*HEADER    APOPTOSIS, ISOMERASE                    08-OCT-13   2MF9              
*TITLE     SOLUTION STRUCTURE OF THE N-TERMINAL DOMAIN OF HUMAN FKBP38           
*TITLE    2 (FKBP38NTD)                                                          
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PEPTIDYL-PROLYL CIS-TRANS ISOMERASE FKBP8;                 
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: UNP RESIDUES 58-206;                                       
*COMPND   5 SYNONYM: PPIASE FKBP8, 38 KDA FK506-BINDING PROTEIN, 38 KDA FKBP,    
*COMPND   6 FKBP-38, HFKBP38, FK506-BINDING PROTEIN 8, FKBP-8, FKBPR38, ROTAMASE;
*COMPND   7 EC: 5.2.1.8;                                                         
*COMPND   8 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: FKBP8, FKBP38;                                                 
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR: PET29                                      
*KEYWDS    BETA BARREL, CENTRAL HELIX, FLEXIBLE N-TERMINAL EXTENSION, APOPTOSIS, 
*KEYWDS   2 ISOMERASE                                                            
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    C.KANG, H.YE, B.SIMON, M.SATTLER, H.S.YOON                            
*REVDAT   1   06-NOV-13 2MF9    0                                                


! distance constraints :
 ASSI {    1}
   (( segid "    " and resid 15   and name HA  ))
   (  segid "    " and resid 14   and name HB% )
      5.200     5.200     0.800 peak     1 spectrum    1 weight  0.11000E+01 volume  0.21643E-03 ppm1      4.322 ppm2      1.408 CV     1
 ASSI {    3}
   (( segid "    " and resid 90   and name HB2 ))
   (( segid "    " and resid 90   and name HA  ))
      3.300     1.400     1.400 peak     3 spectrum    1 weight  0.11000E+01 volume  0.59546E-03 ppm1      1.428 ppm2      4.357 CV     1
 ASSI {    6}
   (( segid "    " and resid 101  and name HB2 ))
   (( segid "    " and resid 101  and name HA  ))
      3.700     1.700     1.700 peak     6 spectrum    1 weight  0.11000E+01 volume  0.86142E-03 ppm1      1.171 ppm2      4.268 CV     1
 ASSI {    7}
   (( segid "    " and resid 101  and name HB1 ))
   (( segid "    " and resid 101  and name HG  ))
      4.000     2.000     2.000 peak     7 spectrum    1 weight  0.11000E+01 volume  0.68223E-03 ppm1      1.608 ppm2      1.818 CV     1
 ASSI {    9}
   (( segid "    " and resid 101  and name HB2 ))
   (( segid "    " and resid 101  and name HB1 ))
      2.400     0.700     0.700 peak     9 spectrum    1 weight  0.11000E+01 volume  0.16630E-02 ppm1      1.175 ppm2      1.606 CV     1
 ASSI {   15}
   (( segid "    " and resid 101  and name HB2 ))
   (  segid "    " and resid 101  and name HD2%)
      4.800     2.800     1.200 peak    15 spectrum    1 weight  0.11000E+01 volume  0.54100E-03 ppm1      1.173 ppm2      0.519 CV     1
 ASSI {   16}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 101  and name HA  ))
      5.300     3.500     0.700 peak    16 spectrum    1 weight  0.11000E+01 volume  0.45135E-03 ppm1      0.681 ppm2      4.272 CV     1
 ASSI {   17}
   (  segid "    " and resid 101  and name HD1%)
   (  segid "    " and resid 101  and name HD2%)
      3.100     1.200     1.200 peak    17 spectrum    1 weight  0.11000E+01 volume  0.22230E-02 ppm1      0.675 ppm2      0.518 CV     1
 ASSI {   19}
   (  segid "    " and resid 101  and name HD2%)
   (( segid "    " and resid 101  and name HA  ))
      4.300     2.300     1.700 peak    19 spectrum    1 weight  0.11000E+01 volume  0.20799E-03 ppm1      0.516 ppm2      4.269 CV     1
 ASSI {   20}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 101  and name HG  ))
      2.900     1.000     1.000 peak    20 spectrum    1 weight  0.11000E+01 volume  0.25595E-02 ppm1      0.682 ppm2      1.813 CV     1
 ASSI {   21}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 101  and name HB1 ))
      3.200     1.300     1.300 peak    21 spectrum    1 weight  0.11000E+01 volume  0.19066E-02 ppm1      0.693 ppm2      1.607 CV     1
 ASSI {   22}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 101  and name HB2 ))
      2.800     1.000     1.000 peak    22 spectrum    1 weight  0.11000E+01 volume  0.29581E-02 ppm1      0.701 ppm2      1.139 CV     1
 ASSI {   26}
   (  segid "    " and resid 101  and name HD2%)
   (( segid "    " and resid 101  and name HB1 ))
      3.000     1.200     1.200 peak    26 spectrum    1 weight  0.11000E+01 volume  0.18740E-02 ppm1      0.523 ppm2      1.619 CV     1
 ASSI {   27}
   (( segid "    " and resid 90   and name HB2 ))
   (( segid "    " and resid 90   and name HB1 ))
      2.300     0.600     0.600 peak    27 spectrum    1 weight  0.11000E+01 volume  0.17586E-02 ppm1      1.433 ppm2      1.956 CV     1
 ASSI {   30}
   (( segid "    " and resid 90   and name HA  ))
   (( segid "    " and resid 91   and name HA1 ))
      3.200     1.300     1.300 peak    30 spectrum    1 weight  0.11000E+01 volume  0.63702E-02 ppm1      4.365 ppm2      4.274 CV     1
 ASSI {   34}
   (( segid "    " and resid 90   and name HG  ))
   (( segid "    " and resid 90   and name HB2 ))
      3.300     3.300     2.700 peak    34 spectrum    1 weight  0.11000E+01 volume  0.15935E-02 ppm1      1.537 ppm2      1.419 CV     1
 ASSI {   36}
   (( segid "    " and resid 90   and name HG  ))
   (( segid "    " and resid 90   and name HA  ))
      3.600     1.700     1.700 peak    36 spectrum    1 weight  0.11000E+01 volume  0.65348E-03 ppm1      1.583 ppm2      4.375 CV     1
 ASSI {   39}
   (  segid "    " and resid 90   and name HD1%)
   (( segid "    " and resid 90   and name HA  ))
      2.500     0.800     0.800 peak    39 spectrum    1 weight  0.11000E+01 volume  0.22671E-02 ppm1      1.058 ppm2      4.354 CV     1
 ASSI {   40}
   (  segid "    " and resid 90   and name HD2%)
   (( segid "    " and resid 90   and name HA  ))
      4.300     2.400     1.700 peak    40 spectrum    1 weight  0.11000E+01 volume  0.10222E-02 ppm1      0.749 ppm2      4.342 CV     1
 ASSI {   42}
   (  segid "    " and resid 90   and name HD2%)
   (( segid "    " and resid 90   and name HG  ))
      2.400     0.700     0.700 peak    42 spectrum    1 weight  0.11000E+01 volume  0.49335E-02 ppm1      0.761 ppm2      1.599 CV     1
 ASSI {   50}
   (( segid "    " and resid 90   and name HB2 ))
   (  segid "    " and resid 90   and name HD1%)
      3.100     1.200     1.200 peak    50 spectrum    1 weight  0.11000E+01 volume  0.94962E-03 ppm1      1.436 ppm2      1.054 CV     1
 ASSI {   53}
   (  segid "    " and resid 90   and name HD1%)
   (( segid "    " and resid 90   and name HG  ))
      2.500     0.800     0.800 peak    53 spectrum    1 weight  0.11000E+01 volume  0.28997E-02 ppm1      1.057 ppm2      1.597 CV     1
 ASSI {   55}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 101  and name HB1 ))
      3.000     1.100     1.100 peak    55 spectrum    1 weight  0.11000E+01 volume  0.11234E-02 ppm1      4.294 ppm2      1.593 CV     1
 ASSI {   58}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 101  and name HG  ))
      3.900     1.900     1.900 peak    58 spectrum    1 weight  0.11000E+01 volume  0.52895E-03 ppm1      4.265 ppm2      1.807 CV     1
 ASSI {   59}
   (( segid "    " and resid 101  and name HG  ))
   (( segid "    " and resid 101  and name HB2 ))
      3.500     1.500     1.500 peak    59 spectrum    1 weight  0.11000E+01 volume  0.53303E-03 ppm1      1.814 ppm2      1.178 CV     1
 ASSI {   65}
   (  segid "    " and resid 101  and name HD2%)
   (( segid "    " and resid 101  and name HG  ))
      3.500     1.500     1.500 peak    65 spectrum    1 weight  0.11000E+01 volume  0.71202E-03 ppm1      0.527 ppm2      1.809 CV     1
 ASSI {   69}
   (( segid "    " and resid 99   and name HB2 ))
   (  segid "    " and resid 99   and name HD1%)
      2.400     0.700     0.700 peak    69 spectrum    1 weight  0.11000E+01 volume  0.65299E-02 ppm1      1.330 ppm2      1.340 CV     1
 OR {   69}
   (( segid "    " and resid 99   and name HB2 ))
   (( segid "    " and resid 99   and name HG  ))
 ASSI {   70}
   (( segid "    " and resid 99   and name HB1 ))
   (( segid "    " and resid 99   and name HB2 ))
      2.200     0.600     0.600 peak    70 spectrum    1 weight  0.11000E+01 volume  0.30893E-02 ppm1      1.510 ppm2      1.344 CV     1
 OR {   70}
   (( segid "    " and resid 99   and name HB1 ))
   (  segid "    " and resid 99   and name HD1%)
 ASSI {   74}
   (( segid "    " and resid 99   and name HG  ))
   (  segid "    " and resid 99   and name HD1%)
      2.300     0.700     0.700 peak    74 spectrum    1 weight  0.11000E+01 volume  0.48562E-02 ppm1      1.372 ppm2      1.307 CV     1
 ASSI {   75}
   (( segid "    " and resid 99   and name HA  ))
   (  segid "    " and resid 99   and name HD1%)
      3.100     1.200     1.200 peak    75 spectrum    1 weight  0.11000E+01 volume  0.10792E-02 ppm1      4.193 ppm2      1.331 CV     1
 OR {   75}
   (( segid "    " and resid 99   and name HA  ))
   (( segid "    " and resid 99   and name HB2 ))
 ASSI {   79}
   (  segid "    " and resid 99   and name HD2%)
   (( segid "    " and resid 99   and name HA  ))
      3.600     1.700     1.700 peak    79 spectrum    1 weight  0.11000E+01 volume  0.28766E-02 ppm1      0.739 ppm2      4.193 CV     1
 ASSI {   82}
   (( segid "    " and resid 99   and name HG  ))
   (( segid "    " and resid 99   and name HB2 ))
      2.200     2.200     3.800 peak    82 spectrum    1 weight  0.11000E+01 volume  0.17651E-01 ppm1      1.377 ppm2      1.373 CV     1
 ASSI {   89}
   (  segid "    " and resid 99   and name HD1%)
   (( segid "    " and resid 99   and name HB1 ))
      3.800     1.800     1.800 peak    89 spectrum    1 weight  0.11000E+01 volume  0.14044E-02 ppm1      1.294 ppm2      1.523 CV     1
 ASSI {   90}
   (  segid "    " and resid 99   and name HD2%)
   (  segid "    " and resid 99   and name HD1%)
      2.600     0.900     0.900 peak    90 spectrum    1 weight  0.11000E+01 volume  0.36231E-02 ppm1      0.748 ppm2      1.315 CV     1
 ASSI {   91}
   (  segid "    " and resid 99   and name HD2%)
   (( segid "    " and resid 99   and name HG  ))
      2.400     0.700     0.700 peak    91 spectrum    1 weight  0.11000E+01 volume  0.46357E-02 ppm1      0.748 ppm2      1.377 CV     1
 OR {   91}
   (  segid "    " and resid 99   and name HD2%)
   (( segid "    " and resid 99   and name HB2 ))
 ASSI {   93}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 86   and name HA  ))
      4.100     2.100     1.900 peak    93 spectrum    1 weight  0.11000E+01 volume  0.38047E-03 ppm1      2.052 ppm2      4.606 CV     1
 ASSI {   94}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 86   and name HA  ))
      3.600     1.600     1.600 peak    94 spectrum    1 weight  0.11000E+01 volume  0.54912E-03 ppm1      1.291 ppm2      4.606 CV     1
 ASSI {   98}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 86   and name HB1 ))
