121           HA       GLN 121  34.925   8.752   6.274
  854   1HB   GLN 121          2HB       GLN 121  35.547   7.501   8.898
  855   2HB   GLN 121          1HB       GLN 121  36.463   8.937   8.458
  856   1HG   GLN 121          2HG       GLN 121  34.073   9.888   7.915
  857   2HG   GLN 121          1HG       GLN 121  33.568   8.637   9.049
  858   1HE2  GLN 121          1HE2      GLN 121  34.917  11.728   8.673
  859   2HE2  GLN 121          2HE2      GLN 121  35.241  12.053  10.339
  860    H    LYS 122           H        LYS 122  37.437   6.717   7.764
  861    HA   LYS 122           HA       LYS 122  39.259   7.554   5.606
  862   1HB   LYS 122          2HB       LYS 122  39.548   7.508   8.502
  863   2HB   LYS 122          1HB       LYS 122  40.841   6.628   7.698
  864   1HG   LYS 122          2HG       LYS 122  41.433   8.562   6.409
  865   2HG   LYS 122          1HG       LYS 122  40.041   9.451   7.029
  866   1HD   LYS 122          2HD       LYS 122  40.960   9.540   9.214
  867   2HD   LYS 122          1HD       LYS 122  42.212   8.364   8.808
  868   1HE   LYS 122          2HE       LYS 122  42.400  10.531   6.980
  869   2HE   LYS 122          1HE       LYS 122  42.305  11.196   8.611
  870   1HZ   LYS 122          1HZ       LYS 122  44.531  10.832   8.447
  871   2HZ   LYS 122          2HZ       LYS 122  44.372   9.507   7.409
  872   3HZ   LYS 122          3HZ       LYS 122  44.069   9.325   9.063
  873    H    LEU 123           H        LEU 123  39.764   5.991   4.233
  874    HA   LEU 123           HA       LEU 123  40.176   3.273   5.248
  875   1HB   LEU 123          2HB       LEU 123  37.879   3.433   4.327
  876   2HB   LEU 123          1HB       LEU 123  38.557   3.916   2.784
  877    HG   LEU 123           HG       LEU 123  39.859   1.531   3.370
  878   1HD1  LEU 123          1HD1      LEU 123  38.574   0.528   4.911
  879   2HD1  LEU 123          2HD1      LEU 123  37.493   0.220   3.550
  880   3HD1  LEU 123          3HD1      LEU 123  37.204   1.599   4.614
  881   1HD2  LEU 123          1HD2      LEU 123  38.444   2.652   1.311
  882   2HD2  LEU 123          2HD2      LEU 123  37.456   1.255   1.737
  883   3HD2  LEU 123          3HD2      LEU 123  39.153   1.037   1.307
  884    H    ILE 124           H        ILE 124  42.041   2.460   4.571
  885    HA   ILE 124           HA       ILE 124  43.632   3.892   2.643
  886    HB   ILE 124           HB       ILE 124  44.711   2.981   4.619
  887   1HG1  ILE 124          2HG1      ILE 124  45.619   1.442   2.175
  888   2HG1  ILE 124          1HG1      ILE 124  45.973   3.143   2.459
  889   1HG2  ILE 124          1HG2      ILE 124  43.108   0.727   4.087
  890   2HG2  ILE 124          2HG2      ILE 124  44.202   0.988   5.445
  891   3HG2  ILE 124          3HG2      ILE 124  44.787   0.198   3.981
  892   1HD1  ILE 124          1HD1      ILE 124  47.064   0.725   3.796
  893   2HD1  ILE 124          2HD1      ILE 124  46.956   2.228   4.712
  894   3HD1  ILE 124          3HD1      ILE 124  47.891   2.173   3.218
  895    H    SER 125           H        SER 125  44.223   3.253   0.619
  896    HA   SER 125           HA       SER 125  42.539   1.285  -0.662
  897   1HB   SER 125          2HB       SER 125  43.099   2.296  -2.644
  898   2HB   SER 125          1HB       SER 125  43.475   3.628  -1.552
  899    HG   SER 125           HG       SER 125  45.579   3.285  -1.826
  900    H    GLU 126           H        GLU 126  43.078  -0.752  -1.151
  901    HA   GLU 126           HA       GLU 126  45.465  -1.902  -0.164
  902   1HB   GLU 126          2HB       GLU 126  43.045  -2.823  -1.517
  903   2HB   GLU 126          1HB       GLU 126  44.477  -3.738  -1.971
  904   1HG   GLU 126          2HG       GLU 126  44.242  -4.923  -0.122
  905   2HG   GLU 126          1HG       GLU 126  44.601  -3.469   0.810
  906    H    GLU 127           H        GLU 127  47.402  -1.543  -0.998
  907    HA   GLU 127           HA       GLU 127  48.020  -2.254  -3.684
  908   1HB   GLU 127          2HB       GLU 127  47.016   0.153  -3.765
  909   2HB   GLU 127          1HB       GLU 127  48.569   0.638  -3.096
  910   1HG   GLU 127          2HG       GLU 127  49.732  -0.005  -4.997
  911   2HG   GLU 127          1HG       GLU 127  48.430  -1.052  -5.558
  912    H    ASP 128           H        ASP 128  48.759  -2.178  -0.614
  913    HA   ASP 128           HA       ASP 128  51.611  -1.590  -0.876
  914   1HB   ASP 128          2HB       ASP 128  49.722  -1.369   1.240
  915   2HB   ASP 128          1HB       ASP 128  50.940  -2.543   1.732
  916    H    LEU 129           H        LEU 129  49.894  -4.127   0.929
  917    HA   LEU 129           HA       LEU 129  50.241  -6.360   1.140
  918   1HB   LEU 129          2HB       LEU 129  50.199  -5.873  -1.561
  919   2HB   LEU 129          1HB       LEU 129  51.720  -6.720  -1.365
  920    HG   LEU 129           HG       LEU 129  49.819  -8.205  -1.949
  921   1HD1  LEU 129          1HD1      LEU 129  50.441  -9.950  -0.501
  922   2HD1  LEU 129          2HD1      LEU 129  50.831  -8.836   0.808
  923   3HD1  LEU 129          3HD1      LEU 129  51.860  -8.911  -0.622
  924   1HD2  LEU 129          1HD2      LEU 129  48.812  -7.603   0.827
  925   2HD2  LEU 129          2HD2      LEU 129  48.084  -8.673  -0.371
  926   3HD2  LEU 129          3HD2      LEU 129  48.113  -6.932  -0.647
  927    H    ASN 130           H        ASN 130  51.652  -6.863   2.674
  928    HA   ASN 130           HA       ASN 130  54.313  -6.001   2.808
  929   1HB   ASN 130          2HB       ASN 130  53.289  -8.493   4.158
  930   2HB   ASN 130          1HB       ASN 130  54.521  -7.371   4.728
  931   1HD2  ASN 130          1HD2      ASN 130  51.995  -8.336   5.938
  932   2HD2  ASN 130          2HD2      ASN 130  51.114  -6.909   6.349
  933    H    HIS 131           H        HIS 131  52.861  -8.746   1.261
  934    HA   HIS 131           HA       HIS 131  53.679 -10.419  -0.043
  935   1HB   HIS 131          2HB       HIS 131  55.556  -8.166  -0.443
  936   2HB   HIS 131          1HB       HIS 131  56.129  -9.747  -0.965
  937    HD1  HIS 131           1HD      HIS 131  53.964  -6.972  -1.960
  938    HD2  HIS 131           2HD      HIS 131  54.426 -10.977  -2.968
  939    HE1  HIS 131           1HE      HIS 131  52.745  -7.262  -4.140
  940    HE2  HIS 131           2HE      HIS 131  53.043  -9.692  -4.736
  941    H    HIS 132           H        HIS 132  56.218 -11.422  -0.478
  942    HA   HIS 132           HA       HIS 132  56.694 -12.758   2.048
  943   1HB   HIS 132          2HB       HIS 132  56.736 -13.607  -0.554
  944   2HB   HIS 132          1HB       HIS 132  58.453 -13.413  -0.217
  945    HD1  HIS 132           1HD      HIS 132  56.915 -14.320   2.871
  946    HD2  HIS 132           2HD      HIS 132  58.073 -16.387  -0.543
  947    HE1  HIS 132           1HE      HIS 132  57.089 -16.730   3.571
  948    HE2  HIS 132           2HE      HIS 132  57.872 -17.949   1.509
  949    H    HIS 133           H        HIS 133  59.059 -13.252   2.586
  950    HA   HIS 133           HA       HIS 133  60.754 -10.889   2.153
  951   1HB   HIS 133          2HB       HIS 133  61.482 -11.371   4.639
  952   2HB   HIS 133          1HB       HIS 133  60.066 -10.383   4.299
  953    HD1  HIS 133           1HD      HIS 133  58.357 -10.925   5.995
  954    HD2  HIS 133           2HD      HIS 133  60.347 -14.327   4.678
  955    HE1  HIS 133           1HE      HIS 133  57.240 -12.852   7.163
  956    HE2  HIS 133           2HE      HIS 133  58.493 -14.896   6.389
  957    H    HIS 134           H        HIS 134  63.032 -11.268   2.429
  958    HA   HIS 134           HA       HIS 134  63.792 -14.110   2.326
  959   1HB   HIS 134          2HB       HIS 134  64.599 -11.875   0.482
  960   2HB   HIS 134          1HB       HIS 134  65.619 -13.295   0.687
  961    HD1  HIS 134           1HD      HIS 134  63.302 -15.409   0.792
  962    HD2  HIS 134           2HD      HIS 134  63.694 -12.407  -2.054
  963    HE1  HIS 134           1HE      HIS 134  62.018 -16.213  -1.216
  964    HE2  HIS 134           2HE      HIS 134  62.315 -14.404  -2.945
  965    H    HIS 135           H        HIS 135  63.845 -12.144   4.517
  966    HA   HIS 135           HA       HIS 135  66.646 -11.514   4.904
  967   1HB   HIS 135          2HB       HIS 135  64.315 -11.212   6.811
  968   2HB   HIS 135          1HB       HIS 135  65.919 -10.519   7.018
  969    HD1  HIS 135           1HD      HIS 135  65.936  -9.713   3.825
  970    HD2  HIS 135           2HD      HIS 135  63.227  -8.604   6.775
  971    HE1  HIS 135           1HE      HIS 135  64.874  -7.589   2.998
  972    HE2  HIS 135           2HE      HIS 135  63.202  -6.962   4.776
  Start of MODEL   10
    1   1H    ASP   1          1HT       ASP   1  -9.051 -10.059   8.832
    2   2H    ASP   1          2HT       ASP   1 -10.152 -11.322   9.069
    3   3H    ASP   1          3HT       ASP   1 -10.502  -9.774   9.654
    4    HA   ASP   1           HA       ASP   1 -11.658 -10.508   7.531
    5   1HB   ASP   1          2HB       ASP   1 -10.520  -7.999   8.407
    6   2HB   ASP   1          1HB       ASP   1 -10.619  -8.045   6.648
    7    H    VAL   2           H        VAL   2  -9.040  -8.527   6.359
    8    HA   VAL   2           HA       VAL   2  -8.275 -10.679   4.498
    9    HB   VAL   2           HB       VAL   2  -9.297  -9.208   3.046
   10   1HG1  VAL   2          1HG1      VAL   2  -8.732  -7.249   5.122
   11   2HG1  VAL   2          2HG1      VAL   2 -10.069  -7.332   3.975
   12   3HG1  VAL   2          3HG1      VAL   2  -8.537  -6.603   3.492
   13   1HG2  VAL   2          1HG2      VAL   2  -6.868  -7.603   2.820
   14   2HG2  VAL   2          2HG2      VAL   2  -7.638  -8.670   1.647
   15   3HG2  VAL   2          3HG2      VAL   2  -6.577  -9.340   2.886
   16    H    GLN   3           H        GLN   3  -6.332 -11.389   5.070