      2.300     0.600     0.600 peak    98 spectrum    1 weight  0.11000E+01 volume  0.21450E-02 ppm1      1.298 ppm2      2.048 CV     1
 ASSI {   99}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 86   and name HA  ))
      4.300     2.300     1.700 peak    99 spectrum    1 weight  0.11000E+01 volume  0.17554E-02 ppm1      0.811 ppm2      4.603 CV     1
 ASSI {  100}
   (( segid "    " and resid 86   and name HB1 ))
   (  segid "    " and resid 86   and name HD2%)
      3.200     1.300     1.300 peak   100 spectrum    1 weight  0.11000E+01 volume  0.10032E-02 ppm1      2.035 ppm2      0.781 CV     1
 ASSI {  102}
   (( segid "    " and resid 86   and name HB2 ))
   (  segid "    " and resid 86   and name HD2%)
      3.400     1.500     1.500 peak   102 spectrum    1 weight  0.11000E+01 volume  0.15836E-02 ppm1      1.314 ppm2      0.775 CV     1
 ASSI {  106}
   (( segid "    " and resid 86   and name HG  ))
   (( segid "    " and resid 86   and name HB2 ))
      3.600     1.600     1.600 peak   106 spectrum    1 weight  0.11000E+01 volume  0.10819E-02 ppm1      1.614 ppm2      1.308 CV     1
 ASSI {  109}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 86   and name HG  ))
      4.800     2.900     1.200 peak   109 spectrum    1 weight  0.11000E+01 volume  0.11326E-03 ppm1      4.590 ppm2      1.591 CV     1
 ASSI {  111}
   (( segid "    " and resid 86   and name HA  ))
   (  segid "    " and resid 86   and name HD1%)
      4.300     2.300     1.700 peak   111 spectrum    1 weight  0.11000E+01 volume  0.25886E-03 ppm1      4.598 ppm2      0.946 CV     1
 ASSI {  115}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 86   and name HG  ))
      3.000     1.100     1.100 peak   115 spectrum    1 weight  0.11000E+01 volume  0.14630E-02 ppm1      2.040 ppm2      1.597 CV     1
 ASSI {  119}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 86   and name HB2 ))
      2.900     1.100     1.100 peak   119 spectrum    1 weight  0.11000E+01 volume  0.21840E-02 ppm1      0.952 ppm2      1.289 CV     1
 ASSI {  121}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 86   and name HB1 ))
      3.900     1.900     1.900 peak   121 spectrum    1 weight  0.11000E+01 volume  0.18240E-02 ppm1      0.952 ppm2      2.059 CV     1
 ASSI {  123}
   (  segid "    " and resid 86   and name HD2%)
   (  segid "    " and resid 86   and name HD1%)
      2.800     1.000     1.000 peak   123 spectrum    1 weight  0.11000E+01 volume  0.44257E-02 ppm1      0.810 ppm2      0.956 CV     1
 ASSI {  125}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 86   and name HG  ))
      2.700     0.900     0.900 peak   125 spectrum    1 weight  0.11000E+01 volume  0.43516E-02 ppm1      0.825 ppm2      1.603 CV     1
 ASSI {  128}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 74   and name HB2 ))
      4.600     2.700     1.400 peak   128 spectrum    1 weight  0.11000E+01 volume  0.14271E-03 ppm1      4.730 ppm2      1.908 CV     1
 ASSI {  129}
   (( segid "    " and resid 74   and name HB1 ))
   (( segid "    " and resid 74   and name HB2 ))
      2.100     0.500     0.500 peak   129 spectrum    1 weight  0.11000E+01 volume  0.27376E-02 ppm1      1.962 ppm2      1.922 CV     1
 ASSI {  130}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 74   and name HB1 ))
      4.100     2.200     1.900 peak   130 spectrum    1 weight  0.11000E+01 volume  0.14871E-03 ppm1      4.733 ppm2      1.991 CV     1
 ASSI {  132}
   (  segid "    " and resid 74   and name HD1%)
   (  segid "    " and resid 72   and name HG2%)
      2.200     2.200     3.800 peak   132 spectrum    1 weight  0.11000E+01 volume  0.65588E-01 ppm1      1.177 ppm2      1.177 CV     1
 OR {  132}
   (  segid "    " and resid 72   and name HG2%)
   (  segid "    " and resid 74   and name HD1%)
 ASSI {  133}
   (  segid "    " and resid 74   and name HD1%)
   (( segid "    " and resid 74   and name HB1 ))
      3.000     1.100     1.100 peak   133 spectrum    1 weight  0.11000E+01 volume  0.13710E-02 ppm1      1.179 ppm2      2.004 CV     1
 ASSI {  134}
   (  segid "    " and resid 74   and name HD1%)
   (( segid "    " and resid 74   and name HB2 ))
      4.000     2.000     2.000 peak   134 spectrum    1 weight  0.11000E+01 volume  0.85143E-03 ppm1      1.177 ppm2      1.897 CV     1
 ASSI {  135}
   (  segid "    " and resid 74   and name HD1%)
   (( segid "    " and resid 74   and name HA  ))
      5.500     3.800     0.500 peak   135 spectrum    1 weight  0.11000E+01 volume  0.19281E-03 ppm1      1.179 ppm2      4.763 CV     1
 ASSI {  138}
   (  segid "    " and resid 74   and name HD2%)
   (  segid "    " and resid 74   and name HD1%)
      3.100     1.200     1.200 peak   138 spectrum    1 weight  0.11000E+01 volume  0.17392E-02 ppm1      0.843 ppm2      1.175 CV     1
 ASSI {  140}
   (  segid "    " and resid 74   and name HD2%)
   (( segid "    " and resid 74   and name HB1 ))
      3.300     3.300     2.700 peak   140 spectrum    1 weight  0.11000E+01 volume  0.18274E-02 ppm1      0.841 ppm2      2.044 CV     1
 ASSI {  144}
   (( segid "    " and resid 74   and name HG  ))
   (  segid "    " and resid 74   and name HD2%)
      2.700     0.900     0.900 peak   144 spectrum    1 weight  0.11000E+01 volume  0.27309E-02 ppm1      1.751 ppm2      0.839 CV     1
 ASSI {  147}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 74   and name HG  ))
      6.000     6.000     0.000 peak   147 spectrum    1 weight  0.11000E+01 volume  0.22030E-04 ppm1      4.738 ppm2      1.748 CV     1
 ASSI {  148}
   (( segid "    " and resid 74   and name HB2 ))
   (  segid "    " and resid 80   and name HG1%)
      4.000     2.000     2.000 peak   148 spectrum    1 weight  0.11000E+01 volume  0.17343E-02 ppm1      1.950 ppm2      0.986 CV     1
 OR {  148}
   (( segid "    " and resid 74   and name HB1 ))
   (  segid "    " and resid 80   and name HG1%)
 ASSI {  151}
   (( segid "    " and resid 74   and name HG  ))
   (  segid "    " and resid 138  and name HD1%)
      4.100     4.100     1.900 peak   151 spectrum    1 weight  0.11000E+01 volume  0.22560E-02 ppm1      1.735 ppm2      0.984 CV     1
 ASSI {  152}
   (  segid "    " and resid 74   and name HD1%)
   (  segid "    " and resid 138  and name HD1%)
      4.100     4.100     1.900 peak   152 spectrum    1 weight  0.11000E+01 volume  0.16519E-02 ppm1      1.174 ppm2      0.985 CV     1
 ASSI {  153}
   (  segid "    " and resid 74   and name HD2%)
   (  segid "    " and resid 138  and name HD1%)
      2.700     2.700     3.300 peak   153 spectrum    1 weight  0.11000E+01 volume  0.40990E-02 ppm1      0.827 ppm2      0.984 CV     1
 ASSI {  156}
   (( segid "    " and resid 70   and name HB1 ))
   (( segid "    " and resid 70   and name HA  ))
      3.800     1.800     1.800 peak   156 spectrum    1 weight  0.11000E+01 volume  0.71824E-03 ppm1      1.895 ppm2      5.381 CV     1
 ASSI {  157}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 70   and name HA  ))
      2.800     1.000     1.000 peak   157 spectrum    1 weight  0.11000E+01 volume  0.10067E-02 ppm1      1.234 ppm2      5.382 CV     1
 ASSI {  159}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 70   and name HB1 ))
      2.300     0.700     0.700 peak   159 spectrum    1 weight  0.11000E+01 volume  0.19555E-02 ppm1      1.233 ppm2      1.895 CV     1
 ASSI {  165}
   (( segid "    " and resid 70   and name HG  ))
   (( segid "    " and resid 70   and name HB1 ))
      3.200     1.300     1.300 peak   165 spectrum    1 weight  0.11000E+01 volume  0.20902E-02 ppm1      1.497 ppm2      1.918 CV     1
 ASSI {  166}
   (( segid "    " and resid 70   and name HG  ))
   (( segid "    " and resid 70   and name HA  ))
      3.900     1.900     1.900 peak   166 spectrum    1 weight  0.11000E+01 volume  0.50563E-03 ppm1      1.486 ppm2      5.381 CV     1
 ASSI {  167}
   (( segid "    " and resid 70   and name HG  ))
   (( segid "    " and resid 70   and name HB2 ))
      3.300     1.300     1.300 peak   167 spectrum    1 weight  0.11000E+01 volume  0.77545E-03 ppm1      1.486 ppm2      1.230 CV     1
 ASSI {  173}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 70   and name HG  ))
      2.500     0.800     0.800 peak   173 spectrum    1 weight  0.11000E+01 volume  0.54609E-02 ppm1      0.956 ppm2      1.491 CV     1
 ASSI {  176}
   (( segid "    " and resid 70   and name HB1 ))
   (  segid "    " and resid 70   and name HD1%)
      3.700     1.800     1.800 peak   176 spectrum    1 weight  0.11000E+01 volume  0.75043E-03 ppm1      1.897 ppm2      0.952 CV     1
 ASSI {  177}
   (( segid "    " and resid 70   and name HB2 ))
   (  segid "    " and resid 70   and name HD1%)
      3.100     1.200     1.200 peak   177 spectrum    1 weight  0.11000E+01 volume  0.11571E-02 ppm1      1.262 ppm2      0.957 CV     1
 ASSI {  179}
   (  segid "    " and resid 70   and name HD2%)
   (( segid "    " and resid 70   and name HG  ))
      2.700     0.900     0.900 peak   179 spectrum    1 weight  0.11000E+01 volume  0.38776E-02 ppm1      0.799 ppm2      1.488 CV     1
 ASSI {  181}
   (  segid "    " and resid 70   and name HD2%)
   (  segid "    " and resid 70   and name HD1%)
      2.300     2.300     3.700 peak   181 spectrum    1 weight  0.11000E+01 volume  0.12481E-01 ppm1      0.781 ppm2      0.944 CV     1
 ASSI {  182}
   (  segid "    " and resid 70   and name HD2%)
   (( segid "    " and resid 70   and name HB2 ))
      3.800     1.800     1.800 peak   182 spectrum    1 weight  0.11000E+01 volume  0.23044E-02 ppm1      0.788 ppm2      1.239 CV     1
 ASSI {  183}
   (  segid "    " and resid 70   and name HD2%)
   (( segid "    " and resid 70   and name HB1 ))
      2.800     1.000     1.000 peak   183 spectrum    1 weight  0.11000E+01 volume  0.27003E-02 ppm1      0.794 ppm2      1.897 CV     1
 ASSI {  193}
   (( segid "    " and resid 105  and name HB1 ))
   (( segid "    " and resid 105  and name HB2 ))
      2.300     0.700     0.700 peak   193 spectrum    1 weight  0.11000E+01 volume  0.20908E-02 ppm1      1.792 ppm2      1.703 CV     1
 ASSI {  198}
   (( segid "    " and resid 105  and name HG  ))
   (( segid "    " and resid 105  and name HB1 ))
      2.500     0.800     0.800 peak   198 spectrum    1 weight  0.11000E+01 volume  0.11554E-01 ppm1      1.611 ppm2      1.790 CV     1
 ASSI {  203}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 105  and name HG  ))
      3.600     3.600     2.400 peak   203 spectrum    1 weight  0.11000E+01 volume  0.42888E-03 ppm1      1.673 ppm2      1.627 CV     1
 ASSI {  207}
   (  segid "    " and resid 105  and name HD1%)
   (  segid "    " and resid 105  and name HD2%)
      2.500     2.500     3.500 peak   207 spectrum    1 weight  0.11000E+01 volume  0.76514E-02 ppm1      0.966 ppm2      0.848 CV     1
 ASSI {  209}
   (  segid "    " and resid 105  and name HD1%)
   (( segid "    " and resid 105  and name HG  ))
      2.500     0.800     0.800 peak   209 spectrum    1 weight  0.11000E+01 volume  0.51123E-02 ppm1      0.978 ppm2      1.625 CV     1
 ASSI {  220}