   17    HA   GLN   3           HA       GLN   3  -4.345  -9.464   6.057
   18   1HB   GLN   3          2HB       GLN   3  -5.105 -11.973   7.017
   19   2HB   GLN   3          1HB       GLN   3  -3.551 -12.246   6.241
   20   1HG   GLN   3          2HG       GLN   3  -3.226  -9.903   7.710
   21   2HG   GLN   3          1HG       GLN   3  -4.155 -10.980   8.753
   22   1HE2  GLN   3          1HE2      GLN   3  -1.285 -10.895   6.687
   23   2HE2  GLN   3          2HE2      GLN   3  -0.344 -11.979   7.649
   24    H    LEU   4           H        LEU   4  -2.418  -9.177   5.025
   25    HA   LEU   4           HA       LEU   4  -2.142 -10.562   2.442
   26   1HB   LEU   4          2HB       LEU   4  -0.496  -8.197   2.737
   27   2HB   LEU   4          1HB       LEU   4  -1.639  -8.613   1.479
   28    HG   LEU   4           HG       LEU   4  -2.414  -7.394   4.131
   29   1HD1  LEU   4          1HD1      LEU   4  -2.749  -5.764   1.750
   30   2HD1  LEU   4          2HD1      LEU   4  -1.059  -6.141   2.091
   31   3HD1  LEU   4          3HD1      LEU   4  -2.051  -5.352   3.317
   32   1HD2  LEU   4          1HD2      LEU   4  -4.524  -7.727   3.530
   33   2HD2  LEU   4          2HD2      LEU   4  -3.940  -8.711   2.187
   34   3HD2  LEU   4          3HD2      LEU   4  -4.239  -6.989   1.954
   35    H    GLN   5           H        GLN   5   0.056 -10.912   1.656
   36    HA   GLN   5           HA       GLN   5   1.931 -11.491   3.852
   37   1HB   GLN   5          2HB       GLN   5   0.949 -13.509   2.739
   38   2HB   GLN   5          1HB       GLN   5   1.695 -12.985   1.235
   39   1HG   GLN   5          2HG       GLN   5   3.903 -13.056   2.459
   40   2HG   GLN   5          1HG       GLN   5   3.048 -13.883   3.760
   41   1HE2  GLN   5          1HE2      GLN   5   5.195 -14.961   2.291
   42   2HE2  GLN   5          2HE2      GLN   5   4.612 -16.334   1.420
   43    H    ALA   6           H        ALA   6   3.459  -9.984   3.813
   44    HA   ALA   6           HA       ALA   6   4.290  -8.778   1.307
   45   1HB   ALA   6          1HB       ALA   6   5.466  -8.127   3.980
   46   2HB   ALA   6          2HB       ALA   6   3.854  -7.564   3.534
   47   3HB   ALA   6          3HB       ALA   6   5.253  -7.088   2.570
   48    H    SER   7           H        SER   7   6.174  -9.101   0.281
   49    HA   SER   7           HA       SER   7   8.462 -10.275   1.546
   50   1HB   SER   7          2HB       SER   7   6.866 -12.227   1.006
   51   2HB   SER   7          1HB       SER   7   7.269 -11.915  -0.683
   52    HG   SER   7           HG       SER   7   9.509 -11.993   0.799
   53    H    GLY   8           H        GLY   8  10.164 -10.825  -0.235
   54   1HA   GLY   8          2HA       GLY   8  10.929 -10.315  -2.482
   55   2HA   GLY   8          1HA       GLY   8   9.906  -8.887  -2.445
   56    H    GLY   9           H        GLY   9  11.164  -8.997   0.542
   57   1HA   GLY   9          2HA       GLY   9  12.813  -6.770   0.246
   58   2HA   GLY   9          1HA       GLY   9  12.816  -7.847   1.634
   59    H    GLY  10           H        GLY  10  14.717  -6.544  -0.665
   60   1HA   GLY  10          2HA       GLY  10  16.597  -8.820  -0.559
   61   2HA   GLY  10          1HA       GLY  10  16.403  -7.835  -1.999
   62    H    LEU  11           H        LEU  11  18.836  -7.841  -1.499
   63    HA   LEU  11           HA       LEU  11  19.462  -5.561   0.254
   64   1HB   LEU  11          2HB       LEU  11  20.739  -8.157  -0.134
   65   2HB   LEU  11          1HB       LEU  11  21.863  -6.820  -0.284
   66    HG   LEU  11           HG       LEU  11  21.825  -7.709   1.992
   67   1HD1  LEU  11          1HD1      LEU  11  20.588  -4.967   1.840
   68   2HD1  LEU  11          2HD1      LEU  11  22.298  -5.326   1.603
   69   3HD1  LEU  11          3HD1      LEU  11  21.545  -5.620   3.170
   70   1HD2  LEU  11          1HD2      LEU  11  19.948  -7.853   3.325
   71   2HD2  LEU  11          2HD2      LEU  11  19.305  -8.310   1.748
   72   3HD2  LEU  11          3HD2      LEU  11  19.046  -6.679   2.366
   73    H    VAL  12           H        VAL  12  20.241  -3.789  -0.624
   74    HA   VAL  12           HA       VAL  12  21.491  -3.958  -3.264
   75    HB   VAL  12           HB       VAL  12  18.952  -3.153  -3.094
   76   1HG1  VAL  12          1HG1      VAL  12  19.331  -0.534  -3.538
   77   2HG1  VAL  12          2HG1      VAL  12  20.521  -0.822  -2.271
   78   3HG1  VAL  12          3HG1      VAL  12  18.826  -1.211  -1.990
   79   1HG2  VAL  12          1HG2      VAL  12  21.154  -2.620  -4.949
   80   2HG2  VAL  12          2HG2      VAL  12  19.674  -1.692  -5.188
   81   3HG2  VAL  12          3HG2      VAL  12  19.623  -3.454  -5.200
   82    H    GLN  13           H        GLN  13  22.033  -1.427  -3.788
   83    HA   GLN  13           HA       GLN  13  23.521  -0.399  -1.461
   84   1HB   GLN  13          2HB       GLN  13  24.752  -0.077  -4.144
   85   2HB   GLN  13          1HB       GLN  13  25.516  -0.308  -2.577
   86   1HG   GLN  13          2HG       GLN  13  25.169  -2.638  -2.640
   87   2HG   GLN  13          1HG       GLN  13  24.053  -2.510  -3.999
   88   1HE2  GLN  13          1HE2      GLN  13  27.212  -1.004  -3.510
   89   2HE2  GLN  13          2HE2      GLN  13  27.965  -1.723  -4.889
   90    HA   PRO  14           HA       PRO  14  21.934   3.648  -2.198
   91   1HB   PRO  14          2HB       PRO  14  24.766   4.551  -2.510
   92   2HB   PRO  14          1HB       PRO  14  23.477   5.221  -1.500
   93   1HG   PRO  14          2HG       PRO  14  25.396   3.741  -0.413
   94   2HG   PRO  14          1HG       PRO  14  23.715   3.575   0.123
   95   1HD   PRO  14          2HD       PRO  14  25.339   1.775  -1.613
   96   2HD   PRO  14          1HD       PRO  14  24.083   1.369  -0.427
   97    H    GLY  15           H        GLY  15  20.953   3.660  -4.157
   98   1HA   GLY  15          2HA       GLY  15  20.967   4.870  -6.267
   99   2HA   GLY  15          1HA       GLY  15  22.639   4.367  -6.475
  100    H    GLY  16           H        GLY  16  20.895   1.850  -5.176
  101   1HA   GLY  16          2HA       GLY  16  20.973   0.392  -7.669
  102   2HA   GLY  16          1HA       GLY  16  20.542  -0.248  -6.097
  103    H    SER  17           H        SER  17  18.754  -1.341  -6.854
  104    HA   SER  17           HA       SER  17  16.333   0.144  -6.912
  105   1HB   SER  17          2HB       SER  17  16.144   0.540  -9.113
  106   2HB   SER  17          1HB       SER  17  17.614  -0.372  -9.449
  107    HG   SER  17           HG       SER  17  16.119  -1.543 -10.459
  108    H    LEU  18           H        LEU  18  15.158  -1.127  -5.648
  109    HA   LEU  18           HA       LEU  18  15.176  -4.027  -6.177
  110   1HB   LEU  18          2HB       LEU  18  16.264  -3.792  -4.113
  111   2HB   LEU  18          1HB       LEU  18  15.181  -2.518  -3.585
  112    HG   LEU  18           HG       LEU  18  13.351  -4.300  -3.534
  113   1HD1  LEU  18          1HD1      LEU  18  15.432  -6.347  -3.141
  114   2HD1  LEU  18          2HD1      LEU  18  15.139  -5.858  -4.810
  115   3HD1  LEU  18          3HD1      LEU  18  13.814  -6.485  -3.829
  116   1HD2  LEU  18          1HD2      LEU  18  14.740  -3.303  -1.599
  117   2HD2  LEU  18          2HD2      LEU  18  15.552  -4.869  -1.586
  118   3HD2  LEU  18          3HD2      LEU  18  13.811  -4.775  -1.312
  119    H    ARG  19           H        ARG  19  13.267  -4.939  -6.591
  120    HA   ARG  19           HA       ARG  19  10.856  -3.299  -6.226
  121   1HB   ARG  19          2HB       ARG  19  11.203  -3.921  -8.522
  122   2HB   ARG  19          1HB       ARG  19  11.445  -5.607  -8.084
  123   1HG   ARG  19          2HG       ARG  19   9.075  -5.634  -7.263
  124   2HG   ARG  19          1HG       ARG  19   8.885  -4.032  -7.976
  125   1HD   ARG  19          2HD       ARG  19   8.847  -6.636  -9.239
  126   2HD   ARG  19          1HD       ARG  19   8.317  -5.076  -9.862
  127    HE   ARG  19           HE       ARG  19  10.777  -4.721 -10.364
  128   1HH1  ARG  19          1HH1      ARG  19   9.292  -7.874 -10.298
  129   2HH1  ARG  19          2HH1      ARG  19  10.413  -8.568 -11.420
  130   1HH2  ARG  19          1HH2      ARG  19  12.257  -5.628 -11.843
  131   2HH2  ARG  19          2HH2      ARG  19  12.099  -7.291 -12.298
  132    H    VAL  20           H        VAL  20   9.632  -3.787  -4.545
  133    HA   VAL  20           HA       VAL  20   9.676  -6.541  -3.514
  134    HB   VAL  20           HB       VAL  20   8.781  -5.613  -1.420
  135   1HG1  VAL  20          1HG1      VAL  20  11.231  -5.821  -1.856
  136   2HG1  VAL  20          2HG1      VAL  20  10.798  -4.617  -0.642
  137   3HG1  VAL  20          3HG1      VAL  20  11.241  -4.107  -2.272
  138   1HG2  VAL  20          1HG2      VAL  20   8.249  -3.412  -1.076
  139   2HG2  VAL  20          2HG2      VAL  20   7.801  -3.575  -2.774
  140   3HG2  VAL  20          3HG2      VAL  20   9.341  -2.838  -2.336
  141    H    SER  21           H        SER  21   7.714  -7.597  -2.990
  142    HA   SER  21           HA       SER  21   5.334  -6.416  -4.269
  143   1HB   SER  21          2HB       SER  21   4.658  -8.661  -4.962
  144   2HB   SER  21          1HB       SER  21   6.256  -8.277  -5.600
  145    HG   SER  21           HG       SER  21   5.677 -10.399  -4.315
  146    H    CYS  22           H        CYS  22   3.265  -7.344  -3.501
  147    HA   CYS  22           HA       CYS  22   3.283  -8.443  -0.808
  148   1HB   CYS  22          2HB       CYS  22   2.850  -5.653  -1.333
  149   2HB   CYS  22          1HB       CYS  22   1.360  -6.370  -0.728
  150    H    ALA  23           H        ALA  23   2.133 -10.219  -1.235
  151    HA   ALA  23           HA       ALA  23  -0.143 -10.108  -3.012
  152   1HB   ALA  23          1HB       ALA  23   0.823 -12.465  -1.409
  153   2HB   ALA  23          2HB       ALA  23   1.465 -12.021  -2.990