   (  segid "    " and resid 105  and name HD2%)
   (( segid "    " and resid 105  and name HB2 ))
      3.800     1.800     1.800 peak   220 spectrum    1 weight  0.11000E+01 volume  0.22192E-02 ppm1      0.875 ppm2      1.711 CV     1
 ASSI {  221}
   (  segid "    " and resid 105  and name HD2%)
   (( segid "    " and resid 105  and name HG  ))
      2.600     0.800     0.800 peak   221 spectrum    1 weight  0.11000E+01 volume  0.54434E-02 ppm1      0.875 ppm2      1.624 CV     1
 ASSI {  223}
   (( segid "    " and resid 150  and name HA  ))
   (( segid "    " and resid 150  and name HB1 ))
      3.100     1.200     1.200 peak   223 spectrum    1 weight  0.11000E+01 volume  0.27491E-02 ppm1      4.173 ppm2      1.596 CV     1
 OR {  223}
   (( segid "    " and resid 150  and name HA  ))
   (( segid "    " and resid 150  and name HB2 ))
 OR {  223}
   (( segid "    " and resid 150  and name HA  ))
   (( segid "    " and resid 150  and name HG  ))
 ASSI {  224}
   (( segid "    " and resid 150  and name HA  ))
   (  segid "    " and resid 150  and name HD1%)
      3.200     1.300     1.300 peak   224 spectrum    1 weight  0.11000E+01 volume  0.31611E-02 ppm1      4.172 ppm2      0.863 CV     1
 OR {  224}
   (( segid "    " and resid 150  and name HA  ))
   (  segid "    " and resid 150  and name HD2%)
 ASSI {  227}
   (( segid "    " and resid 150  and name HB2 ))
   (( segid "    " and resid 150  and name HB1 ))
      1.200     0.200     1.000 peak   227 spectrum    1 weight  0.11000E+01 volume  0.18833E+00 ppm1      1.594 ppm2      1.594 CV     1
 OR {  227}
   (( segid "    " and resid 150  and name HB1 ))
   (( segid "    " and resid 150  and name HB2 ))
 OR {  227}
   (( segid "    " and resid 150  and name HB1 ))
   (( segid "    " and resid 150  and name HG  ))
 ASSI {  228}
   (( segid "    " and resid 150  and name HG  ))
   (( segid "    " and resid 150  and name HA  ))
      4.000     2.000     2.000 peak   228 spectrum    1 weight  0.11000E+01 volume  0.61963E-03 ppm1      1.540 ppm2      4.169 CV     1
 ASSI {  230}
   (  segid "    " and resid 150  and name HD1%)
   (( segid "    " and resid 150  and name HA  ))
      3.100     1.200     1.200 peak   230 spectrum    1 weight  0.11000E+01 volume  0.37354E-02 ppm1      0.866 ppm2      4.171 CV     1
 ASSI {  231}
   (  segid "    " and resid 150  and name HD2%)
   (( segid "    " and resid 150  and name HA  ))
      4.000     2.000     2.000 peak   231 spectrum    1 weight  0.11000E+01 volume  0.94493E-03 ppm1      0.856 ppm2      4.173 CV     1
 ASSI {  232}
   (  segid "    " and resid 150  and name HD1%)
   (  segid "    " and resid 150  and name HD2%)
      1.500     1.500     4.500 peak   232 spectrum    1 weight  0.11000E+01 volume  0.30731E+00 ppm1      0.861 ppm2      0.871 CV     1
 ASSI {  234}
   (( segid "    " and resid 150  and name HB2 ))
   (  segid "    " and resid 150  and name HD2%)
      2.700     0.900     0.900 peak   234 spectrum    1 weight  0.11000E+01 volume  0.80826E-02 ppm1      1.594 ppm2      0.862 CV     1
 OR {  234}
   (( segid "    " and resid 150  and name HB1 ))
   (  segid "    " and resid 150  and name HD1%)
 OR {  234}
   (( segid "    " and resid 150  and name HB1 ))
   (  segid "    " and resid 150  and name HD2%)
 OR {  234}
   (( segid "    " and resid 150  and name HB2 ))
   (  segid "    " and resid 150  and name HD1%)
 ASSI {  235}
   (  segid "    " and resid 150  and name HD1%)
   (( segid "    " and resid 150  and name HG  ))
      2.500     0.800     0.800 peak   235 spectrum    1 weight  0.11000E+01 volume  0.87155E-02 ppm1      0.868 ppm2      1.589 CV     1
 OR {  235}
   (  segid "    " and resid 150  and name HD1%)
   (( segid "    " and resid 150  and name HB1 ))
 OR {  235}
   (  segid "    " and resid 150  and name HD1%)
   (( segid "    " and resid 150  and name HB2 ))
 ASSI {  236}
   (  segid "    " and resid 150  and name HD2%)
   (( segid "    " and resid 150  and name HG  ))
      2.800     1.000     1.000 peak   236 spectrum    1 weight  0.11000E+01 volume  0.44760E-02 ppm1      0.838 ppm2      1.585 CV     1
 OR {  236}
   (  segid "    " and resid 150  and name HD2%)
   (( segid "    " and resid 150  and name HB2 ))
 OR {  236}
   (  segid "    " and resid 150  and name HD2%)
   (( segid "    " and resid 150  and name HB1 ))
 ASSI {  240}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 45   and name HG  ))
      3.100     1.200     1.200 peak   240 spectrum    1 weight  0.11000E+01 volume  0.82911E-03 ppm1      1.707 ppm2      1.277 CV     1
 ASSI {  241}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 45   and name HG  ))
      3.700     1.800     1.800 peak   241 spectrum    1 weight  0.11000E+01 volume  0.60426E-03 ppm1      0.855 ppm2      1.277 CV     1
 ASSI {  242}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 45   and name HB1 ))
      2.200     0.600     0.600 peak   242 spectrum    1 weight  0.11000E+01 volume  0.26405E-02 ppm1      0.841 ppm2      1.705 CV     1
 ASSI {  243}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 44   and name HB2 ))
      2.700     2.700     3.300 peak   243 spectrum    1 weight  0.11000E+01 volume  0.94756E-02 ppm1      1.723 ppm2      1.722 CV     1
 OR {  243}
   (( segid "    " and resid 44   and name HB2 ))
   (( segid "    " and resid 45   and name HB1 ))
 ASSI {  244}
   (( segid "    " and resid 45   and name HB2 ))
   (  segid "    " and resid 45   and name HD1%)
      2.700     2.700     3.300 peak   244 spectrum    1 weight  0.11000E+01 volume  0.32501E-02 ppm1      0.842 ppm2      0.833 CV     1
 ASSI {  245}
   (( segid "    " and resid 44   and name HB2 ))
   (  segid "    " and resid 44   and name HD2%)
      2.600     2.600     3.400 peak   245 spectrum    1 weight  0.11000E+01 volume  0.36854E-02 ppm1      1.700 ppm2      0.835 CV     1
 ASSI {  247}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 45   and name HB2 ))
      2.900     1.000     1.000 peak   247 spectrum    1 weight  0.11000E+01 volume  0.10690E-02 ppm1      5.238 ppm2      0.870 CV     1
 ASSI {  248}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 45   and name HG  ))
      4.500     2.500     1.500 peak   248 spectrum    1 weight  0.11000E+01 volume  0.27776E-03 ppm1      5.224 ppm2      1.281 CV     1
 ASSI {  252}
   (( segid "    " and resid 45   and name HG  ))
   (  segid "    " and resid 45   and name HD1%)
      2.700     0.900     0.900 peak   252 spectrum    1 weight  0.11000E+01 volume  0.26872E-02 ppm1      1.287 ppm2      0.795 CV     1
 OR {  252}
   (( segid "    " and resid 45   and name HG  ))
   (( segid "    " and resid 45   and name HB2 ))
 ASSI {  257}
   (  segid "    " and resid 90   and name HD1%)
   (  segid "    " and resid 90   and name HD2%)
      2.400     0.700     0.700 peak   257 spectrum    1 weight  0.11000E+01 volume  0.76438E-02 ppm1      1.058 ppm2      0.754 CV     1
 ASSI {  258}
   (( segid "    " and resid 45   and name HB2 ))
   (  segid "    " and resid 116  and name HB% )
      3.700     3.700     2.300 peak   258 spectrum    1 weight  0.11000E+01 volume  0.40110E-03 ppm1      0.870 ppm2      1.133 CV     1
 ASSI {  263}
   (  segid "    " and resid 45   and name HD1%)
   (  segid "    " and resid 45   and name HD2%)
      2.600     0.900     0.900 peak   263 spectrum    1 weight  0.11000E+01 volume  0.49507E-02 ppm1      0.795 ppm2      0.519 CV     1
 ASSI {  270}
   (( segid "    " and resid 45   and name HB2 ))
   (  segid "    " and resid 45   and name HD2%)
      3.300     1.300     1.300 peak   270 spectrum    1 weight  0.11000E+01 volume  0.10332E-02 ppm1      0.843 ppm2      0.518 CV     1
 ASSI {  275}
   (( segid "    " and resid 44   and name HB1 ))
   (( segid "    " and resid 44   and name HB2 ))
      2.100     2.100     3.900 peak   275 spectrum    1 weight  0.11000E+01 volume  0.45964E-02 ppm1      1.931 ppm2      1.730 CV     1
 ASSI {  277}
   (( segid "    " and resid 44   and name HB1 ))
   (( segid "    " and resid 44   and name HA  ))
      3.900     1.900     1.900 peak   277 spectrum    1 weight  0.11000E+01 volume  0.38420E-03 ppm1      1.961 ppm2      4.380 CV     1
 ASSI {  278}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 44   and name HB2 ))
      4.100     2.100     1.900 peak   278 spectrum    1 weight  0.11000E+01 volume  0.44020E-03 ppm1      4.389 ppm2      1.699 CV     1
 ASSI {  284}
   (( segid "    " and resid 44   and name HB2 ))
   (( segid "    " and resid 44   and name HG  ))
      3.100     3.100     2.900 peak   284 spectrum    1 weight  0.11000E+01 volume  0.10791E-02 ppm1      1.729 ppm2      1.593 CV     1
 ASSI {  286}
   (( segid "    " and resid 44   and name HB1 ))
   (  segid "    " and resid 44   and name HD2%)
      4.100     2.100     1.900 peak   286 spectrum    1 weight  0.11000E+01 volume  0.99020E-03 ppm1      1.958 ppm2      0.831 CV     1
 ASSI {  287}
   (  segid "    " and resid 44   and name HD2%)
   (( segid "    " and resid 44   and name HA  ))
      3.400     1.400     1.400 peak   287 spectrum    1 weight  0.11000E+01 volume  0.41007E-02 ppm1      0.832 ppm2      4.383 CV     1
 ASSI {  289}
   (  segid "    " and resid 44   and name HD1%)
   (( segid "    " and resid 117  and name HB1 ))
      6.000     6.000     0.000 peak   289 spectrum    1 weight  0.11000E+01 volume  0.33525E-03 ppm1      0.960 ppm2      2.479 CV     1
 ASSI {  290}
   (  segid "    " and resid 70   and name HD1%)
   (  segid "    " and resid 140  and name HD1%)
      1.200     1.200     4.800 peak   290 spectrum    1 weight  0.11000E+01 volume  0.35952E+00 ppm1      0.937 ppm2      0.941 CV     1
 OR {  290}
   (  segid "    " and resid 140  and name HD1%)
   (  segid "    " and resid 70   and name HD1%)
 ASSI {  292}
   (( segid "    " and resid 44   and name HB1 ))
   (  segid "    " and resid 44   and name HD1%)
      2.900     1.100     1.100 peak   292 spectrum    1 weight  0.11000E+01 volume  0.20148E-02 ppm1      1.931 ppm2      0.965 CV     1
 ASSI {  293}
   (( segid "    " and resid 44   and name HB2 ))
   (  segid "    " and resid 44   and name HD1%)
      3.800     3.800     2.200 peak   293 spectrum    1 weight  0.11000E+01 volume  0.16910E-02 ppm1      1.733 ppm2      0.977 CV     1
 ASSI {  294}
   (( segid "    " and resid 44   and name HG  ))
   (  segid "    " and resid 44   and name HD1%)
      2.600     0.900     0.900 peak   294 spectrum    1 weight  0.11000E+01 volume  0.34222E-02 ppm1      1.618 ppm2      0.940 CV     1
 ASSI {  296}
   (( segid "    " and resid 59   and name HG2 ))
   (( segid "    " and resid 59   and name HB1 ))
      3.000     1.100     1.100 peak   296 spectrum    1 weight  0.11000E+01 volume  0.20668E-02 ppm1      1.583 ppm2      1.934 CV     1
 ASSI {  299}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 117  and name HB2 ))
      6.000     6.000     0.000 peak   299 spectrum    1 weight  0.11000E+01 volume  0.12730E-03 ppm1      4.426 ppm2      2.469 CV     1
 ASSI {  306}
   (  segid "    " and resid 44   and name HD2%)
   (( segid "    " and resid 44   and name HG  ))
      2.300     0.700     0.700 peak   306 spectrum    1 weight  0.11000E+01 volume  0.57499E-02 ppm1      0.834 ppm2      1.589 CV     1
 ASSI {  313}
   (( segid "    " and resid 37   and name HB1 ))
   (( segid "    " and resid 37   and name HB2 ))
      2.200     0.600     0.600 peak   313 spectrum    1 weight  0.11000E+01 volume  0.46272E-02 ppm1      1.930 ppm2      1.731 CV     1
 ASSI {  319}
   (( segid "    " and resid 37   and name HG  ))
   (( segid "    " and resid 37   and name HB1 ))
      2.900     1.100     1.100 peak   319 spectrum    1 weight  0.11000E+01 volume  0.21181E-02 ppm1      1.489 ppm2      1.916 CV     1
 ASSI {  320}
   (( segid "    " and resid 37   and name HG  ))
   (( segid "    " and resid 37   and name HA  ))
      4.000     2.000     2.000 peak   320 spectrum    1 weight  0.11000E+01 volume  0.49139E-03 ppm1      1.489 ppm2      4.577 CV     1
 ASSI {  321}
   (( segid "    " and resid 37   and name HG  ))
   (( segid "    " and resid 37   and name HB2 ))
      3.600     1.600     1.600 peak   321 spectrum    1 weight  0.11000E+01 volume  0.15300E-02 ppm1      1.485 ppm2      1.729 CV     1
 ASSI {  323}
   (  segid "    " and resid 37   and name HD1%)
   (  segid "    " and resid 37   and name HD2%)
      1.600     1.600     4.400 peak   323 spectrum    1 weight  0.11000E+01 volume  0.17374E+00 ppm1      1.008 ppm2      1.006 CV     1
 ASSI {  324}
   (( segid "    " and resid 37   and name HB2 ))
   (  segid "    " and resid 37   and name HD1%)
      3.300     1.300     1.300 peak   324 spectrum    1 weight  0.11000E+01 volume  0.17373E-02 ppm1      1.733 ppm2      0.979 CV     1
 OR {  324}
   (( segid "    " and resid 37   and name HB2 ))
   (  segid "    " and resid 37   and name HD2%)
 ASSI {  325}
   (( segid "    " and resid 37   and name HB1 ))
   (  segid "    " and resid 37   and name HD2%)
      3.400     1.400     1.400 peak   325 spectrum    1 weight  0.11000E+01 volume  0.17953E-02 ppm1      1.930 ppm2      0.968 CV     1
 OR {  325}
   (( segid "    " and resid 37   and name HB1 ))
   (  segid "    " and resid 37   and name HD1%)
 ASSI {  326}
   (( segid "    " and resid 37   and name HG  ))
   (  segid "    " and resid 37   and name HD1%)
      2.700     0.900     0.900 peak   326 spectrum    1 weight  0.11000E+01 volume  0.42971E-02 ppm1      1.495 ppm2      0.969 CV     1
 OR {  326}
   (( segid "    " and resid 37   and name HG  ))
   (  segid "    " and resid 37   and name HD2%)
 ASSI {  328}
   (( segid "    " and resid 37   and name HA  ))
   (  segid "    " and resid 37   and name HD2%)
      6.000     6.000     0.000 peak   328 spectrum    1 weight  0.11000E+01 volume  0.13573E-03 ppm1      4.590 ppm2      0.863 CV     1
 ASSI {  330}
   (  segid "    " and resid 37   and name HD1%)
   (( segid "    " and resid 37   and name HA  ))
      3.100     1.200     1.200 peak   330 spectrum    1 weight  0.11000E+01 volume  0.17739E-02 ppm1      0.996 ppm2      4.586 CV     1
 ASSI {  335}
   (  segid "    " and resid 37   and name HD1%)
   (( segid "    " and resid 37   and name HB2 ))
      2.800     1.000     1.000 peak   335 spectrum    1 weight  0.11000E+01 volume  0.35689E-02 ppm1      1.009 ppm2      1.720 CV     1
 ASSI {  336}
   (  segid "    " and resid 37   and name HD1%)
   (( segid "    " and resid 37   and name HB1 ))
      4.100     2.100     1.900 peak   336 spectrum    1 weight  0.11000E+01 volume  0.18382E-02 ppm1      0.987 ppm2      1.925 CV     1
 ASSI {  337}
   (  segid "    " and resid 37   and name HD2%)
   (( segid "    " and resid 37   and name HB1 ))
      3.100     3.100     2.900 peak   337 spectrum    1 weight  0.11000E+01 volume  0.22016E-02 ppm1      0.984 ppm2      1.892 CV     1
 ASSI {  348}
   (  segid "    " and resid 40   and name HD2%)
   (( segid "    " and resid 40   and name HA  ))
      4.100     2.100     1.900 peak   348 spectrum    1 weight  0.11000E+01 volume  0.36533E-03 ppm1      0.587 ppm2      4.604 CV     1
 ASSI {  351}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 40   and name HG  ))
      2.900     1.100     1.100 peak   351 spectrum    1 weight  0.11000E+01 volume  0.25219E-02 ppm1      0.810 ppm2      1.370 CV     1
 ASSI {  352}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 40   and name HB1 ))
      2.700     0.900     0.900 peak   352 spectrum    1 weight  0.11000E+01 volume  0.37273E-02 ppm1      0.810 ppm2      1.813 CV     1
 ASSI {  353}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 40   and name HA  ))
      3.900     1.900     1.900 peak   353 spectrum    1 weight  0.11000E+01 volume  0.14436E-02 ppm1      0.810 ppm2      4.602 CV     1
 ASSI {  354}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 40   and name HB2 ))
      2.800     1.000     1.000 peak   354 spectrum    1 weight  0.11000E+01 volume  0.55748E-02 ppm1      0.826 ppm2      1.597 CV     1
 ASSI {  369}
   (  segid "    " and resid 40   and name HD1%)
   (  segid "    " and resid 40   and name HD2%)
      2.700     0.900     0.900 peak   369 spectrum    1 weight  0.11000E+01 volume  0.56029E-02 ppm1      0.822 ppm2      0.593 CV     1
 ASSI {  373}
   (( segid "    " and resid 50   and name HB1 ))
   (( segid "    " and resid 50   and name HG  ))
      1.700     1.700     4.300 peak   373 spectrum    1 weight  0.11000E+01 volume  0.80850E-01 ppm1      1.536 ppm2      1.581 CV     1
 ASSI {  374}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 50   and name HB1 ))
      2.000     0.500     0.500 peak   374 spectrum    1 weight  0.11000E+01 volume  0.57585E-02 ppm1      1.462 ppm2      1.568 CV     1
 ASSI {  376}
   (( segid "    " and resid 50   and name HB1 ))
   (( segid "    " and resid 50   and name HA  ))
      3.500     1.600     1.600 peak   376 spectrum    1 weight  0.11000E+01 volume  0.63218E-03 ppm1      1.543 ppm2      4.452 CV     1
 ASSI {  377}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 50   and name HA  ))
      4.300     2.300     1.700 peak   377 spectrum    1 weight  0.11000E+01 volume  0.57829E-03 ppm1      1.459 ppm2      4.454 CV     1
 ASSI {  381}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 50   and name HB1 ))
      3.800     1.900     1.900 peak   381 spectrum    1 weight  0.11000E+01 volume  0.43666E-03 ppm1      4.472 ppm2      1.574 CV     1
 OR {  381}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 50   and name HG  ))
 ASSI {  382}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 50   and name HA  ))
      5.400     3.700     0.600 peak   382 spectrum    1 weight  0.11000E+01 volume  0.51396E-03 ppm1      0.835 ppm2      4.455 CV     1
 ASSI {  383}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 50   and name HG  ))
      2.400     0.700     0.700 peak   383 spectrum    1 weight  0.11000E+01 volume  0.67313E-02 ppm1      0.846 ppm2      1.572 CV     1
 OR {  383}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 50   and name HB1 ))
 ASSI {  384}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 50   and name HB2 ))
      2.800     1.000     1.000 peak   384 spectrum    1 weight  0.11000E+01 volume  0.24301E-02 ppm1      0.834 ppm2      1.472 CV     1
 ASSI {  386}
   (  segid "    " and resid 50   and name HD2%)
   (  segid "    " and resid 50   and name HD1%)
      2.300     0.700     0.700 peak   386 spectrum    1 weight  0.11000E+01 volume  0.11183E-01 ppm1      0.745 ppm2      0.843 CV     1
 ASSI {  388}
   (( segid "    " and resid 50   and name HG  ))
   (( segid "    " and resid 50   and name HA  ))
      3.800     1.800     1.800 peak   388 spectrum    1 weight  0.11000E+01 volume  0.84435E-03 ppm1      1.611 ppm2      4.449 CV     1
 ASSI {  389}
   (( segid "    " and resid 50   and name HG  ))
   (  segid "    " and resid 50   and name HD2%)
      2.500     0.800     0.800 peak   389 spectrum    1 weight  0.11000E+01 volume  0.34854E-02 ppm1      1.611 ppm2      0.756 CV     1
 ASSI {  390}
   (( segid "    " and resid 50   and name HG  ))
   (  segid "    " and resid 50   and name HD1%)
      2.500     0.800     0.800 peak   390 spectrum    1 weight  0.11000E+01 volume  0.32499E-02 ppm1      1.611 ppm2      0.829 CV     1
 ASSI {  391}
   (( segid "    " and resid 50   and name HA  ))
   (  segid "    " and resid 50   and name HD2%)
      3.800     1.800     1.800 peak   391 spectrum    1 weight  0.11000E+01 volume  0.79609E-03 ppm1      4.455 ppm2      0.751 CV     1
 ASSI {  398}
   (  segid "    " and resid 50   and name HD2%)
   (( segid "    " and resid 50   and name HB2 ))
      4.200     2.200     1.800 peak   398 spectrum    1 weight  0.11000E+01 volume  0.12153E-02 ppm1      0.750 ppm2      1.467 CV     1
 ASSI {  399}
   (  segid "    " and resid 50   and name HD2%)
   (( segid "    " and resid 50   and name HG  ))
      2.400     0.700     0.700 peak   399 spectrum    1 weight  0.11000E+01 volume  0.55833E-02 ppm1      0.752 ppm2      1.574 CV     1
 OR {  399}
   (  segid "    " and resid 50   and name HD2%)
   (( segid "    " and resid 50   and name HB1 ))
 ASSI {  401}
   (( segid "    " and resid 138  and name HB2 ))
   (( segid "    " and resid 138  and name HA  ))
      3.400     1.500     1.500 peak   401 spectrum    1 weight  0.11000E+01 volume  0.78699E-03 ppm1      1.414 ppm2      5.249 CV     1
 ASSI {  402}
   (( segid "    " and resid 138  and name HB2 ))
   (( segid "    " and resid 138  and name HB1 ))
      2.500     0.800     0.800 peak   402 spectrum    1 weight  0.11000E+01 volume  0.17344E-02 ppm1      1.417 ppm2      1.894 CV     1
 OR {  402}
   (( segid "    " and resid 138  and name HB2 ))
   (( segid "    " and resid 138  and name HG  ))
 ASSI {  404}
   (( segid "    " and resid 138  and name HA  ))
   (( segid "    " and resid 138  and name HB1 ))
      3.400     1.400     1.400 peak   404 spectrum    1 weight  0.11000E+01 volume  0.10418E-02 ppm1      5.264 ppm2      1.899 CV     1
 OR {  404}
   (( segid "    " and resid 138  and name HA  ))
   (( segid "    " and resid 138  and name HG  ))
 ASSI {  408}
   (( segid "    " and resid 138  and name HB1 ))
   (( segid "    " and resid 138  and name HB2 ))
      2.500     0.800     0.800 peak   408 spectrum    1 weight  0.11000E+01 volume  0.15120E-02 ppm1      1.878 ppm2      1.404 CV     1
 ASSI {  410}
   (( segid "    " and resid 138  and name HB1 ))
   (  segid "    " and resid 138  and name HD2%)
      4.000     2.000     2.000 peak   410 spectrum    1 weight  0.11000E+01 volume  0.48054E-03 ppm1      1.900 ppm2      0.877 CV     1
 ASSI {  411}
   (( segid "    " and resid 138  and name HB2 ))
   (  segid "    " and resid 138  and name HD2%)
      3.500     1.600     1.600 peak   411 spectrum    1 weight  0.11000E+01 volume  0.70487E-03 ppm1      1.436 ppm2      0.884 CV     1
 ASSI {  413}
   (  segid "    " and resid 138  and name HD2%)
   (( segid "    " and resid 138  and name HG  ))
      2.800     1.000     1.000 peak   413 spectrum    1 weight  0.11000E+01 volume  0.28597E-02 ppm1      0.846 ppm2      1.912 CV     1