  154   3HB   ALA  23          3HB       ALA  23  -0.228 -12.485  -2.825
  155    H    ALA  24           H        ALA  24  -2.210 -11.180  -2.310
  156    HA   ALA  24           HA       ALA  24  -2.891 -11.243   0.456
  157   1HB   ALA  24          1HB       ALA  24  -2.832  -8.852   0.302
  158   2HB   ALA  24          2HB       ALA  24  -4.523  -9.356   0.384
  159   3HB   ALA  24          3HB       ALA  24  -3.818  -8.873  -1.161
  160    H    SER  25           H        SER  25  -5.151 -11.816   0.805
  161    HA   SER  25           HA       SER  25  -6.754 -12.469  -1.515
  162   1HB   SER  25          2HB       SER  25  -5.131 -14.476  -0.127
  163   2HB   SER  25          1HB       SER  25  -6.838 -14.907  -0.232
  164    HG   SER  25           HG       SER  25  -4.934 -14.781  -2.197
  165    H    GLY  26           H        GLY  26  -8.507 -11.375  -0.783
  166   1HA   GLY  26          2HA       GLY  26 -10.352 -12.475   0.888
  167   2HA   GLY  26          1HA       GLY  26  -9.344 -11.526   1.968
  168    H    PHE  27           H        PHE  27  -9.386 -10.068  -1.047
  169    HA   PHE  27           HA       PHE  27 -11.890  -8.732  -0.911
  170   1HB   PHE  27          2HB       PHE  27 -11.248  -6.574  -0.144
  171   2HB   PHE  27          1HB       PHE  27 -10.664  -7.727   1.046
  172    HD1  PHE  27           1HD      PHE  27  -8.225  -8.553  -0.807
  173    HD2  PHE  27           2HD      PHE  27  -9.763  -4.853   0.632
  174    HE1  PHE  27           1HE      PHE  27  -5.983  -7.563  -0.964
  175    HE2  PHE  27           2HE      PHE  27  -7.520  -3.857   0.471
  176    HZ   PHE  27           HZ       PHE  27  -5.623  -5.212  -0.325
  177    H    THR  28           H        THR  28  -8.890  -9.364  -2.340
  178    HA   THR  28           HA       THR  28  -8.069  -9.057  -4.438
  179    HB   THR  28           HB       THR  28 -10.685  -7.862  -5.314
  180    HG1  THR  28           1HG      THR  28 -10.736 -10.491  -5.675
  181   1HG2  THR  28          1HG2      THR  28  -9.231  -7.902  -7.116
  182   2HG2  THR  28          2HG2      THR  28 -10.063  -9.448  -7.291
  183   3HG2  THR  28          3HG2      THR  28  -8.448  -9.390  -6.584
  184    H    PHE  29           H        PHE  29  -7.386  -7.396  -5.979
  185    HA   PHE  29           HA       PHE  29  -7.266  -4.773  -4.672
  186   1HB   PHE  29          2HB       PHE  29  -5.493  -6.216  -6.616
  187   2HB   PHE  29          1HB       PHE  29  -5.407  -4.463  -6.485
  188    HD1  PHE  29           1HD      PHE  29  -5.775  -7.190  -3.960
  189    HD2  PHE  29           2HD      PHE  29  -3.519  -3.857  -5.343
  190    HE1  PHE  29           1HE      PHE  29  -4.266  -7.416  -2.031
  191    HE2  PHE  29           2HE      PHE  29  -2.007  -4.078  -3.417
  192    HZ   PHE  29           HZ       PHE  29  -2.379  -5.860  -1.758
  193    H    SER  30           H        SER  30  -6.519  -3.223  -6.849
  194    HA   SER  30           HA       SER  30  -7.399  -1.897  -8.471
  195   1HB   SER  30          2HB       SER  30  -7.212  -4.028  -9.773
  196   2HB   SER  30          1HB       SER  30  -8.889  -4.379  -9.354
  197    HG   SER  30           HG       SER  30  -8.641  -1.882 -10.354
  198    H    SER  31           H        SER  31  -8.973  -2.679  -5.910
  199    HA   SER  31           HA       SER  31 -11.405  -1.241  -6.694
  200   1HB   SER  31          2HB       SER  31 -11.234  -3.969  -5.646
  201   2HB   SER  31          1HB       SER  31 -12.302  -2.931  -4.702
  202    HG   SER  31           HG       SER  31 -13.683  -2.950  -6.284
  203    H    TYR  32           H        TYR  32  -9.208  -2.265  -4.144
  204    HA   TYR  32           HA       TYR  32 -10.212  -0.097  -2.433
  205   1HB   TYR  32          2HB       TYR  32  -8.472  -2.456  -1.686
  206   2HB   TYR  32          1HB       TYR  32  -9.115  -1.250  -0.575
  207    HD1  TYR  32           1HD      TYR  32 -11.346  -1.395   0.246
  208    HD2  TYR  32           2HD      TYR  32 -10.023  -4.060  -2.796
  209    HE1  TYR  32           1HE      TYR  32 -13.364  -2.761   0.573
  210    HE2  TYR  32           2HE      TYR  32 -12.039  -5.431  -2.478
  211    HH   TYR  32           HH       TYR  32 -14.237  -4.886   0.162
  212    H    HIS  33           H        HIS  33  -8.652   1.199  -1.276
  213    HA   HIS  33           HA       HIS  33  -6.340   1.802  -2.945
  214   1HB   HIS  33          2HB       HIS  33  -7.016   3.399  -0.512
  215   2HB   HIS  33          1HB       HIS  33  -6.380   3.938  -2.063
  216    HD1  HIS  33           1HD      HIS  33  -8.102   4.364  -3.965
  217    HD2  HIS  33           2HD      HIS  33  -9.794   3.310  -0.320
  218    HE1  HIS  33           1HE      HIS  33 -10.549   4.899  -4.180
  219    HE2  HIS  33           2HE      HIS  33 -11.568   4.158  -1.998
  220    H    MET  34           H        MET  34  -4.814   0.262  -2.444
  221    HA   MET  34           HA       MET  34  -4.170  -0.307   0.318
  222   1HB   MET  34          2HB       MET  34  -3.131  -1.312  -2.317
  223   2HB   MET  34          1HB       MET  34  -2.295  -1.674  -0.813
  224   1HG   MET  34          2HG       MET  34  -5.184  -2.210  -0.812
  225   2HG   MET  34          1HG       MET  34  -4.223  -3.214  -1.895
  226   1HE   MET  34          1HE       MET  34  -1.664  -4.861   0.379
  227   2HE   MET  34          2HE       MET  34  -1.368  -3.125   0.486
  228   3HE   MET  34          3HE       MET  34  -1.820  -3.850  -1.057
  229    H    ALA  35           H        ALA  35  -1.726  -0.345   0.866
  230    HA   ALA  35           HA       ALA  35  -0.271   1.895  -0.284
  231   1HB   ALA  35          1HB       ALA  35  -1.886   2.552   1.706
  232   2HB   ALA  35          2HB       ALA  35  -0.296   3.288   1.508
  233   3HB   ALA  35          3HB       ALA  35  -0.524   1.978   2.669
  234    H    TRP  36           H        TRP  36   1.910   2.021   0.316
  235    HA   TRP  36           HA       TRP  36   3.033  -0.501   1.325
  236   1HB   TRP  36          2HB       TRP  36   3.850   1.453  -0.738
  237   2HB   TRP  36          1HB       TRP  36   5.158   0.857   0.278
  238    HD1  TRP  36           HD       TRP  36   3.442   0.057  -2.830
  239    HE1  TRP  36           1HE      TRP  36   3.899  -2.371  -3.553
  240    HE3  TRP  36           3HE      TRP  36   5.371  -1.747   1.548
  241    HZ2  TRP  36           2HZ      TRP  36   4.939  -4.737  -2.419
  242    HZ3  TRP  36           3HZ      TRP  36   6.072  -4.103   1.646
  243    HH2  TRP  36           HH       TRP  36   5.859  -5.566  -0.298
  244    H    VAL  37           H        VAL  37   3.430  -0.357   3.419
  245    HA   VAL  37           HA       VAL  37   4.287   2.160   4.636
  246    HB   VAL  37           HB       VAL  37   3.708  -0.281   6.259
  247   1HG1  VAL  37          1HG1      VAL  37   2.957   1.187   7.857
  248   2HG1  VAL  37          2HG1      VAL  37   2.764   2.510   6.702
  249   3HG1  VAL  37          3HG1      VAL  37   4.379   1.965   7.167
  250   1HG2  VAL  37          1HG2      VAL  37   1.911  -0.407   4.678
  251   2HG2  VAL  37          2HG2      VAL  37   1.615   1.331   4.789
  252   3HG2  VAL  37          3HG2      VAL  37   1.269   0.282   6.167
  253    H    ARG  38           H        ARG  38   5.909   1.977   6.435
  254    HA   ARG  38           HA       ARG  38   7.834  -0.191   6.138
  255   1HB   ARG  38          2HB       ARG  38   8.679   1.227   4.461
  256   2HB   ARG  38          1HB       ARG  38   8.387   2.673   5.416
  257   1HG   ARG  38          2HG       ARG  38  10.139   1.395   7.013
  258   2HG   ARG  38          1HG       ARG  38  10.672   0.828   5.427
  259   1HD   ARG  38          2HD       ARG  38  11.876   2.831   5.967
  260   2HD   ARG  38          1HD       ARG  38  10.733   3.190   4.668
  261    HE   ARG  38           HE       ARG  38   9.267   4.041   6.580
  262   1HH1  ARG  38          1HH1      ARG  38  12.752   4.163   6.598
  263   2HH1  ARG  38          2HH1      ARG  38  12.825   5.547   7.636
  264   1HH2  ARG  38          1HH2      ARG  38   9.358   5.863   7.946
  265   2HH2  ARG  38          2HH2      ARG  38  10.897   6.513   8.403
  266    H    GLN  39           H        GLN  39   9.373  -0.332   7.807
  267    HA   GLN  39           HA       GLN  39   9.057   1.445  10.110
  268   1HB   GLN  39          2HB       GLN  39   7.606  -0.475  10.545
  269   2HB   GLN  39          1HB       GLN  39   8.933  -1.572  10.229
  270   1HG   GLN  39          2HG       GLN  39   9.744  -1.355  12.290
  271   2HG   GLN  39          1HG       GLN  39   9.546   0.397  12.279
  272   1HE2  GLN  39          1HE2      GLN  39   7.303   1.180  12.582
  273   2HE2  GLN  39          2HE2      GLN  39   6.291   0.323  13.690
  274    H    ALA  40           H        ALA  40  10.975   2.027  10.914
  275    HA   ALA  40           HA       ALA  40  13.331   0.352  10.306
  276   1HB   ALA  40          1HB       ALA  40  14.236   2.001   9.115
  277   2HB   ALA  40          2HB       ALA  40  14.034   3.129  10.458
  278   3HB   ALA  40          3HB       ALA  40  12.734   2.908   9.287
  279    HA   PRO  41           HA       PRO  41  15.325   0.654  14.310
  280   1HB   PRO  41          2HB       PRO  41  16.352   3.373  13.554
  281   2HB   PRO  41          1HB       PRO  41  17.174   2.072  14.423
  282   1HG   PRO  41          2HG       PRO  41  17.527   2.525  11.765
  283   2HG   PRO  41          1HG       PRO  41  17.670   0.922  12.504
  284   1HD   PRO  41          2HD       PRO  41  15.664   1.895  10.646
  285   2HD   PRO  41          1HD       PRO  41  15.915   0.249  11.249
  286    H    GLY  42           H        GLY  42  14.684   4.116  13.648
  287   1HA   GLY  42          2HA       GLY  42  13.635   4.680  16.191
  288   2HA   GLY  42          1HA       GLY  42  13.358   5.648  14.748
  289    H    LYS  43           H        LYS  43  12.165   3.479  13.294