 OR {  413}
   (  segid "    " and resid 138  and name HD2%)
   (( segid "    " and resid 138  and name HB1 ))
 ASSI {  414}
   (( segid "    " and resid 138  and name HB1 ))
   (  segid "    " and resid 138  and name HD1%)
      5.300     3.500     0.700 peak   414 spectrum    1 weight  0.11000E+01 volume  0.17109E-03 ppm1      1.916 ppm2      1.095 CV     1
 ASSI {  415}
   (( segid "    " and resid 138  and name HG  ))
   (( segid "    " and resid 138  and name HA  ))
      3.900     2.000     2.000 peak   415 spectrum    1 weight  0.11000E+01 volume  0.42157E-03 ppm1      1.914 ppm2      5.248 CV     1
 ASSI {  417}
   (( segid "    " and resid 138  and name HG  ))
   (  segid "    " and resid 138  and name HD2%)
      3.000     1.100     1.100 peak   417 spectrum    1 weight  0.11000E+01 volume  0.15319E-02 ppm1      1.911 ppm2      0.858 CV     1
 ASSI {  418}
   (( segid "    " and resid 138  and name HG  ))
   (( segid "    " and resid 138  and name HB2 ))
      3.800     1.800     1.800 peak   418 spectrum    1 weight  0.11000E+01 volume  0.62552E-03 ppm1      1.904 ppm2      1.439 CV     1
 ASSI {  419}
   (( segid "    " and resid 138  and name HG  ))
   (( segid "    " and resid 138  and name HB1 ))
      2.000     0.500     0.500 peak   419 spectrum    1 weight  0.11000E+01 volume  0.13054E-01 ppm1      1.898 ppm2      1.915 CV     1
 ASSI {  420}
   (  segid "    " and resid 146  and name HG2%)
   (  segid "    " and resid 147  and name HB% )
      1.900     1.900     4.100 peak   420 spectrum    1 weight  0.11000E+01 volume  0.23757E+00 ppm1      1.116 ppm2      1.118 CV     1
 OR {  420}
   (  segid "    " and resid 147  and name HB% )
   (  segid "    " and resid 146  and name HG2%)
 ASSI {  421}
   (  segid "    " and resid 116  and name HB% )
   (  segid "    " and resid 138  and name HD1%)
      2.200     2.200     3.800 peak   421 spectrum    1 weight  0.11000E+01 volume  0.44511E-01 ppm1      1.110 ppm2      1.109 CV     1
 OR {  421}
   (  segid "    " and resid 138  and name HD1%)
   (  segid "    " and resid 116  and name HB% )
 ASSI {  422}
   (  segid "    " and resid 138  and name HD1%)
   (  segid "    " and resid 138  and name HD2%)
      2.900     1.000     1.000 peak   422 spectrum    1 weight  0.11000E+01 volume  0.29981E-02 ppm1      1.118 ppm2      0.851 CV     1
 ASSI {  423}
   (  segid "    " and resid 138  and name HD1%)
   (( segid "    " and resid 138  and name HA  ))
      3.300     3.300     2.700 peak   423 spectrum    1 weight  0.11000E+01 volume  0.10052E-02 ppm1      1.107 ppm2      5.226 CV     1
 ASSI {  428}
   (( segid "    " and resid 140  and name HB2 ))
   (( segid "    " and resid 140  and name HB1 ))
      2.300     0.700     0.700 peak   428 spectrum    1 weight  0.11000E+01 volume  0.14996E-02 ppm1      1.302 ppm2      1.886 CV     1
 ASSI {  431}
   (( segid "    " and resid 140  and name HA  ))
   (( segid "    " and resid 140  and name HB1 ))
      3.100     1.200     1.200 peak   431 spectrum    1 weight  0.11000E+01 volume  0.89115E-03 ppm1      5.286 ppm2      1.891 CV     1
 ASSI {  432}
   (( segid "    " and resid 140  and name HG  ))
   (( segid "    " and resid 140  and name HA  ))
      4.100     2.100     1.900 peak   432 spectrum    1 weight  0.11000E+01 volume  0.66446E-03 ppm1      1.662 ppm2      5.297 CV     1
 ASSI {  435}
   (  segid "    " and resid 140  and name HD1%)
   (( segid "    " and resid 140  and name HB2 ))
      2.600     0.900     0.900 peak   435 spectrum    1 weight  0.11000E+01 volume  0.25688E-02 ppm1      0.950 ppm2      1.301 CV     1
 ASSI {  436}
   (  segid "    " and resid 140  and name HD2%)
   (( segid "    " and resid 140  and name HA  ))
      5.000     3.100     1.000 peak   436 spectrum    1 weight  0.11000E+01 volume  0.62902E-03 ppm1      0.705 ppm2      5.301 CV     1
 ASSI {  447}
   (( segid "    " and resid 140  and name HG  ))
   (  segid "    " and resid 140  and name HD1%)
      2.500     0.800     0.800 peak   447 spectrum    1 weight  0.11000E+01 volume  0.38798E-02 ppm1      1.615 ppm2      0.952 CV     1
 ASSI {  448}
   (( segid "    " and resid 140  and name HG  ))
   (( segid "    " and resid 140  and name HB2 ))
      3.500     1.500     1.500 peak   448 spectrum    1 weight  0.11000E+01 volume  0.93703E-03 ppm1      1.630 ppm2      1.301 CV     1
 ASSI {  449}
   (( segid "    " and resid 79   and name HG1 ))
   (( segid "    " and resid 79   and name HB2 ))
      2.300     0.600     0.600 peak   449 spectrum    1 weight  0.11000E+01 volume  0.10161E-01 ppm1      1.693 ppm2      1.885 CV     1
 OR {  449}
   (( segid "    " and resid 79   and name HG2 ))
   (( segid "    " and resid 79   and name HB1 ))
 OR {  449}
   (( segid "    " and resid 79   and name HG2 ))
   (( segid "    " and resid 79   and name HB2 ))
 OR {  449}
   (( segid "    " and resid 79   and name HG1 ))
   (( segid "    " and resid 79   and name HB1 ))
 ASSI {  451}
   (  segid "    " and resid 140  and name HD2%)
   (  segid "    " and resid 140  and name HD1%)
      2.800     1.000     1.000 peak   451 spectrum    1 weight  0.11000E+01 volume  0.35538E-02 ppm1      0.699 ppm2      0.959 CV     1
 ASSI {  452}
   (  segid "    " and resid 140  and name HD2%)
   (( segid "    " and resid 140  and name HG  ))
      2.600     0.800     0.800 peak   452 spectrum    1 weight  0.11000E+01 volume  0.35438E-02 ppm1      0.716 ppm2      1.667 CV     1
 ASSI {  453}
   (  segid "    " and resid 140  and name HD2%)
   (( segid "    " and resid 140  and name HB1 ))
      2.600     0.900     0.900 peak   453 spectrum    1 weight  0.11000E+01 volume  0.24183E-02 ppm1      0.710 ppm2      1.883 CV     1
 ASSI {  454}
   (  segid "    " and resid 140  and name HD2%)
   (( segid "    " and resid 140  and name HB2 ))
      3.300     1.400     1.400 peak   454 spectrum    1 weight  0.11000E+01 volume  0.23379E-02 ppm1      0.710 ppm2      1.307 CV     1
 ASSI {  456}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 51   and name HA  ))
      3.200     1.300     1.300 peak   456 spectrum    1 weight  0.11000E+01 volume  0.16935E-02 ppm1      0.901 ppm2      4.503 CV     1
 ASSI {  457}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 51   and name HB  ))
      2.600     0.800     0.800 peak   457 spectrum    1 weight  0.11000E+01 volume  0.54044E-02 ppm1      0.908 ppm2      2.064 CV     1
 ASSI {  459}
   (( segid "    " and resid 51   and name HB  ))
   (( segid "    " and resid 51   and name HA  ))
      4.700     2.700     1.300 peak   459 spectrum    1 weight  0.11000E+01 volume  0.17074E-03 ppm1      2.069 ppm2      4.500 CV     1
 ASSI {  467}
   (  segid "    " and resid 51   and name HG1%)
   (( segid "    " and resid 51   and name HB  ))
      2.600     0.800     0.800 peak   467 spectrum    1 weight  0.11000E+01 volume  0.54441E-02 ppm1      1.068 ppm2      2.057 CV     1
 ASSI {  470}
   (  segid "    " and resid 51   and name HG1%)
   (  segid "    " and resid 51   and name HG2%)
      2.500     0.800     0.800 peak   470 spectrum    1 weight  0.11000E+01 volume  0.10501E-01 ppm1      1.069 ppm2      0.913 CV     1
 ASSI {  473}
   (( segid "    " and resid 61   and name HB  ))
   (( segid "    " and resid 61   and name HA  ))
      3.100     1.200     1.200 peak   473 spectrum    1 weight  0.11000E+01 volume  0.21412E-02 ppm1      1.987 ppm2      4.412 CV     1
 ASSI {  480}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 61   and name HB  ))
      2.700     0.900     0.900 peak   480 spectrum    1 weight  0.11000E+01 volume  0.49457E-02 ppm1      0.808 ppm2      1.998 CV     1
 ASSI {  484}
   (( segid "    " and resid 61   and name HB  ))
   (  segid "    " and resid 61   and name HG1%)
      2.800     1.000     1.000 peak   484 spectrum    1 weight  0.11000E+01 volume  0.45003E-02 ppm1      1.996 ppm2      0.935 CV     1
 ASSI {  486}
   (  segid "    " and resid 61   and name HG2%)
   (  segid "    " and resid 61   and name HG1%)
      2.700     0.900     0.900 peak   486 spectrum    1 weight  0.11000E+01 volume  0.75313E-02 ppm1      0.795 ppm2      0.939 CV     1
 ASSI {  494}
   (  segid "    " and resid 65   and name HG1%)
   (( segid "    " and resid 65   and name HA  ))
      3.100     1.200     1.200 peak   494 spectrum    1 weight  0.11000E+01 volume  0.49254E-02 ppm1      0.846 ppm2      4.269 CV     1
 ASSI {  495}
   (  segid "    " and resid 65   and name HG1%)
   (( segid "    " and resid 65   and name HB  ))
      2.500     0.800     0.800 peak   495 spectrum    1 weight  0.11000E+01 volume  0.54958E-02 ppm1      0.861 ppm2      1.732 CV     1
 ASSI {  501}
   (  segid "    " and resid 65   and name HG2%)
   (  segid "    " and resid 65   and name HG1%)
      2.500     0.800     0.800 peak   501 spectrum    1 weight  0.11000E+01 volume  0.92087E-02 ppm1      0.468 ppm2      0.858 CV     1
 ASSI {  508}
   (  segid "    " and resid 66   and name HG1%)
   (( segid "    " and resid 66   and name HB  ))
      2.400     0.700     0.700 peak   508 spectrum    1 weight  0.11000E+01 volume  0.44113E-02 ppm1      0.681 ppm2      1.694 CV     1
 ASSI {  510}
   (  segid "    " and resid 66   and name HG2%)
   (  segid "    " and resid 66   and name HG1%)
      2.500     0.800     0.800 peak   510 spectrum    1 weight  0.11000E+01 volume  0.47076E-02 ppm1      0.024 ppm2      0.678 CV     1
 ASSI {  532}
   (  segid "    " and resid 68   and name HG1%)
   (  segid "    " and resid 68   and name HG2%)
      2.400     2.400     3.600 peak   532 spectrum    1 weight  0.11000E+01 volume  0.65375E-02 ppm1      1.112 ppm2      0.943 CV     1
 ASSI {  536}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 80   and name HB  ))
      2.900     1.100     1.100 peak   536 spectrum    1 weight  0.11000E+01 volume  0.26119E-02 ppm1      4.410 ppm2      2.023 CV     1
 ASSI {  542}
   (  segid "    " and resid 80   and name HG2%)
   (  segid "    " and resid 80   and name HG1%)
      2.300     2.300     3.700 peak   542 spectrum    1 weight  0.11000E+01 volume  0.93552E-02 ppm1      0.783 ppm2      0.935 CV     1
 ASSI {  547}
   (( segid "    " and resid 80   and name HB  ))
   (  segid "    " and resid 80   and name HG1%)
      2.800     2.800     3.200 peak   547 spectrum    1 weight  0.11000E+01 volume  0.29326E-02 ppm1      2.006 ppm2      0.909 CV     1
 ASSI {  550}
   (  segid "    " and resid 80   and name HG2%)
   (( segid "    " and resid 80   and name HB  ))
      2.400     0.700     0.700 peak   550 spectrum    1 weight  0.11000E+01 volume  0.52448E-02 ppm1      0.795 ppm2      1.992 CV     1
 ASSI {  555}
   (  segid "    " and resid 87   and name HG1%)
   (( segid "    " and resid 87   and name HB  ))
      2.600     0.900     0.900 peak   555 spectrum    1 weight  0.11000E+01 volume  0.53781E-02 ppm1      0.986 ppm2      1.892 CV     1
 ASSI {  565}
   (  segid "    " and resid 87   and name HG2%)
   (( segid "    " and resid 87   and name HB  ))
      2.600     0.800     0.800 peak   565 spectrum    1 weight  0.11000E+01 volume  0.51984E-02 ppm1      0.733 ppm2      1.892 CV     1
 ASSI {  576}
   (  segid "    " and resid 95   and name HG2%)
   (  segid "    " and resid 95   and name HG1%)
      2.600     0.800     0.800 peak   576 spectrum    1 weight  0.11000E+01 volume  0.49266E-02 ppm1      0.092 ppm2      0.325 CV     1
 ASSI {  584}
   (( segid "    " and resid 103  and name HB  ))
   (  segid "    " and resid 103  and name HG2%)
      2.600     0.800     0.800 peak   584 spectrum    1 weight  0.11000E+01 volume  0.17963E-02 ppm1      2.300 ppm2      1.041 CV     1
 ASSI {  588}
   (  segid "    " and resid 103  and name HG1%)
   (  segid "    " and resid 103  and name HG2%)
      2.400     0.700     0.700 peak   588 spectrum    1 weight  0.11000E+01 volume  0.52771E-02 ppm1      1.305 ppm2      1.033 CV     1
 ASSI {  589}
   (  segid "    " and resid 103  and name HG1%)
   (( segid "    " and resid 103  and name HB  ))
      2.500     0.800     0.800 peak   589 spectrum    1 weight  0.11000E+01 volume  0.25007E-02 ppm1      1.304 ppm2      2.301 CV     1
 ASSI {  603}
   (  segid "    " and resid 108  and name HG1%)
   (  segid "    " and resid 108  and name HG2%)
      2.200     2.200     3.800 peak   603 spectrum    1 weight  0.11000E+01 volume  0.17849E-01 ppm1      0.950 ppm2      0.845 CV     1
 ASSI {  609}
   (  segid "    " and resid 108  and name HG1%)
   (( segid "    " and resid 108  and name HB  ))
      2.600     0.800     0.800 peak   609 spectrum    1 weight  0.11000E+01 volume  0.41007E-02 ppm1      0.945 ppm2      2.057 CV     1
 ASSI {  611}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 108  and name HB  ))
      2.400     0.700     0.700 peak   611 spectrum    1 weight  0.11000E+01 volume  0.43517E-02 ppm1      0.841 ppm2      2.057 CV     1
 ASSI {  619}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 114  and name HB  ))
      2.400     0.700     0.700 peak   619 spectrum    1 weight  0.11000E+01 volume  0.54305E-02 ppm1      0.888 ppm2      2.045 CV     1
 ASSI {  620}
   (  segid "    " and resid 114  and name HG2%)
   (  segid "    " and resid 114  and name HG1%)
      1.400     1.400     4.600 peak   620 spectrum    1 weight  0.11000E+01 volume  0.23821E+00 ppm1      0.856 ppm2      0.860 CV     1
 ASSI {  623}
   (  segid "    " and resid 114  and name HG1%)
   (( segid "    " and resid 114  and name HB  ))
      2.400     0.700     0.700 peak   623 spectrum    1 weight  0.11000E+01 volume  0.62138E-02 ppm1      0.907 ppm2      2.063 CV     1
 ASSI {  634}
   (  segid "    " and resid 142  and name HG2%)
   (  segid "    " and resid 142  and name HG1%)
      2.000     2.000     4.000 peak   634 spectrum    1 weight  0.11000E+01 volume  0.21351E-01 ppm1      0.846 ppm2      0.932 CV     1
 ASSI {  636}
   (  segid "    " and resid 142  and name HG1%)
   (( segid "    " and resid 142  and name HA  ))
      3.000     1.100     1.100 peak   636 spectrum    1 weight  0.11000E+01 volume  0.15475E-02 ppm1      0.928 ppm2      5.054 CV     1
 ASSI {  637}
   (  segid "    " and resid 142  and name HG2%)
   (( segid "    " and resid 142  and name HB  ))
      2.100     0.600     0.600 peak   637 spectrum    1 weight  0.11000E+01 volume  0.11542E-01 ppm1      0.855 ppm2      1.968 CV     1
 ASSI {  648}
   (  segid "    " and resid 148  and name HG1%)
   (( segid "    " and resid 148  and name HA  ))
      4.100     2.100     1.900 peak   648 spectrum    1 weight  0.11000E+01 volume  0.40025E-03 ppm1      0.882 ppm2      4.586 CV     1
 ASSI {  649}
   (  segid "    " and resid 148  and name HG1%)
   (  segid "    " and resid 148  and name HG2%)
      1.400     1.400     4.600 peak   649 spectrum    1 weight  0.11000E+01 volume  0.29027E+00 ppm1      0.885 ppm2      0.902 CV     1
 ASSI {  650}
   (  segid "    " and resid 148  and name HG1%)
   (( segid "    " and resid 148  and name HB  ))
      2.700     0.900     0.900 peak   650 spectrum    1 weight  0.11000E+01 volume  0.55061E-02 ppm1      0.902 ppm2      2.123 CV     1
 ASSI {  656}
   (  segid "    " and resid 49   and name HG2%)
   (( segid "    " and resid 49   and name HB  ))
      2.700     0.900     0.900 peak   656 spectrum    1 weight  0.11000E+01 volume  0.36568E-02 ppm1      1.050 ppm2      3.826 CV     1
 ASSI {  667}
   (  segid "    " and resid 67   and name HG2%)
   (( segid "    " and resid 67   and name HB  ))
      2.600     0.800     0.800 peak   667 spectrum    1 weight  0.11000E+01 volume  0.39731E-02 ppm1      1.066 ppm2      3.989 CV     1
 ASSI {  674}
   (( segid "    " and resid 72   and name HB  ))
   (( segid "    " and resid 72   and name HA  ))
      3.300     1.400     1.400 peak   674 spectrum    1 weight  0.11000E+01 volume  0.68887E-03 ppm1      4.024 ppm2      4.905 CV     1
 ASSI {  681}
   (( segid "    " and resid 78   and name HB  ))
   (( segid "    " and resid 78   and name HA  ))
      2.300     0.700     0.700 peak   681 spectrum    1 weight  0.11000E+01 volume  0.13394E-01 ppm1      4.060 ppm2      4.065 CV     1
 ASSI {  682}
   (( segid "    " and resid 78   and name HB  ))
   (  segid "    " and resid 78   and name HG2%)
      3.000     1.100     1.100 peak   682 spectrum    1 weight  0.11000E+01 volume  0.25592E-02 ppm1      4.064 ppm2      1.238 CV     1
 ASSI {  684}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 78   and name HB  ))
      2.400     0.700     0.700 peak   684 spectrum    1 weight  0.11000E+01 volume  0.94475E-02 ppm1      1.237 ppm2      4.066 CV     1
 OR {  684}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 78   and name HA  ))
 ASSI {  688}
   (( segid "    " and resid 89   and name HB  ))
   (( segid "    " and resid 89   and name HA  ))
      4.400     2.400     1.600 peak   688 spectrum    1 weight  0.11000E+01 volume  0.23685E-03 ppm1      4.145 ppm2      4.588 CV     1
 ASSI {  707}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 115  and name HB  ))
      2.700     0.900     0.900 peak   707 spectrum    1 weight  0.11000E+01 volume  0.42282E-02 ppm1      1.121 ppm2      4.110 CV     1
 ASSI {  721}
   (  segid "    " and resid 146  and name HG2%)
   (( segid "    " and resid 146  and name HB  ))
      2.600     0.800     0.800 peak   721 spectrum    1 weight  0.11000E+01 volume  0.52319E-02 ppm1      1.111 ppm2      4.059 CV     1
 ASSI {  727}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 22   and name HA  ))
      1.800     1.800     4.200 peak   727 spectrum    1 weight  0.11000E+01 volume  0.15429E+00 ppm1      4.292 ppm2      4.292 CV     1
 OR {  727}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 21   and name HA  ))
 ASSI {  729}
   (  segid "    " and resid 9    and name HB% )
   (( segid "    " and resid 9    and name HA  ))
      3.300     1.300     1.300 peak   729 spectrum    1 weight  0.11000E+01 volume  0.20339E-02 ppm1      1.404 ppm2      4.296 CV     1
 ASSI {  730}
   (( segid "    " and resid 14   and name HA  ))
   (  segid "    " and resid 14   and name HB% )
      2.800     1.000     1.000 peak   730 spectrum    1 weight  0.11000E+01 volume  0.53594E-02 ppm1      4.288 ppm2      1.409 CV     1
 ASSI {  732}
   (  segid "    " and resid 21   and name HB% )
   (  segid "    " and resid 22   and name HB% )
      1.100     1.100     4.900 peak   732 spectrum    1 weight  0.11000E+01 volume  0.15666E+01 ppm1      1.405 ppm2      1.406 CV     1
 ASSI {  741}
   (  segid "    " and resid 30   and name HB% )
   (( segid "    " and resid 30   and name HA  ))
      3.700     1.700     1.700 peak   741 spectrum    1 weight  0.11000E+01 volume  0.96780E-03 ppm1      1.480 ppm2      4.474 CV     1
 ASSI {  749}
   (  segid "    " and resid 112  and name HB% )
   (( segid "    " and resid 112  and name HA  ))
      2.400     0.700     0.700 peak   749 spectrum    1 weight  0.11000E+01 volume  0.38460E-02 ppm1      1.537 ppm2      5.191 CV     1
 ASSI {  753}
   (  segid "    " and resid 116  and name HB% )
   (( segid "    " and resid 116  and name HA  ))
      2.400     0.700     0.700 peak   753 spectrum    1 weight  0.11000E+01 volume  0.47308E-02 ppm1      1.109 ppm2      5.354 CV     1
 ASSI {  763}
   (  segid "    " and resid 147  and name HB% )
   (( segid "    " and resid 147  and name HA  ))
      2.600     0.800     0.800 peak   763 spectrum    1 weight  0.11000E+01 volume  0.43560E-02 ppm1      1.129 ppm2      5.022 CV     1
 ASSI {  765}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 39   and name HB  ))
      3.700     1.700     1.700 peak   765 spectrum    1 weight  0.11000E+01 volume  0.69735E-03 ppm1      3.463 ppm2      1.629 CV     1
 ASSI {  772}
   (( segid "    " and resid 39   and name HG12))
   (( segid "    " and resid 39   and name HG11))
      2.200     0.600     0.600 peak   772 spectrum    1 weight  0.11000E+01 volume  0.19619E-02 ppm1      0.994 ppm2      1.811 CV     1
 ASSI {  775}
   (( segid "    " and resid 39   and name HG11))
   (( segid "    " and resid 39   and name HB  ))
      2.700     0.900     0.900 peak   775 spectrum    1 weight  0.11000E+01 volume  0.16680E-02 ppm1      1.811 ppm2      1.635 CV     1
 ASSI {  776}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 39   and name HG11))
      3.900     1.900     1.900 peak   776 spectrum    1 weight  0.11000E+01 volume  0.89821E-03 ppm1      3.467 ppm2      1.809 CV     1
 ASSI {  777}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 39   and name HG12))
      2.800     1.000     1.000 peak   777 spectrum    1 weight  0.11000E+01 volume  0.19810E-02 ppm1      3.467 ppm2      0.988 CV     1
 ASSI {  778}
   (  segid "    " and resid 39   and name HG2%)
   (( segid "    " and resid 39   and name HA  ))
      2.900     1.000     1.000 peak   778 spectrum    1 weight  0.11000E+01 volume  0.30093E-02 ppm1      0.789 ppm2      3.471 CV     1
 ASSI {  779}
   (  segid "    " and resid 39   and name HG2%)
   (( segid "    " and resid 39   and name HG11))
      3.800     1.800     1.800 peak   779 spectrum    1 weight  0.11000E+01 volume  0.17715E-02 ppm1      0.788 ppm2      1.811 CV     1
 ASSI {  780}
   (  segid "    " and resid 39   and name HG2%)
   (( segid "    " and resid 39   and name HB  ))
      2.500     0.800     0.800 peak   780 spectrum    1 weight  0.11000E+01 volume  0.37974E-02 ppm1      0.788 ppm2      1.628 CV     1
 ASSI {  781}
   (  segid "    " and resid 39   and name HG2%)
   (( segid "    " and resid 39   and name HG12))
      2.600     0.900     0.900 peak   781 spectrum    1 weight  0.11000E+01 volume  0.46538E-02 ppm1      0.791 ppm2      0.987 CV     1
 ASSI {  782}
   (  segid "    " and resid 39   and name HG2%)
   (  segid "    " and resid 39   and name HD1%)
      1.700     1.700     4.300 peak   782 spectrum    1 weight  0.11000E+01 volume  0.48111E-01 ppm1      0.787 ppm2      0.788 CV     1
 ASSI {  783}
   (( segid "    " and resid 39   and name HA  ))
   (  segid "    " and resid 39   and name HG2%)