  290    HA   LYS  43           HA       LYS  43  10.129   2.723  12.738
  291   1HB   LYS  43          2HB       LYS  43   9.282   1.115  14.106
  292   2HB   LYS  43          1HB       LYS  43  10.883   1.303  14.797
  293   1HG   LYS  43          2HG       LYS  43   9.716   2.990  16.391
  294   2HG   LYS  43          1HG       LYS  43   8.241   2.163  15.886
  295   1HD   LYS  43          2HD       LYS  43   8.915   1.016  17.814
  296   2HD   LYS  43          1HD       LYS  43   9.474  -0.001  16.485
  297   1HE   LYS  43          2HE       LYS  43  11.705   1.129  16.688
  298   2HE   LYS  43          1HE       LYS  43  11.108   1.903  18.154
  299   1HZ   LYS  43          1HZ       LYS  43  12.421  -0.183  18.491
  300   2HZ   LYS  43          2HZ       LYS  43  11.144  -1.038  17.783
  301   3HZ   LYS  43          3HZ       LYS  43  10.893  -0.178  19.218
  302    H    GLY  44           H        GLY  44   7.709   2.620  13.621
  303   1HA   GLY  44          2HA       GLY  44   6.107   4.143  14.859
  304   2HA   GLY  44          1HA       GLY  44   6.944   5.442  14.011
  305    H    LEU  45           H        LEU  45   7.164   3.085  11.930
  306    HA   LEU  45           HA       LEU  45   6.221   2.496   9.980
  307   1HB   LEU  45          2HB       LEU  45   4.173   2.216  11.888
  308   2HB   LEU  45          1HB       LEU  45   3.443   2.986  10.491
  309    HG   LEU  45           HG       LEU  45   4.058   1.156   9.049
  310   1HD1  LEU  45          1HD1      LEU  45   6.157   0.826  10.851
  311   2HD1  LEU  45          2HD1      LEU  45   5.814  -0.127   9.405
  312   3HD1  LEU  45          3HD1      LEU  45   5.195  -0.648  10.974
  313   1HD2  LEU  45          1HD2      LEU  45   2.471  -0.236   9.779
  314   2HD2  LEU  45          2HD2      LEU  45   2.255   0.935  11.080
  315   3HD2  LEU  45          3HD2      LEU  45   3.259  -0.495  11.334
  316    H    GLU  46           H        GLU  46   5.895   3.423   8.113
  317    HA   GLU  46           HA       GLU  46   4.684   6.094   8.023
  318   1HB   GLU  46          2HB       GLU  46   7.067   6.462   7.870
  319   2HB   GLU  46          1HB       GLU  46   7.228   5.199   6.656
  320   1HG   GLU  46          2HG       GLU  46   6.667   6.567   4.994
  321   2HG   GLU  46          1HG       GLU  46   5.331   7.273   5.905
  322    H    TRP  47           H        TRP  47   3.021   6.110   6.675
  323    HA   TRP  47           HA       TRP  47   2.212   3.911   5.186
  324   1HB   TRP  47          2HB       TRP  47   0.373   5.193   5.319
  325   2HB   TRP  47          1HB       TRP  47   1.322   6.651   5.581
  326    HD1  TRP  47           HD       TRP  47   0.574   4.406   2.494
  327    HE1  TRP  47           1HE      TRP  47   0.101   5.966   0.503
  328    HE3  TRP  47           3HE      TRP  47   1.097   8.896   4.845
  329    HZ2  TRP  47           2HZ      TRP  47  -0.065   8.744   0.002
  330    HZ3  TRP  47           3HZ      TRP  47   0.762  10.966   3.550
  331    HH2  TRP  47           HH       TRP  47   0.191  10.887   1.178
  332    H    VAL  48           H        VAL  48   4.395   6.477   4.384
  333    HA   VAL  48           HA       VAL  48   5.691   6.917   2.580
  334    HB   VAL  48           HB       VAL  48   5.397   3.937   2.339
  335   1HG1  VAL  48          1HG1      VAL  48   6.295   3.914   0.306
  336   2HG1  VAL  48          2HG1      VAL  48   7.668   4.854   0.891
  337   3HG1  VAL  48          3HG1      VAL  48   6.240   5.677   0.265
  338   1HG2  VAL  48          1HG2      VAL  48   7.958   5.332   2.882
  339   2HG2  VAL  48          2HG2      VAL  48   7.345   3.801   3.508
  340   3HG2  VAL  48          3HG2      VAL  48   6.740   5.324   4.158
  341    H    SER  49           H        SER  49   3.757   4.341   0.992
  342    HA   SER  49           HA       SER  49   2.786   6.441  -0.850
  343   1HB   SER  49          2HB       SER  49   3.828   3.727  -1.673
  344   2HB   SER  49          1HB       SER  49   3.188   4.965  -2.755
  345    HG   SER  49           HG       SER  49   4.972   6.258  -1.521
  346    H    THR  50           H        THR  50   0.908   6.002  -2.056
  347    HA   THR  50           HA       THR  50  -0.748   3.722  -1.313
  348    HB   THR  50           HB       THR  50  -1.364   6.550  -0.562
  349    HG1  THR  50           1HG      THR  50  -0.859   4.556   0.823
  350   1HG2  THR  50          1HG2      THR  50  -3.117   5.923  -2.224
  351   2HG2  THR  50          2HG2      THR  50  -3.741   6.201  -0.598
  352   3HG2  THR  50          3HG2      THR  50  -3.537   4.553  -1.194
  353    H    ILE  51           H        ILE  51  -2.034   3.069  -2.986
  354    HA   ILE  51           HA       ILE  51  -2.081   4.825  -5.356
  355    HB   ILE  51           HB       ILE  51  -0.718   2.827  -5.727
  356   1HG1  ILE  51          2HG1      ILE  51  -3.030   2.105  -7.388
  357   2HG1  ILE  51          1HG1      ILE  51  -2.676   3.831  -7.377
  358   1HG2  ILE  51          1HG2      ILE  51  -1.295   0.769  -5.091
  359   2HG2  ILE  51          2HG2      ILE  51  -2.902   0.911  -5.803
  360   3HG2  ILE  51          3HG2      ILE  51  -2.599   1.534  -4.181
  361   1HD1  ILE  51          1HD1      ILE  51  -0.335   3.292  -8.002
  362   2HD1  ILE  51          2HD1      ILE  51  -1.532   2.822  -9.211
  363   3HD1  ILE  51          3HD1      ILE  51  -0.816   1.602  -8.157
  364    H    ASN  52           H        ASN  52  -3.969   5.137  -6.437
  365    HA   ASN  52           HA       ASN  52  -6.384   3.948  -5.236
  366   1HB   ASN  52          2HB       ASN  52  -6.358   6.291  -4.736
  367   2HB   ASN  52          1HB       ASN  52  -5.935   6.701  -6.394
  368   1HD2  ASN  52          1HD2      ASN  52  -7.709   8.077  -6.549
  369   2HD2  ASN  52          2HD2      ASN  52  -9.318   7.475  -6.728
  370    HA   PRO  53           HA       PRO  53  -6.764   2.213  -9.368
  371   1HB   PRO  53          2HB       PRO  53  -9.051   0.825  -8.885
  372   2HB   PRO  53          1HB       PRO  53  -7.458   0.263  -8.366
  373   1HG   PRO  53          2HG       PRO  53  -9.570   1.689  -6.791
  374   2HG   PRO  53          1HG       PRO  53  -8.574   0.296  -6.324
  375   1HD   PRO  53          2HD       PRO  53  -8.008   2.805  -5.507
  376   2HD   PRO  53          1HD       PRO  53  -6.738   1.611  -5.843
  377    H    GLY  54           H        GLY  54  -8.427   2.222 -11.075
  378   1HA   GLY  54          2HA       GLY  54 -10.395   3.059 -12.072
  379   2HA   GLY  54          1HA       GLY  54 -10.609   4.129 -10.695
  380    H    ASP  55           H        ASP  55  -9.099   5.963 -10.516
  381    HA   ASP  55           HA       ASP  55  -8.803   7.232 -13.089
  382   1HB   ASP  55          2HB       ASP  55  -8.391   8.149 -10.250
  383   2HB   ASP  55          1HB       ASP  55  -7.937   9.154 -11.623
  384    H    GLY  56           H        GLY  56  -6.537   6.954 -10.340
  385   1HA   GLY  56          2HA       GLY  56  -4.423   5.670 -11.028
  386   2HA   GLY  56          1HA       GLY  56  -4.336   6.885 -12.295
  387    H    SER  57           H        SER  57  -5.630   8.577  -9.907
  388    HA   SER  57           HA       SER  57  -3.384  10.111  -9.338
  389   1HB   SER  57          2HB       SER  57  -6.139   9.969  -8.417
  390   2HB   SER  57          1HB       SER  57  -5.042  10.421  -7.114
  391    HG   SER  57           HG       SER  57  -4.838  12.303  -8.005
  392    H    THR  58           H        THR  58  -1.812  10.053  -7.816
  393    HA   THR  58           HA       THR  58  -1.849   7.759  -5.967
  394    HB   THR  58           HB       THR  58   0.806   8.586  -6.218
  395    HG1  THR  58           1HG      THR  58   0.905   8.245  -8.642
  396   1HG2  THR  58          1HG2      THR  58  -0.756   6.282  -7.358
  397   2HG2  THR  58          2HG2      THR  58   0.272   6.306  -5.925
  398   3HG2  THR  58          3HG2      THR  58   0.994   6.415  -7.530
  399    H    TYR  59           H        TYR  59  -0.741   8.025  -3.946
  400    HA   TYR  59           HA       TYR  59  -0.441  10.813  -3.059
  401   1HB   TYR  59          2HB       TYR  59  -1.722   8.649  -1.382
  402   2HB   TYR  59          1HB       TYR  59  -1.603  10.364  -1.004
  403    HD1  TYR  59           1HD      TYR  59  -3.394   7.819  -2.914
  404    HD2  TYR  59           2HD      TYR  59  -3.072  11.983  -2.100
  405    HE1  TYR  59           1HE      TYR  59  -5.600   8.183  -3.938
  406    HE2  TYR  59           2HE      TYR  59  -5.277  12.359  -3.124
  407    HH   TYR  59           HH       TYR  59  -6.696  10.669  -5.106
  408    H    TYR  60           H        TYR  60   1.409  11.184  -1.977
  409    HA   TYR  60           HA       TYR  60   2.862   8.861  -0.894
  410   1HB   TYR  60          2HB       TYR  60   3.926  11.153  -2.536
  411   2HB   TYR  60          1HB       TYR  60   4.971  10.161  -1.529
  412    HD1  TYR  60           1HD      TYR  60   5.993   8.329  -2.489
  413    HD2  TYR  60           2HD      TYR  60   2.376   9.782  -4.198
  414    HE1  TYR  60           1HE      TYR  60   6.205   6.695  -4.314
  415    HE2  TYR  60           2HE      TYR  60   2.581   8.150  -6.026
  416    HH   TYR  60           HH       TYR  60   5.175   6.724  -6.935
  417    H    ALA  61           H        ALA  61   4.398   9.367   0.804
  418    HA   ALA  61           HA       ALA  61   3.305  11.216   2.703
  419   1HB   ALA  61          1HB       ALA  61   4.104   9.177   3.597
  420   2HB   ALA  61          2HB       ALA  61   5.250  10.412   4.118
  421   3HB   ALA  61          3HB       ALA  61   5.659   9.340   2.779
  422    H    ASP  62           H        ASP  62   4.650  12.147   0.144
  423    HA   ASP  62           HA       ASP  62   5.697  14.059  -0.495
  424   1HB   ASP  62          2HB       ASP  62   4.849  14.955   1.738
  425   2HB   ASP  62          1HB       ASP  62   6.452  14.596   2.372
  426    H    SER  63           H        SER  63   7.536  12.625   2.215
  427    HA   SER  63           HA       SER  63  10.033  13.076   0.850
  428   1HB   SER  63          2HB       SER  63   9.176  12.263   3.525
  429   2HB   SER  63          1HB       SER  63  10.598  11.388   2.958
  430    HG   SER  63           HG       SER  63  11.737  13.146   3.145
  431    H    VAL  64           H        VAL  64   8.095  11.344  -0.476
  432    HA   VAL  64           HA       VAL  64   9.875   9.096  -0.960
  433    HB   VAL  64           HB       VAL  64   7.732   7.602  -1.015
  434   1HG1  VAL  64          1HG1      VAL  64   8.356   6.683   1.016
  435   2HG1  VAL  64          2HG1      VAL  64   8.713   8.254   1.734
  436   3HG1  VAL  64          3HG1      VAL  64   9.807   7.562   0.536
  437   1HG2  VAL  64          1HG2      VAL  64   6.939   9.776   0.914
  438   2HG2  VAL  64          2HG2      VAL  64   6.164   8.194   0.822
  439   3HG2  VAL  64          3HG2      VAL  64   6.095   9.292  -0.557
  440    H    LYS  65           H        LYS  65   7.684  11.431  -1.989
  441    HA   LYS  65           HA       LYS  65   6.508  10.332  -4.253
  442   1HB   LYS  65          2HB       LYS  65   6.131  12.646  -3.261
  443   2HB   LYS  65          1HB       LYS  65   7.571  13.152  -4.134
  444   1HG   LYS  65          2HG       LYS  65   5.740  13.761  -5.479
  445   2HG   LYS  65          1HG       LYS  65   6.441  12.329  -6.233
  446   1HD   LYS  65          2HD       LYS  65   4.654  11.006  -5.710
  447   2HD   LYS  65          1HD       LYS  65   4.273  11.918  -4.247
  448   1HE   LYS  65          2HE       LYS  65   2.882  13.304  -5.331
  449   2HE   LYS  65          1HE       LYS  65   3.957  13.447  -6.721
  450   1HZ   LYS  65          1HZ       LYS  65   1.651  11.816  -6.397
  451   2HZ   LYS  65          2HZ       LYS  65   2.995  10.876  -6.811
  452   3HZ   LYS  65          3HZ       LYS  65   2.528  12.164  -7.802
  453    H    GLY  66           H        GLY  66   9.777  11.446  -3.727
  454   1HA   GLY  66          2HA       GLY  66  10.441  10.702  -6.510
  455   2HA   GLY  66          1HA       GLY  66  11.321  11.910  -5.581
  456    H    ARG  67           H        ARG  67  10.484   9.477  -3.527
  457    HA   ARG  67           HA       ARG  67  13.176   8.343  -3.629
  458   1HB   ARG  67          2HB       ARG  67  12.175   9.288  -1.502
  459   2HB   ARG  67          1HB       ARG  67  11.067   7.923  -1.511
  460   1HG   ARG  67          2HG       ARG  67  12.701   7.148  -0.118
  461   2HG   ARG  67          1HG       ARG  67  13.265   6.521  -1.671
  462   1HD   ARG  67          2HD       ARG  67  15.010   7.642  -0.225
  463   2HD   ARG  67          1HD       ARG  67  14.882   8.222  -1.886
  464    HE   ARG  67           HE       ARG  67  13.639   9.640   0.381
  465   1HH1  ARG  67          1HH1      ARG  67  15.556   9.596  -2.529
  466   2HH1  ARG  67          2HH1      ARG  67  15.724  11.319  -2.600
  467   1HH2  ARG  67          1HH2      ARG  67  13.854  11.911   0.297
  468   2HH2  ARG  67          2HH2      ARG  67  14.755  12.635  -0.992
  469    H    PHE  68           H        PHE  68   9.940   7.053  -2.891
  470    HA   PHE  68           HA       PHE  68  10.714   4.559  -4.242
  471   1HB   PHE  68          2HB       PHE  68   8.599   5.053  -2.140
  472   2HB   PHE  68          1HB       PHE  68   8.938   3.496  -2.886
  473    HD1  PHE  68           1HD      PHE  68  11.482   2.770  -2.719
  474    HD2  PHE  68           2HD      PHE  68   9.533   5.496  -0.104
  475    HE1  PHE  68           1HE      PHE  68  13.167   2.306  -0.989
  476    HE2  PHE  68           2HE      PHE  68  11.216   5.041   1.632
  477    HZ   PHE  68           HZ       PHE  68  13.033   3.441   1.189
  478    H    THR  69           H        THR  69   8.996   3.393  -5.368
  479    HA   THR  69           HA       THR  69   6.969   5.198  -6.520
  480    HB   THR  69           HB       THR  69   8.666   3.140  -7.939
  481    HG1  THR  69           1HG      THR  69   9.158   4.945  -9.246
  482   1HG2  THR  69          1HG2      THR  69   7.284   3.405  -9.901
  483   2HG2  THR  69          2HG2      THR  69   6.254   4.569  -9.069
  484   3HG2  THR  69          3HG2      THR  69   6.263   2.879  -8.562
  485    H    ILE  70           H        ILE  70   4.958   4.506  -6.355
  486    HA   ILE  70           HA       ILE  70   4.504   1.772  -5.422
  487    HB   ILE  70           HB       ILE  70   3.594   4.060  -4.351
  488   1HG1  ILE  70          2HG1      ILE  70   2.496   1.280  -4.386
  489   2HG1  ILE  70          1HG1      ILE  70   3.297   2.154  -3.084
  490   1HG2  ILE  70          1HG2      ILE  70   1.537   4.773  -5.046
  491   2HG2  ILE  70          2HG2      ILE  70   1.115   3.219  -5.763
  492   3HG2  ILE  70          3HG2      ILE  70   2.241   4.295  -6.591
  493   1HD1  ILE  70          1HD1      ILE  70   0.449   2.277  -3.956
  494   2HD1  ILE  70          2HD1      ILE  70   1.179   3.613  -3.066
  495   3HD1  ILE  70          3HD1      ILE  70   1.122   2.002  -2.348
  496    H    SER  71           H        SER  71   3.322   0.335  -6.539
  497    HA   SER  71           HA       SER  71   1.790   1.174  -8.868
  498   1HB   SER  71          2HB       SER  71   3.788  -1.047  -9.215
  499   2HB   SER  71          1HB       SER  71   2.965  -0.096 -10.451
  500    HG   SER  71           HG       SER  71   4.349   1.530 -10.154
  501    H    ARG  72           H        ARG  72   0.500  -0.610  -9.764
  502    HA   ARG  72           HA       ARG  72   0.221  -3.051  -8.312
  503   1HB   ARG  72          2HB       ARG  72  -0.847  -1.735  -6.640
  504   2HB   ARG  72          1HB       ARG  72  -1.772  -0.840  -7.837
  505   1HG   ARG  72          2HG       ARG  72  -2.642  -3.335  -8.346
  506   2HG   ARG  72          1HG       ARG  72  -2.284  -3.472  -6.623
  507   1HD   ARG  72          2HD       ARG  72  -4.402  -2.689  -6.445
  508   2HD   ARG  72          1HD       ARG  72  -3.577  -1.139  -6.595
  509    HE   ARG  72           HE       ARG  72  -5.214  -2.453  -8.616
  510   1HH1  ARG  72          1HH1      ARG  72  -3.104   0.183  -7.754
  511   2HH1  ARG  72          2HH1      ARG  72  -3.598   1.182  -9.080
  512   1HH2  ARG  72          1HH2      ARG  72  -5.874  -1.143 -10.362
  513   2HH2  ARG  72          2HH2      ARG  72  -5.173   0.429 -10.562
  514    H    ASP  73           H        ASP  73  -0.992  -4.543  -9.397
  515    HA   ASP  73           HA       ASP  73  -1.788  -3.816 -12.093
  516   1HB   ASP  73          2HB       ASP  73  -0.782  -6.162 -10.834
  517   2HB   ASP  73          1HB       ASP  73  -2.366  -6.552 -11.498
  518    H    ASN  74           H        ASN  74  -3.849  -3.940 -12.915
  519    HA   ASN  74           HA       ASN  74  -5.987  -3.858 -10.947
  520   1HB   ASN  74          2HB       ASN  74  -7.274  -3.434 -13.273
  521   2HB   ASN  74          1HB       ASN  74  -6.448  -2.156 -12.388
  522   1HD2  ASN  74          1HD2      ASN  74  -5.617  -4.730 -14.693
  523   2HD2  ASN  74          2HD2      ASN  74  -4.626  -3.737 -15.702
  524    H    ALA  75           H        ALA  75  -4.973  -6.372 -11.056
  525    HA   ALA  75           HA       ALA  75  -7.268  -7.882 -11.958
  526   1HB   ALA  75          1HB       ALA  75  -6.415  -8.743 -13.816
  527   2HB   ALA  75          2HB       ALA  75  -5.016  -9.340 -12.922
  528   3HB   ALA  75          3HB       ALA  75  -4.992  -7.721 -13.619
  529    H    LYS  76           H        LYS  76  -3.888  -8.696 -11.169
  530    HA   LYS  76           HA       LYS  76  -4.747 -10.724  -9.316
  531   1HB   LYS  76          2HB       LYS  76  -2.773 -11.087 -10.698
  532   2HB   LYS  76          1HB       LYS  76  -1.992  -9.679  -9.994
  533   1HG   LYS  76          2HG       LYS  76  -1.936 -10.776  -7.823
  534   2HG   LYS  76          1HG       LYS  76  -2.757 -12.182  -8.504
  535   1HD   LYS  76          2HD       LYS  76  -0.326 -11.333  -9.930
  536   2HD   LYS  76          1HD       LYS  76  -0.066 -11.935  -8.292
  537   1HE   LYS  76          2HE       LYS  76  -0.637 -14.049  -8.838
  538   2HE   LYS  76          1HE       LYS  76  -1.896 -13.529  -9.958
  539   1HZ   LYS  76          1HZ       LYS  76  -0.265 -14.515 -11.282
  540   2HZ   LYS  76          2HZ       LYS  76   1.008 -13.772 -10.454
  541   3HZ   LYS  76          3HZ       LYS  76   0.010 -12.855 -11.465
  542    H    ASN  77           H        ASN  77  -4.446 -10.766  -7.097
  543    HA   ASN  77           HA       ASN  77  -4.595  -8.207  -5.786
  544   1HB   ASN  77          2HB       ASN  77  -4.349 -10.214  -3.830
  545   2HB   ASN  77          1HB       ASN  77  -5.828  -9.432  -4.378
  546   1HD2  ASN  77          1HD2      ASN  77  -3.910 -12.274  -4.434
  547   2HD2  ASN  77          2HD2      ASN  77  -5.009 -13.265  -5.328
  548    H    THR  78           H        THR  78  -2.502  -7.343  -6.234
  549    HA   THR  78           HA       THR  78  -0.546  -8.104  -4.245
  550    HB   THR  78           HB       THR  78   0.606  -7.917  -6.980
  551    HG1  THR  78           1HG      THR  78  -1.088  -9.464  -7.203
  552   1HG2  THR  78          1HG2      THR  78   2.293  -9.338  -6.059
  553   2HG2  THR  78          2HG2      THR  78   1.298  -9.704  -4.651
  554   3HG2  THR  78          3HG2      THR  78   1.954  -8.081  -4.870
  555    H    LEU  79           H        LEU  79   1.173  -6.584  -4.010
  556    HA   LEU  79           HA       LEU  79   0.743  -3.990  -5.327
  557   1HB   LEU  79          2HB       LEU  79  -0.226  -4.133  -2.974
  558   2HB   LEU  79          1HB       LEU  79   1.425  -4.282  -2.405
  559    HG   LEU  79           HG       LEU  79   1.930  -2.069  -3.431
  560   1HD1  LEU  79          1HD1      LEU  79   0.270  -0.681  -4.318
  561   2HD1  LEU  79          2HD1      LEU  79  -1.034  -1.706  -3.717
  562   3HD1  LEU  79          3HD1      LEU  79  -0.029  -2.254  -5.059