      3.100     1.200     1.200 peak   783 spectrum    1 weight  0.11000E+01 volume  0.27226E-02 ppm1      3.465 ppm2      0.784 CV     1
 OR {  783}
   (( segid "    " and resid 39   and name HA  ))
   (  segid "    " and resid 39   and name HD1%)
 ASSI {  785}
   (  segid "    " and resid 39   and name HD1%)
   (( segid "    " and resid 39   and name HG12))
      2.300     0.700     0.700 peak   785 spectrum    1 weight  0.11000E+01 volume  0.54408E-02 ppm1      0.765 ppm2      0.992 CV     1
 ASSI {  786}
   (  segid "    " and resid 39   and name HD1%)
   (( segid "    " and resid 39   and name HB  ))
      3.000     1.100     1.100 peak   786 spectrum    1 weight  0.11000E+01 volume  0.19276E-02 ppm1      0.761 ppm2      1.631 CV     1
 ASSI {  787}
   (  segid "    " and resid 39   and name HD1%)
   (( segid "    " and resid 39   and name HG11))
      2.400     0.700     0.700 peak   787 spectrum    1 weight  0.11000E+01 volume  0.40006E-02 ppm1      0.761 ppm2      1.807 CV     1
 ASSI {  788}
   (  segid "    " and resid 39   and name HD1%)
   (( segid "    " and resid 39   and name HA  ))
      4.700     2.800     1.300 peak   788 spectrum    1 weight  0.11000E+01 volume  0.85820E-03 ppm1      0.764 ppm2      3.477 CV     1
 ASSI {  789}
   (( segid "    " and resid 39   and name HB  ))
   (  segid "    " and resid 39   and name HG2%)
      2.600     0.900     0.900 peak   789 spectrum    1 weight  0.11000E+01 volume  0.30689E-02 ppm1      1.631 ppm2      0.781 CV     1
 OR {  789}
   (( segid "    " and resid 39   and name HB  ))
   (  segid "    " and resid 39   and name HD1%)
 ASSI {  790}
   (( segid "    " and resid 39   and name HB  ))
   (( segid "    " and resid 39   and name HG12))
      3.700     1.800     1.800 peak   790 spectrum    1 weight  0.11000E+01 volume  0.72599E-03 ppm1      1.633 ppm2      0.994 CV     1
 ASSI {  792}
   (( segid "    " and resid 39   and name HG11))
   (  segid "    " and resid 39   and name HD1%)
      2.800     1.000     1.000 peak   792 spectrum    1 weight  0.11000E+01 volume  0.22749E-02 ppm1      1.808 ppm2      0.767 CV     1
 OR {  792}
   (( segid "    " and resid 39   and name HG11))
   (  segid "    " and resid 39   and name HG2%)
 ASSI {  793}
   (( segid "    " and resid 39   and name HG12))
   (  segid "    " and resid 39   and name HD1%)
      2.700     0.900     0.900 peak   793 spectrum    1 weight  0.11000E+01 volume  0.27648E-02 ppm1      0.984 ppm2      0.766 CV     1
 OR {  793}
   (( segid "    " and resid 39   and name HG12))
   (  segid "    " and resid 39   and name HG2%)
 ASSI {  804}
   (  segid "    " and resid 96   and name HG2%)
   (  segid "    " and resid 96   and name HD1%)
      2.600     2.600     3.400 peak   804 spectrum    1 weight  0.11000E+01 volume  0.49091E-02 ppm1      0.280 ppm2      0.752 CV     1
 ASSI {  811}
   (( segid "    " and resid 96   and name HG11))
   (  segid "    " and resid 96   and name HG2%)
      4.200     2.200     1.800 peak   811 spectrum    1 weight  0.11000E+01 volume  0.72794E-03 ppm1      1.263 ppm2      0.279 CV     1
 ASSI {  812}
   (( segid "    " and resid 96   and name HG12))
   (( segid "    " and resid 96   and name HB  ))
      4.000     2.000     2.000 peak   812 spectrum    1 weight  0.11000E+01 volume  0.48504E-03 ppm1      1.148 ppm2      2.095 CV     1
 ASSI {  813}
   (( segid "    " and resid 96   and name HG11))
   (( segid "    " and resid 96   and name HG12))
      2.000     0.500     0.500 peak   813 spectrum    1 weight  0.11000E+01 volume  0.27014E-02 ppm1      1.261 ppm2      1.147 CV     1
 ASSI {  815}
   (( segid "    " and resid 96   and name HG11))
   (  segid "    " and resid 96   and name HD1%)
      2.400     0.700     0.700 peak   815 spectrum    1 weight  0.11000E+01 volume  0.43757E-02 ppm1      1.292 ppm2      0.755 CV     1
 ASSI {  816}
   (( segid "    " and resid 96   and name HG12))
   (  segid "    " and resid 96   and name HD1%)
      2.600     0.800     0.800 peak   816 spectrum    1 weight  0.11000E+01 volume  0.30180E-02 ppm1      1.160 ppm2      0.760 CV     1
 ASSI {  819}
   (( segid "    " and resid 96   and name HA  ))
   (( segid "    " and resid 96   and name HG12))
      4.900     3.000     1.100 peak   819 spectrum    1 weight  0.11000E+01 volume  0.21438E-03 ppm1      4.019 ppm2      1.149 CV     1
 ASSI {  820}
   (( segid "    " and resid 96   and name HA  ))
   (( segid "    " and resid 96   and name HG11))
      4.900     3.000     1.100 peak   820 spectrum    1 weight  0.11000E+01 volume  0.18359E-03 ppm1      4.013 ppm2      1.266 CV     1
 ASSI {  823}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 96   and name HG12))
      3.100     1.200     1.200 peak   823 spectrum    1 weight  0.11000E+01 volume  0.14582E-02 ppm1      0.280 ppm2      1.157 CV     1
 ASSI {  830}
   (  segid "    " and resid 132  and name HG2%)
   (( segid "    " and resid 132  and name HA  ))
      3.200     1.300     1.300 peak   830 spectrum    1 weight  0.11000E+01 volume  0.15252E-02 ppm1      0.934 ppm2      4.111 CV     1
 ASSI {  833}
   (  segid "    " and resid 132  and name HG2%)
   (( segid "    " and resid 132  and name HB  ))
      2.600     0.800     0.800 peak   833 spectrum    1 weight  0.11000E+01 volume  0.35164E-02 ppm1      0.933 ppm2      1.143 CV     1
 ASSI {  834}
   (  segid "    " and resid 132  and name HD1%)
   (( segid "    " and resid 132  and name HA  ))
      3.900     1.900     1.900 peak   834 spectrum    1 weight  0.11000E+01 volume  0.64472E-03 ppm1      0.459 ppm2      4.110 CV     1
 ASSI {  837}
   (  segid "    " and resid 132  and name HD1%)
   (  segid "    " and resid 132  and name HG2%)
      2.600     0.900     0.900 peak   837 spectrum    1 weight  0.11000E+01 volume  0.47516E-02 ppm1      0.458 ppm2      0.928 CV     1
 ASSI {  839}
   (( segid "    " and resid 132  and name HG11))
   (( segid "    " and resid 132  and name HA  ))
      3.900     1.900     1.900 peak   839 spectrum    1 weight  0.11000E+01 volume  0.38235E-03 ppm1      1.011 ppm2      4.116 CV     1
 ASSI {  846}
   (( segid "    " and resid 132  and name HG11))
   (( segid "    " and resid 132  and name HG12))
      2.200     2.200     3.800 peak   846 spectrum    1 weight  0.11000E+01 volume  0.35346E-02 ppm1      0.991 ppm2      0.761 CV     1
 ASSI {  847}
   (( segid "    " and resid 132  and name HG12))
   (( segid "    " and resid 132  and name HB  ))
      3.500     1.500     1.500 peak   847 spectrum    1 weight  0.11000E+01 volume  0.78127E-03 ppm1      0.710 ppm2      1.151 CV     1
 ASSI {  848}
   (( segid "    " and resid 132  and name HG12))
   (( segid "    " and resid 132  and name HG11))
      2.300     0.700     0.700 peak   848 spectrum    1 weight  0.11000E+01 volume  0.27807E-02 ppm1      0.733 ppm2      0.990 CV     1
 OR {  848}
   (( segid "    " and resid 132  and name HG12))
   (  segid "    " and resid 132  and name HG2%)
 ASSI {  850}
   (  segid "    " and resid 132  and name HG2%)
   (( segid "    " and resid 132  and name HG12))
      3.100     1.200     1.200 peak   850 spectrum    1 weight  0.11000E+01 volume  0.18031E-02 ppm1      0.928 ppm2      0.751 CV     1
 ASSI {  851}
   (  segid "    " and resid 132  and name HG2%)
   (( segid "    " and resid 132  and name HG11))
      3.500     1.500     1.500 peak   851 spectrum    1 weight  0.11000E+01 volume  0.13797E-02 ppm1      0.933 ppm2      1.007 CV     1
 ASSI {  854}
   (  segid "    " and resid 132  and name HD1%)
   (( segid "    " and resid 132  and name HG12))
      2.800     1.000     1.000 peak   854 spectrum    1 weight  0.11000E+01 volume  0.20531E-02 ppm1      0.463 ppm2      0.727 CV     1
 ASSI {  858}
   (( segid "    " and resid 132  and name HA  ))
   (( segid "    " and resid 132  and name HG12))
      3.900     1.900     1.900 peak   858 spectrum    1 weight  0.11000E+01 volume  0.43684E-03 ppm1      4.115 ppm2      0.734 CV     1
 ASSI {  864}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 36   and name HB2 ))
      3.900     3.900     2.100 peak   864 spectrum    1 weight  0.11000E+01 volume  0.10059E-02 ppm1      4.565 ppm2      3.014 CV     1
 ASSI {  873}
   (( segid "    " and resid 57   and name HB2 ))
   (( segid "    " and resid 57   and name HB1 ))
      1.900     0.400     0.400 peak   873 spectrum    1 weight  0.11000E+01 volume  0.65873E-02 ppm1      3.964 ppm2      4.048 CV     1
 ASSI {  881}
   (( segid "    " and resid 58   and name HB1 ))
   (( segid "    " and resid 58   and name HB2 ))
      2.000     0.500     0.500 peak   881 spectrum    1 weight  0.11000E+01 volume  0.10914E-01 ppm1      3.864 ppm2      3.800 CV     1
 ASSI {  886}
   (( segid "    " and resid 102  and name HB2 ))
   (( segid "    " and resid 102  and name HA  ))
      3.000     1.100     1.100 peak   886 spectrum    1 weight  0.11000E+01 volume  0.98936E-03 ppm1      3.544 ppm2      4.479 CV     1
 ASSI {  888}
   (( segid "    " and resid 102  and name HB2 ))
   (( segid "    " and resid 102  and name HB1 ))
      2.100     0.500     0.500 peak   888 spectrum    1 weight  0.11000E+01 volume  0.36957E-02 ppm1      3.539 ppm2      3.620 CV     1
 ASSI {  913}
   (( segid "    " and resid 129  and name HB2 ))
   (( segid "    " and resid 129  and name HA  ))
      3.100     1.200     1.200 peak   913 spectrum    1 weight  0.11000E+01 volume  0.21701E-02 ppm1      3.605 ppm2      4.505 CV     1
 ASSI {  915}
   (( segid "    " and resid 129  and name HB2 ))
   (( segid "    " and resid 129  and name HB1 ))
      2.000     0.500     0.500 peak   915 spectrum    1 weight  0.11000E+01 volume  0.78135E-02 ppm1      3.606 ppm2      3.766 CV     1
 ASSI {  938}
   (( segid "    " and resid 82   and name HG1 ))
   (( segid "    " and resid 82   and name HA  ))
      3.200     1.300     1.300 peak   938 spectrum    1 weight  0.11000E+01 volume  0.13686E-02 ppm1      2.202 ppm2      5.058 CV     1
 ASSI {  941}
   (( segid "    " and resid 82   and name HB1 ))
   (( segid "    " and resid 82   and name HG1 ))
      2.700     0.900     0.900 peak   941 spectrum    1 weight  0.11000E+01 volume  0.12795E-01 ppm1      2.112 ppm2      2.181 CV     1
 ASSI {  944}
   (( segid "    " and resid 83   and name HB2 ))
   (( segid "    " and resid 83   and name HA  ))
      3.400     1.400     1.400 peak   944 spectrum    1 weight  0.11000E+01 volume  0.77775E-03 ppm1      1.911 ppm2      5.039 CV     1
 ASSI {  945}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 83   and name HB1 ))
      4.000     4.000     2.000 peak   945 spectrum    1 weight  0.11000E+01 volume  0.63790E-03 ppm1      5.037 ppm2      2.103 CV     1
 ASSI {  949}
   (( segid "    " and resid 83   and name HB1 ))
   (( segid "    " and resid 83   and name HB2 ))
      2.000     0.500     0.500 peak   949 spectrum    1 weight  0.11000E+01 volume  0.72269E-02 ppm1      2.037 ppm2      1.917 CV     1
 ASSI {  950}
   (( segid "    " and resid 83   and name HG1 ))
   (( segid "    " and resid 83   and name HB2 ))