  563   1HD2  LEU  79          1HD2      LEU  79   0.173  -0.873  -1.791
  564   2HD2  LEU  79          2HD2      LEU  79   1.616  -1.713  -1.224
  565   3HD2  LEU  79          3HD2      LEU  79   0.054  -2.531  -1.202
  566    H    TYR  80           H        TYR  80   2.566  -3.202  -6.196
  567    HA   TYR  80           HA       TYR  80   5.132  -4.256  -5.197
  568   1HB   TYR  80          2HB       TYR  80   4.546  -3.402  -8.033
  569   2HB   TYR  80          1HB       TYR  80   6.012  -4.172  -7.441
  570    HD1  TYR  80           1HD      TYR  80   6.194  -6.512  -7.374
  571    HD2  TYR  80           2HD      TYR  80   2.385  -4.727  -8.003
  572    HE1  TYR  80           1HE      TYR  80   5.255  -8.719  -7.916
  573    HE2  TYR  80           2HE      TYR  80   1.434  -6.928  -8.543
  574    HH   TYR  80           HH       TYR  80   1.981  -9.079  -9.119
  575    H    LEU  81           H        LEU  81   6.923  -2.891  -5.185
  576    HA   LEU  81           HA       LEU  81   6.485  -0.063  -5.767
  577   1HB   LEU  81          2HB       LEU  81   5.994  -0.336  -3.365
  578   2HB   LEU  81          1HB       LEU  81   7.577  -1.056  -3.129
  579    HG   LEU  81           HG       LEU  81   8.062   1.416  -4.370
  580   1HD1  LEU  81          1HD1      LEU  81   6.717   2.351  -2.010
  581   2HD1  LEU  81          2HD1      LEU  81   5.573   1.576  -3.108
  582   3HD1  LEU  81          3HD1      LEU  81   6.580   2.909  -3.678
  583   1HD2  LEU  81          1HD2      LEU  81   8.679   1.891  -1.804
  584   2HD2  LEU  81          2HD2      LEU  81   9.670   0.913  -2.887
  585   3HD2  LEU  81          3HD2      LEU  81   8.552   0.132  -1.768
  586    H    GLN  82           H        GLN  82   8.311   1.026  -6.401
  587    HA   GLN  82           HA       GLN  82  10.676  -0.651  -6.846
  588   1HB   GLN  82          2HB       GLN  82   9.287   0.765  -8.674
  589   2HB   GLN  82          1HB       GLN  82  10.445   1.989  -8.177
  590   1HG   GLN  82          2HG       GLN  82  11.115   0.633 -10.163
  591   2HG   GLN  82          1HG       GLN  82  12.282   0.653  -8.843
  592   1HE2  GLN  82          1HE2      GLN  82  13.175  -1.235  -8.484
  593   2HE2  GLN  82          2HE2      GLN  82  12.432  -2.780  -8.699
  594    H    MET  83           H        MET  83  12.088  -0.414  -5.270
  595    HA   MET  83           HA       MET  83  12.349   2.071  -3.826
  596   1HB   MET  83          2HB       MET  83  13.702  -0.609  -3.553
  597   2HB   MET  83          1HB       MET  83  14.067   0.767  -2.519
  598   1HG   MET  83          2HG       MET  83  12.102   0.622  -1.393
  599   2HG   MET  83          1HG       MET  83  11.229  -0.033  -2.776
  600   1HE   MET  83          1HE       MET  83  11.377  -1.256   0.612
  601   2HE   MET  83          2HE       MET  83  10.696  -2.729  -0.077
  602   3HE   MET  83          3HE       MET  83  10.167  -1.153  -0.666
  603    H    ASN  84           H        ASN  84  13.315   3.611  -5.011
  604    HA   ASN  84           HA       ASN  84  16.012   3.006  -6.044
  605   1HB   ASN  84          2HB       ASN  84  14.336   5.207  -7.204
  606   2HB   ASN  84          1HB       ASN  84  15.671   4.322  -7.936
  607   1HD2  ASN  84          1HD2      ASN  84  15.275   2.479  -9.042
  608   2HD2  ASN  84          2HD2      ASN  84  13.694   1.840  -9.320
  609    H    SER  85           H        SER  85  17.338   5.072  -6.306
  610    HA   SER  85           HA       SER  85  18.470   6.760  -5.289
  611   1HB   SER  85          2HB       SER  85  15.663   7.524  -5.281
  612   2HB   SER  85          1HB       SER  85  16.547   8.265  -3.946
  613    HG   SER  85           HG       SER  85  17.691   8.293  -6.501
  614    H    LEU  86           H        LEU  86  18.106   4.306  -3.798
  615    HA   LEU  86           HA       LEU  86  17.467   4.772  -1.101
  616   1HB   LEU  86          2HB       LEU  86  19.486   2.774  -2.120
  617   2HB   LEU  86          1HB       LEU  86  18.584   2.696  -0.618
  618    HG   LEU  86           HG       LEU  86  16.543   2.749  -2.392
  619   1HD1  LEU  86          1HD1      LEU  86  18.856   2.232  -3.962
  620   2HD1  LEU  86          2HD1      LEU  86  17.166   2.281  -4.465
  621   3HD1  LEU  86          3HD1      LEU  86  17.877   0.767  -3.905
  622   1HD2  LEU  86          1HD2      LEU  86  16.464   1.117  -0.774
  623   2HD2  LEU  86          2HD2      LEU  86  18.089   0.532  -1.129
  624   3HD2  LEU  86          3HD2      LEU  86  16.757   0.153  -2.221
  625    H    LYS  87           H        LYS  87  18.504   5.803   0.466
  626    HA   LYS  87           HA       LYS  87  21.334   6.502   0.034
  627   1HB   LYS  87          2HB       LYS  87  20.941   8.528   1.352
  628   2HB   LYS  87          1HB       LYS  87  19.879   8.470  -0.047
  629   1HG   LYS  87          2HG       LYS  87  18.829   7.384   2.499
  630   2HG   LYS  87          1HG       LYS  87  19.022   9.134   2.372
  631   1HD   LYS  87          2HD       LYS  87  17.839   8.257  -0.036
  632   2HD   LYS  87          1HD       LYS  87  16.976   7.460   1.280
  633   1HE   LYS  87          2HE       LYS  87  17.378  10.409   0.840
  634   2HE   LYS  87          1HE       LYS  87  15.860   9.514   0.868
  635   1HZ   LYS  87          1HZ       LYS  87  17.432  10.550   3.060
  636   2HZ   LYS  87          2HZ       LYS  87  16.864   8.975   3.296
  637   3HZ   LYS  87          3HZ       LYS  87  15.774  10.227   2.974
  638    H    SER  88           H        SER  88  18.892   5.736   2.472
  639    HA   SER  88           HA       SER  88  20.454   3.946   3.916
  640   1HB   SER  88          2HB       SER  88  21.617   6.254   4.393
  641   2HB   SER  88          1HB       SER  88  20.257   6.496   5.490
  642    HG   SER  88           HG       SER  88  21.215   5.222   6.842
  643    H    GLU  89           H        GLU  89  17.940   6.378   3.948
  644    HA   GLU  89           HA       GLU  89  16.491   5.425   6.169
  645   1HB   GLU  89          2HB       GLU  89  15.192   7.197   5.757
  646   2HB   GLU  89          1HB       GLU  89  16.308   7.583   4.460
  647   1HG   GLU  89          2HG       GLU  89  14.862   6.216   2.935
  648   2HG   GLU  89          1HG       GLU  89  13.695   6.111   4.252
  649    H    ASP  90           H        ASP  90  16.767   4.293   2.930
  650    HA   ASP  90           HA       ASP  90  14.323   2.955   2.629
  651   1HB   ASP  90          2HB       ASP  90  17.036   2.172   1.543
  652   2HB   ASP  90          1HB       ASP  90  15.487   1.579   0.955
  653    H    THR  91           H        THR  91  17.411   1.878   4.004
  654    HA   THR  91           HA       THR  91  16.934  -0.764   4.529
  655    HB   THR  91           HB       THR  91  18.388   1.299   6.173
  656    HG1  THR  91           1HG      THR  91  19.883   0.806   4.780
  657   1HG2  THR  91          1HG2      THR  91  18.439  -0.081   7.924
  658   2HG2  THR  91          2HG2      THR  91  19.310  -1.243   6.921
  659   3HG2  THR  91          3HG2      THR  91  17.552  -1.318   7.032
  660    H    ALA  92           H        ALA  92  14.917  -1.399   5.136
  661    HA   ALA  92           HA       ALA  92  14.185  -1.368   7.831
  662   1HB   ALA  92          1HB       ALA  92  13.553   0.858   7.783
  663   2HB   ALA  92          2HB       ALA  92  12.031   0.027   7.458
  664   3HB   ALA  92          3HB       ALA  92  12.939   0.754   6.132
  665    H    VAL  93           H        VAL  93  11.789  -2.051   8.086
  666    HA   VAL  93           HA       VAL  93  11.290  -4.169   6.132
  667    HB   VAL  93           HB       VAL  93   9.847  -3.666   8.741
  668   1HG1  VAL  93          1HG1      VAL  93   9.352  -6.129   8.500
  669   2HG1  VAL  93          2HG1      VAL  93   9.952  -6.000   6.848
  670   3HG1  VAL  93          3HG1      VAL  93   8.543  -5.066   7.349
  671   1HG2  VAL  93          1HG2      VAL  93  11.869  -4.150   9.635
  672   2HG2  VAL  93          2HG2      VAL  93  12.452  -4.931   8.165
  673   3HG2  VAL  93          3HG2      VAL  93  11.385  -5.804   9.264
  674    H    TYR  94           H        TYR  94   9.415  -4.262   4.869
  675    HA   TYR  94           HA       TYR  94   7.748  -1.845   5.018
  676   1HB   TYR  94          2HB       TYR  94   8.626  -3.435   2.614
  677   2HB   TYR  94          1HB       TYR  94   7.362  -2.206   2.549
  678    HD1  TYR  94           1HD      TYR  94  10.920  -2.698   3.537
  679    HD2  TYR  94           2HD      TYR  94   7.939   0.040   2.229
  680    HE1  TYR  94           1HE      TYR  94  12.636  -0.951   3.309
  681    HE2  TYR  94           2HE      TYR  94   9.650   1.794   1.993
  682    HH   TYR  94           HH       TYR  94  11.806   2.365   2.667
  683    H    TYR  95           H        TYR  95   5.633  -1.945   5.054
  684    HA   TYR  95           HA       TYR  95   4.333  -4.587   5.073
  685   1HB   TYR  95          2HB       TYR  95   3.474  -2.069   6.529
  686   2HB   TYR  95          1HB       TYR  95   2.766  -3.676   6.690
  687    HD1  TYR  95           1HD      TYR  95   4.329  -5.550   7.574
  688    HD2  TYR  95           2HD      TYR  95   5.158  -1.398   7.935
  689    HE1  TYR  95           1HE      TYR  95   5.905  -6.031   9.402
  690    HE2  TYR  95           2HE      TYR  95   6.728  -1.859   9.758
  691    HH   TYR  95           HH       TYR  95   8.031  -3.618  10.670
  692    H    CYS  96           H        CYS  96   1.923  -4.414   4.599
  693    HA   CYS  96           HA       CYS  96   1.255  -2.261   2.753
  694   1HB   CYS  96          2HB       CYS  96   0.280  -4.045   1.170
  695   2HB   CYS  96          1HB       CYS  96   2.021  -3.799   1.144
  696    H    ALA  97           H        ALA  97  -0.936  -1.781   2.695
  697    HA   ALA  97           HA       ALA  97  -2.867  -3.571   3.861
  698   1HB   ALA  97          1HB       ALA  97  -1.697  -1.376   5.460
  699   2HB   ALA  97          2HB       ALA  97  -2.294  -2.958   5.963
  700   3HB   ALA  97          3HB       ALA  97  -3.432  -1.659   5.602
  701    H    LYS  98           H        LYS  98  -5.025  -2.581   4.093
  702    HA   LYS  98           HA       LYS  98  -5.622  -0.976   1.758
  703   1HB   LYS  98          2HB       LYS  98  -7.046  -2.858   2.143
  704   2HB   LYS  98          1HB       LYS  98  -7.323  -2.388   3.813
  705   1HG   LYS  98          2HG       LYS  98  -8.304  -0.219   2.624
  706   2HG   LYS  98          1HG       LYS  98  -8.566  -1.381   1.323
  707   1HD   LYS  98          2HD       LYS  98 -10.091  -2.591   2.526
  708   2HD   LYS  98          1HD       LYS  98  -9.368  -2.163   4.077
  709   1HE   LYS  98          2HE       LYS  98 -10.741  -0.427   4.336
  710   2HE   LYS  98          1HE       LYS  98 -10.409   0.162   2.707
  711   1HZ   LYS  98          1HZ       LYS  98 -12.059  -2.168   2.684
  712   2HZ   LYS  98          2HZ       LYS  98 -12.328  -0.654   1.980
  713   3HZ   LYS  98          3HZ       LYS  98 -12.758  -0.922   3.593
  714    H    TYR  99           H        TYR  99  -6.708   1.010   1.779
  715    HA   TYR  99           HA       TYR  99  -6.181   2.645   4.124
  716   1HB   TYR  99          2HB       TYR  99  -6.172   3.110   1.357
  717   2HB   TYR  99          1HB       TYR  99  -7.545   4.022   1.973
  718    HD1  TYR  99           1HD      TYR  99  -3.939   3.412   2.763
  719    HD2  TYR  99           2HD      TYR  99  -7.178   6.173   2.723
  720    HE1  TYR  99           1HE      TYR  99  -2.418   5.199   3.490
  721    HE2  TYR  99           2HE      TYR  99  -5.664   7.967   3.452
  722    HH   TYR  99           HH       TYR  99  -2.438   7.849   3.245
  723    H    SER 100           H        SER 100  -7.697   3.437   5.488
  724    HA   SER 100           HA       SER 100 -10.437   3.740   4.839
  725   1HB   SER 100          2HB       SER 100  -9.684   1.110   5.600
  726   2HB   SER 100          1HB       SER 100 -10.587   1.805   6.945
  727    HG   SER 100           HG       SER 100 -12.339   1.982   5.707
  728    H    GLY 101           H        GLY 101 -11.403   5.099   6.253
  729   1HA   GLY 101          2HA       GLY 101 -11.790   6.267   8.217
  730   2HA   GLY 101          1HA       GLY 101 -10.557   5.293   9.002
  731    H    GLY 102           H        GLY 102  -8.994   6.283   6.379
  732   1HA   GLY 102          2HA       GLY 102  -7.876   8.289   5.794
  733   2HA   GLY 102          1HA       GLY 102  -8.359   8.979   7.336
  734    H    ALA 103           H        ALA 103  -7.352   5.998   8.119
  735    HA   ALA 103           HA       ALA 103  -4.510   6.733   8.292
  736   1HB   ALA 103          1HB       ALA 103  -5.353   7.298  10.436
  737   2HB   ALA 103          2HB       ALA 103  -4.514   5.757  10.616
  738   3HB   ALA 103          3HB       ALA 103  -6.275   5.799  10.545
  739    H    LEU 104           H        LEU 104  -3.173   5.153   7.686
  740    HA   LEU 104           HA       LEU 104  -4.162   2.698   6.696
  741   1HB   LEU 104          2HB       LEU 104  -1.845   4.152   6.404
  742   2HB   LEU 104          1HB       LEU 104  -1.300   2.767   7.322
  743    HG   LEU 104           HG       LEU 104  -1.441   2.896   4.597
  744   1HD1  LEU 104          1HD1      LEU 104  -0.520   1.164   6.440
  745   2HD1  LEU 104          2HD1      LEU 104  -0.509   0.873   4.699
  746   3HD1  LEU 104          3HD1      LEU 104  -1.803   0.207   5.695
  747   1HD2  LEU 104          1HD2      LEU 104  -3.802   1.252   5.472
  748   2HD2  LEU 104          2HD2      LEU 104  -3.190   1.451   3.831
  749   3HD2  LEU 104          3HD2      LEU 104  -3.912   2.821   4.676
  750    H    ASP 105           H        ASP 105  -3.839   0.588   7.429
  751    HA   ASP 105           HA       ASP 105  -3.641   0.369  10.344
  752   1HB   ASP 105          2HB       ASP 105  -5.218  -0.939   8.291
  753   2HB   ASP 105          1HB       ASP 105  -4.383  -2.118   9.299
  754    H    ALA 106           H        ALA 106  -2.251  -0.823   7.365
  755    HA   ALA 106           HA       ALA 106  -0.296  -1.862   6.877
  756   1HB   ALA 106          1HB       ALA 106   0.631  -0.157   8.433
  757   2HB   ALA 106          2HB       ALA 106   1.566  -1.651   8.332
  758   3HB   ALA 106          3HB       ALA 106   0.522  -1.357   9.722
  759    H    TRP 107           H        TRP 107  -0.349  -3.932   6.487
  760    HA   TRP 107           HA       TRP 107  -0.647  -5.806   8.736
  761   1HB   TRP 107          2HB       TRP 107  -1.735  -6.201   5.941
  762   2HB   TRP 107          1HB       TRP 107  -1.939  -7.290   7.309
  763    HD1  TRP 107           HD       TRP 107  -2.788  -5.088   9.478
  764    HE1  TRP 107           1HE      TRP 107  -5.123  -4.017   9.323
  765    HE3  TRP 107           3HE      TRP 107  -3.782  -6.053   4.571
  766    HZ2  TRP 107           2HZ      TRP 107  -7.128  -3.637   7.367
  767    HZ3  TRP 107           3HZ      TRP 107  -5.929  -5.307   3.627
  768    HH2  TRP 107           HH       TRP 107  -7.567  -4.124   4.998
  769    H    GLY 108           H        GLY 108  -0.419  -7.725   6.201
  770   1HA   GLY 108          2HA       GLY 108   1.254  -8.890   5.141
  771   2HA   GLY 108          1HA       GLY 108   2.267  -7.469   5.339
  772    H    GLN 109           H        GLN 109   3.601  -9.691   5.522
  773    HA   GLN 109           HA       GLN 109   3.727 -10.538   8.318
  774   1HB   GLN 109          2HB       GLN 109   4.706 -11.637   5.727
  775   2HB   GLN 109          1HB       GLN 109   5.623 -12.028   7.175
  776   1HG   GLN 109          2HG       GLN 109   3.349 -12.734   8.157
  777   2HG   GLN 109          1HG       GLN 109   2.805 -12.743   6.481
  778   1HE2  GLN 109          1HE2      GLN 109   3.540 -14.311   5.094
  779   2HE2  GLN 109          2HE2      GLN 109   4.427 -15.696   5.621
  780    H    GLY 110           H        GLY 110   5.265  -8.447   6.101
  781   1HA   GLY 110          2HA       GLY 110   6.785  -6.767   6.844
  782   2HA   GLY 110          1HA       GLY 110   7.331  -7.863   8.104
  783    H    THR 111           H        THR 111   7.934  -6.629   5.010
  784    HA   THR 111           HA       THR 111   9.726  -8.816   4.275
  785    HB   THR 111           HB       THR 111   8.293  -7.865   2.518
  786    HG1  THR 111           1HG      THR 111  10.678  -8.553   2.261
  787   1HG2  THR 111          1HG2      THR 111   9.941  -5.362   2.567
  788   2HG2  THR 111          2HG2      THR 111   8.481  -5.491   3.549
  789   3HG2  THR 111          3HG2      THR 111   8.382  -5.657   1.796
  790    H    GLN 112           H        GLN 112  11.891  -8.737   4.459
  791    HA   GLN 112           HA       GLN 112  13.058  -6.484   5.852
  792   1HB   GLN 112          2HB       GLN 112  13.740  -9.284   5.400
  793   2HB   GLN 112          1HB       GLN 112  15.129  -8.213   5.257
  794   1HG   GLN 112          2HG       GLN 112  13.286  -8.035   7.607
  795   2HG   GLN 112          1HG       GLN 112  14.573  -9.238   7.546
  796   1HE2  GLN 112          1HE2      GLN 112  14.060  -5.763   7.040
  797   2HE2  GLN 112          2HE2      GLN 112  15.544  -5.264   7.771
  798    H    VAL 113           H        VAL 113  13.471  -4.754   4.614
  799    HA   VAL 113           HA       VAL 113  14.947  -5.189   2.095
  800    HB   VAL 113           HB       VAL 113  13.152  -2.893   2.896
  801   1HG1  VAL 113          1HG1      VAL 113  13.582  -2.056   0.592
  802   2HG1  VAL 113          2HG1      VAL 113  14.853  -3.269   0.437
  803   3HG1  VAL 113          3HG1      VAL 113  14.993  -1.995   1.651
  804   1HG2  VAL 113          1HG2      VAL 113  12.688  -4.443   0.427
  805   2HG2  VAL 113          2HG2      VAL 113  11.537  -3.777   1.586
  806   3HG2  VAL 113          3HG2      VAL 113  12.378  -5.284   1.945
  807    H    THR 114           H        THR 114  17.065  -4.712   2.275
  808    HA   THR 114           HA       THR 114  17.795  -2.436   4.006
  809    HB   THR 114           HB       THR 114  19.624  -4.791   3.734
  810    HG1  THR 114           1HG      THR 114  18.626  -5.802   5.398
  811   1HG2  THR 114          1HG2      THR 114  19.757  -2.282   4.998
  812   2HG2  THR 114          2HG2      THR 114  20.904  -3.616   5.128
  813   3HG2  THR 114          3HG2      THR 114  19.579  -3.475   6.284
  814    H    VAL 115           H        VAL 115  19.477  -1.149   3.365
  815    HA   VAL 115           HA       VAL 115  20.581  -1.676   0.687
  816    HB   VAL 115           HB       VAL 115  19.133   0.150   0.374
  817   1HG1  VAL 115          1HG1      VAL 115  18.920   2.050   1.773
  818   2HG1  VAL 115          2HG1      VAL 115  20.319   1.576   2.736
  819   3HG1  VAL 115          3HG1      VAL 115  18.835   0.625   2.810
  820   1HG2  VAL 115          1HG2      VAL 115  21.354   0.473  -0.609
  821   2HG2  VAL 115          2HG2      VAL 115  21.868   1.326   0.846
  822   3HG2  VAL 115          3HG2      VAL 115  20.604   2.009  -0.176
  823    H    SER 116           H        SER 116  22.570  -2.368   1.071
  824    HA   SER 116           HA       SER 116  24.272  -0.784   2.879
  825   1HB   SER 116          2HB       SER 116  23.629  -3.341   3.340
  826   2HB   SER 116          1HB       SER 116  25.011  -3.603   2.276
  827    HG   SER 116           HG       SER 116  25.760  -1.754   3.961
  828    H    SER 117           H        SER 117  26.059  -3.167   1.370
  829    HA   SER 117           HA       SER 117  26.574  -1.795  -1.109
  830   1HB   SER 117          2HB       SER 117  29.139  -1.747  -0.255
  831   2HB   SER 117          1HB       SER 117  28.054  -0.362  -0.136
  832    HG   SER 117           HG       SER 117  29.204  -1.795   1.834
  833    H    GLN 118           H        GLN 118  25.873  -4.485  -0.030
  834    HA   GLN 118           HA       GLN 118  28.004  -5.981  -1.398
  835   1HB   GLN 118          2HB       GLN 118  27.262  -7.883   0.260
  836   2HB   GLN 118          1HB       GLN 118  28.448  -6.682   0.751
  837   1HG   GLN 118          2HG       GLN 118  26.865  -7.037   2.523
  838   2HG   GLN 118          1HG       GLN 118  26.672  -5.410   1.871
  839   1HE2  GLN 118          1HE2      GLN 118  24.795  -4.850   0.867
  840   2HE2  GLN 118          2HE2      GLN 118  23.395  -5.861   0.827
  841    H    SER 119           H        SER 119  26.804  -8.496  -1.258
  842    HA   SER 119           HA       SER 119  24.110  -8.291  -2.287
  843   1HB   SER 119          2HB       SER 119  26.381  -8.358  -4.068
  844   2HB   SER 119          1HB       SER 119  25.392  -9.802  -4.284
  845    HG   SER 119           HG       SER 119  24.920  -7.380  -5.198
  846    H    GLU 120           H        GLU 120  23.657 -10.674  -3.338
  847    HA   GLU 120           HA       GLU 120  24.887 -12.746  -1.709
  848   1HB   GLU 120          2HB       GLU 120  22.394 -11.549  -1.008
  849   2HB   GLU 120          1HB       GLU 120  22.076 -13.190  -1.555
  850   1HG   GLU 120          2HG       GLU 120  24.346 -13.134   0.208
  851   2HG   GLU 120          1HG       GLU 120  22.946 -12.374   0.964
  852    H    GLN 121           H        GLN 121  25.186 -12.439  -4.392
  853    HA   GLN 121           HA       GLN 121  24.082 -14.901  -5.381
  854   1HB   GLN 121          2HB       GLN 121  22.613 -12.584  -5.893
  855   2HB   GLN 121          1HB       GLN 121  23.513 -12.871  -7.376
  856   1HG   GLN 121          2HG       GLN 121  22.381 -14.765  -7.865
  857   2HG   GLN 121          1HG       GLN 121  22.159 -15.203  -6.172
  858   1HE2  GLN 121          1HE2      GLN 121  20.099 -15.277  -5.672
  859   2HE2  GLN 121          2HE2      GLN 121  18.874 -14.183  -6.210
  860    H    LYS 122           H        LYS 122  25.416 -11.883  -6.745
  861    HA   LYS 122           HA       LYS 122  27.388 -13.483  -8.202
  862   1HB   LYS 122          2HB       LYS 122  25.874 -11.174  -8.841
  863   2HB   LYS 122          1HB       LYS 122  27.565 -10.691  -8.807
  864   1HG   LYS 122          2HG       LYS 122  28.102 -12.492 -10.379
  865   2HG   LYS 122          1HG       LYS 122  26.398 -12.947 -10.427
  866   1HD   LYS 122          2HD       LYS 122  25.789 -11.054 -11.599
  867   2HD   LYS 122          1HD       LYS 122  27.188 -10.133 -11.042
  868   1HE   LYS 122          2HE       LYS 122  27.167 -10.890 -13.482
  869   2HE   LYS 122          1HE       LYS 122  28.630 -11.194 -12.547
  870   1HZ   LYS 122          1HZ       LYS 122  28.192 -13.443 -12.432
  871   2HZ   LYS 122          2HZ       LYS 122  27.657 -13.068 -13.992
  872   3HZ   LYS 122          3HZ       LYS 122  26.539 -13.261 -12.738
  873    H    LEU 123           H        LEU 123  29.574 -13.195  -8.004
  874    HA   LEU 123           HA       LEU 123  31.561 -12.723  -7.017
  875   1HB   LEU 123          2HB       LEU 123  30.444 -10.313  -7.503
  876   2HB   LEU 123          1HB       LEU 123  30.630 -10.219  -5.762
  877    HG   LEU 123           HG       LEU 123  32.992 -11.103  -7.334
  878   1HD1  LEU 123          1HD1      LEU 123  33.034  -9.314  -8.644
  879   2HD1  LEU 123          2HD1      LEU 123  33.212  -8.327  -7.192
  880   3HD1  LEU 123          3HD1      LEU 123  31.608  -8.634  -7.861
  881   1HD2  LEU 123          1HD2      LEU 123  32.366  -9.869  -4.741
  882   2HD2  LEU 123          2HD2      LEU 123  33.809  -9.246  -5.541
  883   3HD2  LEU 123          3HD2      LEU 123  33.668 -10.970  -5.194
  884    H    ILE 124           H        ILE 124  32.106 -13.972  -5.376
  885    HA   ILE 124           HA       ILE 124  30.535 -14.155  -2.981
  886    HB   ILE 124           HB       ILE 124  32.731 -15.505  -2.276
  887   1HG1  ILE 124          2HG1      ILE 124  32.741 -15.779  -5.284
  888   2HG1  ILE 124          1HG1      ILE 124  33.864 -14.734  -4.421
  889   1HG2  ILE 124          1HG2      ILE 124  30.273 -16.203  -2.812
  890   2HG2  ILE 124          2HG2      ILE 124  31.549 -17.419  -2.761
  891   3HG2  ILE 124          3HG2      ILE 124  30.979 -16.803  -4.313
  892   1HD1  ILE 124          1HD1      ILE 124  34.234 -17.041  -3.085
  893   2HD1  ILE 124          2HD1      ILE 124  35.176 -16.550  -4.495
  894   3HD1  ILE 124          3HD1      ILE 124  33.816 -17.658  -4.684
  895    H    SER 125           H        SER 125  31.572 -13.973  -0.798
  896    HA   SER 125           HA       SER 125  33.027 -11.439  -0.664
  897   1HB   SER 125          2HB       SER 125  31.550 -12.992   1.473
  898   2HB   SER 125          1HB       SER 125  32.360 -11.446   1.731
  899    HG   SER 125           HG       SER 125  30.530 -11.587  -0.361
  900    H    GLU 126           H        GLU 126  33.305 -14.816   0.225
  901    HA   GLU 126           HA       GLU 126  35.639 -14.490   1.840
  902   1HB   GLU 126          2HB       GLU 126  35.816 -17.041   1.389
  903   2HB   GLU 126          1HB       GLU 126  34.476 -16.435   2.349
  904   1HG   GLU 126          2HG       GLU 126  33.037 -16.511   0.360
  905   2HG   GLU 126          1HG       GLU 126  34.383 -17.175  -0.568
  906    H    GLU 127           H        GLU 127  36.950 -13.185   0.452
  907    HA   GLU 127           HA       GLU 127  38.707 -12.842  -0.946
  908   1HB   GLU 127          2HB       GLU 127  39.595 -14.887   0.128
  909   2HB   GLU 127          1HB       GLU 127  38.812 -15.858  -1.111
  910   1HG   GLU 127          2HG       GLU 127  40.305 -14.015  -2.539
  911   2HG   GLU 127          1HG       GLU 127  41.335 -14.452  -1.177
  912    H    ASP 128           H        ASP 128  38.428 -11.997  -2.886
  913    HA   ASP 128           HA       ASP 128  37.434 -13.667  -5.062
  914   1HB   ASP 128          2HB       ASP 128  35.966 -11.652  -5.760
  915   2HB   ASP 128          1HB       ASP 128  35.377 -12.715  -4.486
  916    H    LEU 129           H        LEU 129  38.865 -13.503  -6.636
  917    HA   LEU 129           HA       LEU 129  39.709 -10.964  -7.657
  918   1HB   LEU 129          2HB       LEU 129  42.136 -11.379  -7.362
  919   2HB   LEU 129          1HB       LEU 129  41.288 -11.065  -5.860
  920    HG   LEU 129           HG       LEU 129  41.208 -13.807  -6.008
  921   1HD1  LEU 129          1HD1      LEU 129  42.910 -14.661  -7.151
  922   2HD1  LEU 129          2HD1      LEU 129  44.047 -13.507  -6.455
  923   3HD1  LEU 129          3HD1      LEU 129  43.113 -13.071  -7.886
  924   1HD2  LEU 129          1HD2      LEU 129  43.158 -11.951  -4.659
  925   2HD2  LEU 129          2HD2      LEU 129  43.058 -13.678  -4.315
  926   3HD2  LEU 129          3HD2      LEU 129  41.674 -12.633  -3.995
  927    H    ASN 130           H        ASN 130  38.773 -13.979  -8.109
  928    HA   ASN 130           HA       ASN 130  40.438 -14.453 -10.485
  929   1HB   ASN 130          2HB       ASN 130  39.304 -16.199  -8.472
  930   2HB   ASN 130          1HB       ASN 130  38.790 -16.686 -10.084
  931   1HD2  ASN 130          1HD2      ASN 130  40.479 -16.997 -11.692
  932   2HD2  ASN 130          2HD2      ASN 130  42.018 -17.593 -11.180
  933    H    HIS 131           H        HIS 131  37.265 -13.656  -9.402
  934    HA   HIS 131           HA       HIS 131  35.950 -14.371 -11.869
  935   1HB   HIS 131          2HB       HIS 131  34.972 -12.728  -9.523
  936   2HB   HIS 131          1HB       HIS 131  33.974 -13.277 -10.867
  937    HD1  HIS 131           1HD      HIS 131  36.140 -15.993 -10.210
  938    HD2  HIS 131           2HD      HIS 131  32.771 -14.461  -8.323
  939    HE1  HIS 131           1HE      HIS 131  35.258 -17.866  -8.783
  940    HE2  HIS 131           2HE      HIS 131  33.269 -16.888  -7.586
  941    H    HIS 132           H        HIS 132  37.673 -11.682 -10.631
  942    HA   HIS 132           HA       HIS 132  36.572  -9.887 -12.672
  943   1HB   HIS 132          2HB       HIS 132  37.763  -9.520 -10.025
  944   2HB   HIS 132          1HB       HIS 132  38.425  -8.424 -11.235
  945    HD1  HIS 132           1HD      HIS 132  35.879  -8.496  -8.816
  946    HD2  HIS 132           2HD      HIS 132  36.042  -7.216 -12.766
  947    HE1  HIS 132           1HE      HIS 132  33.956  -6.899  -9.085
  948    HE2  HIS 132           2HE      HIS 132  34.029  -6.195 -11.503
  949    H    HIS 133           H        HIS 133  38.686  -8.204 -13.096
  950    HA   HIS 133           HA       HIS 133  40.719  -9.957 -14.311
  951   1HB   HIS 133          2HB       HIS 133  39.142  -7.715 -15.465
  952   2HB   HIS 133          1HB       HIS 133  40.829  -7.845 -15.953
  953    HD1  HIS 133           1HD      HIS 133  39.003 -11.004 -15.291
  954    HD2  HIS 133           2HD      HIS 133  39.955  -8.603 -18.545
  955    HE1  HIS 133           1HE      HIS 133  38.519 -12.404 -17.324
  956    HE2  HIS 133           2HE      HIS 133  39.022 -10.900 -19.281
  957    H    HIS 134           H        HIS 134  42.806  -9.459 -13.964
  958    HA   HIS 134           HA       HIS 134  43.522  -7.670 -11.920
  959   1HB   HIS 134          2HB       HIS 134  44.991  -9.348 -13.887
  960   2HB   HIS 134          1HB       HIS 134  45.890  -8.052 -13.109
  961    HD1  HIS 134           1HD      HIS 134  45.896 -11.362 -12.727
  962    HD2  HIS 134           2HD      HIS 134  44.738  -8.391 -10.062
  963    HE1  HIS 134           1HE      HIS 134  46.091 -12.395 -10.442
  964    HE2  HIS 134           2HE      HIS 134  45.304 -10.607  -8.852
  965    H    HIS 135           H        HIS 135  44.626  -7.481 -15.306
  966    HA   HIS 135           HA       HIS 135  43.829  -4.771 -15.632
  967   1HB   HIS 135          2HB       HIS 135  45.795  -4.538 -14.074
  968   2HB   HIS 135          1HB       HIS 135  46.806  -5.206 -15.351
  969    HD1  HIS 135           1HD      HIS 135  44.249  -2.381 -15.165
  970    HD2  HIS 135           2HD      HIS 135  48.023  -3.212 -16.692
  971    HE1  HIS 135           1HE      HIS 135  44.994  -0.266 -16.303
  972    HE2  HIS 135           2HE      HIS 135  47.244  -0.819 -17.293