      2.700     0.900     0.900 peak   950 spectrum    1 weight  0.11000E+01 volume  0.50270E-02 ppm1      2.186 ppm2      1.939 CV     1
 OR {  950}
   (( segid "    " and resid 83   and name HG2 ))
   (( segid "    " and resid 83   and name HB2 ))
 ASSI {  951}
   (( segid "    " and resid 83   and name HG1 ))
   (( segid "    " and resid 83   and name HB1 ))
      2.300     2.300     3.700 peak   951 spectrum    1 weight  0.11000E+01 volume  0.85964E-02 ppm1      2.185 ppm2      2.104 CV     1
 OR {  951}
   (( segid "    " and resid 83   and name HG2 ))
   (( segid "    " and resid 83   and name HB1 ))
 ASSI {  954}
   (( segid "    " and resid 85   and name HB1 ))
   (( segid "    " and resid 85   and name HA  ))
      3.100     1.200     1.200 peak   954 spectrum    1 weight  0.11000E+01 volume  0.16101E-02 ppm1      1.962 ppm2      4.397 CV     1
 ASSI {  956}
   (( segid "    " and resid 85   and name HB1 ))
   (( segid "    " and resid 85   and name HB2 ))
      2.200     0.600     0.600 peak   956 spectrum    1 weight  0.11000E+01 volume  0.53956E-02 ppm1      1.958 ppm2      1.742 CV     1
 ASSI {  963}
   (( segid "    " and resid 85   and name HB1 ))
   (( segid "    " and resid 85   and name HG2 ))
      2.000     0.500     0.500 peak   963 spectrum    1 weight  0.11000E+01 volume  0.22681E-01 ppm1      1.956 ppm2      2.045 CV     1
 OR {  963}
   (( segid "    " and resid 85   and name HB1 ))
   (( segid "    " and resid 85   and name HG1 ))
 ASSI {  971}
   (( segid "    " and resid 141  and name HG2 ))
   (( segid "    " and resid 141  and name HB2 ))
      2.400     0.700     0.700 peak   971 spectrum    1 weight  0.11000E+01 volume  0.13118E-01 ppm1      1.973 ppm2      1.961 CV     1
 ASSI {  972}
   (( segid "    " and resid 141  and name HG2 ))
   (( segid "    " and resid 141  and name HG1 ))
      1.900     0.500     0.500 peak   972 spectrum    1 weight  0.11000E+01 volume  0.98983E-02 ppm1      1.961 ppm2      2.040 CV     1
 OR {  972}
   (( segid "    " and resid 141  and name HG2 ))
   (( segid "    " and resid 141  and name HB1 ))
 ASSI {  973}
   (( segid "    " and resid 141  and name HG1 ))
   (( segid "    " and resid 141  and name HG2 ))
      1.900     0.400     0.400 peak   973 spectrum    1 weight  0.11000E+01 volume  0.12518E-01 ppm1      2.012 ppm2      1.965 CV     1
 OR {  973}
   (( segid "    " and resid 141  and name HG1 ))
   (( segid "    " and resid 141  and name HB2 ))
 ASSI {  975}
   (( segid "    " and resid 141  and name HA  ))
   (( segid "    " and resid 141  and name HB1 ))
      3.300     1.400     1.400 peak   975 spectrum    1 weight  0.11000E+01 volume  0.12213E-02 ppm1      5.228 ppm2      2.030 CV     1
 OR {  975}
   (( segid "    " and resid 141  and name HA  ))
   (( segid "    " and resid 141  and name HG1 ))
 ASSI {  976}
   (( segid "    " and resid 141  and name HA  ))
   (( segid "    " and resid 141  and name HB2 ))
      2.800     1.000     1.000 peak   976 spectrum    1 weight  0.11000E+01 volume  0.14698E-02 ppm1      5.231 ppm2      1.962 CV     1
 OR {  976}
   (( segid "    " and resid 141  and name HA  ))
   (( segid "    " and resid 141  and name HG2 ))
 ASSI {  977}
   (( segid "    " and resid 141  and name HB1 ))
   (( segid "    " and resid 141  and name HA  ))
      3.600     1.600     1.600 peak   977 spectrum    1 weight  0.11000E+01 volume  0.93781E-03 ppm1      2.039 ppm2      5.230 CV     1
 ASSI {  981}
   (( segid "    " and resid 141  and name HB1 ))
   (( segid "    " and resid 141  and name HB2 ))
      1.700     0.400     0.500 peak   981 spectrum    1 weight  0.11000E+01 volume  0.15909E-01 ppm1      2.039 ppm2      1.949 CV     1
 OR {  981}
   (( segid "    " and resid 141  and name HB1 ))
   (( segid "    " and resid 141  and name HG2 ))
 ASSI {  982}
   (( segid "    " and resid 141  and name HB2 ))
   (( segid "    " and resid 141  and name HB1 ))
      1.700     0.300     0.500 peak   982 spectrum    1 weight  0.11000E+01 volume  0.18131E-01 ppm1      1.968 ppm2      2.035 CV     1
 OR {  982}
   (( segid "    " and resid 141  and name HB2 ))
   (( segid "    " and resid 141  and name HG1 ))
 ASSI {  988}
   (( segid "    " and resid 151  and name HG1 ))
   (( segid "    " and resid 151  and name HA  ))
      3.400     1.500     1.500 peak   988 spectrum    1 weight  0.11000E+01 volume  0.24143E-02 ppm1      2.255 ppm2      4.295 CV     1
 ASSI {  989}
   (( segid "    " and resid 151  and name HG2 ))
   (( segid "    " and resid 151  and name HA  ))
      3.700     1.700     1.700 peak   989 spectrum    1 weight  0.11000E+01 volume  0.10087E-02 ppm1      2.051 ppm2      4.295 CV     1
 ASSI {  995}
   (( segid "    " and resid 151  and name HG1 ))
   (( segid "    " and resid 151  and name HB2 ))
      3.000     1.100     1.100 peak   995 spectrum    1 weight  0.11000E+01 volume  0.34420E-02 ppm1      2.256 ppm2      1.944 CV     1
 ASSI {  996}
   (( segid "    " and resid 151  and name HG2 ))
   (( segid "    " and resid 151  and name HB2 ))
      2.600     0.800     0.800 peak   996 spectrum    1 weight  0.11000E+01 volume  0.57892E-02 ppm1      2.057 ppm2      1.945 CV     1
 ASSI {  998}
   (  segid "    " and resid 106  and name HE% )
   (( segid "    " and resid 106  and name HA  ))
      5.500     3.700     0.500 peak   998 spectrum    1 weight  0.11000E+01 volume  0.45026E-03 ppm1      1.969 ppm2      4.386 CV     1
 ASSI { 1003}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 106  and name HG2 ))
      1.900     1.900     4.100 peak  1003 spectrum    1 weight  0.11000E+01 volume  0.18519E+00 ppm1      1.909 ppm2      1.914 CV     1
 OR { 1003}
   (( segid "    " and resid 106  and name HG2 ))
   (( segid "    " and resid 52   and name HB2 ))
 ASSI { 1008}
   (( segid "    " and resid 93   and name HB1 ))
   (( segid "    " and resid 93   and name HA  ))
      3.100     1.200     1.200 peak  1008 spectrum    1 weight  0.11000E+01 volume  0.20499E-02 ppm1      3.200 ppm2      4.272 CV     1
 OR { 1008}
   (( segid "    " and resid 93   and name HB2 ))
   (( segid "    " and resid 93   and name HA  ))
 ASSI { 1027}
   (( segid "    " and resid 139  and name HB2 ))
   (( segid "    " and resid 139  and name HB1 ))
      2.200     0.600     0.600 peak  1027 spectrum    1 weight  0.11000E+01 volume  0.59304E-02 ppm1      2.684 ppm2      2.891 CV     1
 ASSI { 1039}
   (( segid "    " and resid 76   and name HB1 ))
   (( segid "    " and resid 76   and name HA  ))
      3.900     1.900     1.900 peak  1039 spectrum    1 weight  0.11000E+01 volume  0.59536E-03 ppm1      3.320 ppm2      4.574 CV     1
 ASSI { 1049}
   (( segid "    " and resid 38   and name HB1 ))
   (( segid "    " and resid 38   and name HA  ))
      3.900     1.900     1.900 peak  1049 spectrum    1 weight  0.11000E+01 volume  0.26903E-03 ppm1      2.591 ppm2      4.778 CV     1
 OR { 1049}
   (( segid "    " and resid 38   and name HB2 ))
   (( segid "    " and resid 38   and name HA  ))
 ASSI { 1053}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 38   and name HB1 ))
      4.000     2.000     2.000 peak  1053 spectrum    1 weight  0.11000E+01 volume  0.15899E-03 ppm1      4.763 ppm2      2.620 CV     1
 ASSI { 1063}
   (( segid "    " and resid 94   and name HA  ))
   (( segid "    " and resid 94   and name HB1 ))
      5.400     3.700     0.600 peak  1063 spectrum    1 weight  0.11000E+01 volume  0.12763E-03 ppm1      4.673 ppm2      2.810 CV     1
 ASSI { 1071}
   (( segid "    " and resid 100  and name HB2 ))
   (( segid "    " and resid 100  and name HB1 ))
      2.100     0.500     0.500 peak  1071 spectrum    1 weight  0.11000E+01 volume  0.34862E-02 ppm1      2.405 ppm2      2.579 CV     1
 ASSI { 1078}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 107  and name HB2 ))
      5.300     3.600     0.700 peak  1078 spectrum    1 weight  0.11000E+01 volume  0.10414E-03 ppm1      4.744 ppm2      2.289 CV     1
 ASSI { 1080}
   (( segid "    " and resid 117  and name HB2 ))
   (( segid "    " and resid 117  and name HA  ))
      3.600     1.700     1.700 peak  1080 spectrum    1 weight  0.11000E+01 volume  0.44206E-03 ppm1      2.484 ppm2      4.475 CV     1
 ASSI { 1088}
   (( segid "    " and resid 149  and name HB1 ))
   (( segid "    " and resid 149  and name HB2 ))
      2.400     0.700     0.700 peak  1088 spectrum    1 weight  0.11000E+01 volume  0.40055E-02 ppm1      2.713 ppm2      2.506 CV     1
 ASSI { 1095}
   (( segid "    " and resid 64   and name HB1 ))
   (( segid "    " and resid 64   and name HA  ))
      3.400     1.400     1.400 peak  1095 spectrum    1 weight  0.11000E+01 volume  0.44981E-03 ppm1      2.217 ppm2      4.480 CV     1
 ASSI { 1096}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 64   and name HA  ))
      4.100     2.100     1.900 peak  1096 spectrum    1 weight  0.11000E+01 volume  0.53303E-03 ppm1      1.628 ppm2      4.480 CV     1
 ASSI { 1098}
   (( segid "    " and resid 64   and name HG2 ))
   (( segid "    " and resid 64   and name HA  ))
      4.400     2.400     1.600 peak  1098 spectrum    1 weight  0.11000E+01 volume  0.50431E-03 ppm1      2.144 ppm2      4.472 CV     1
 ASSI { 1101}
   (( segid "    " and resid 64   and name HG1 ))
   (( segid "    " and resid 64   and name HG2 ))
      2.300     0.700     0.700 peak  1101 spectrum    1 weight  0.11000E+01 volume  0.21171E-02 ppm1      2.474 ppm2      2.172 CV     1
 OR { 1101}
   (( segid "    " and resid 64   and name HG1 ))
   (( segid "    " and resid 64   and name HB1 ))
 ASSI { 1102}
   (( segid "    " and resid 64   and name HG2 ))
   (( segid "    " and resid 64   and name HB1 ))
      2.000     2.000     4.000 peak  1102 spectrum    1 weight  0.11000E+01 volume  0.46711E-01 ppm1      2.144 ppm2      2.172 CV     1
 ASSI { 1103}
   (( segid "    " and resid 64   and name HB1 ))
   (( segid "    " and resid 64   and name HB2 ))
      2.600     0.800     0.800 peak  1103 spectrum    1 weight  0.11000E+01 volume  0.11016E-02 ppm1      2.218 ppm2      1.626 CV     1
 ASSI { 1104}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 64   and name HB1 ))
      2.700     0.900     0.900 peak  1104 spectrum    1 weight  0.11000E+01 volume  0.11231E-02 ppm1      1.629 ppm2      2.195 CV     1
 OR { 1104}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 64   and name HG2 ))
 ASSI { 1108}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 64   and name HB1 ))
      3.700     1.700     1.700 peak  1108 spectrum    1 weight  0.11000E+01 volume  0.33082E-03 ppm1      4.449 ppm2      2.191 CV     1
 OR { 1108}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 64   and name HG2 ))
 ASSI { 1111}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 64   and name HG1 ))
      3.300     1.400     1.400 peak  1111 spectrum    1 weight  0.11000E+01 volume  0.70610E-03 ppm1      1.640 ppm2      2.454 CV     1
 ASSI { 1117}
   (( segid "    " and resid 71   and name HG1 ))
   (( segid "    " and resid 71   and name HG2 ))
      1.900     0.400     0.400 peak  1117 spectrum    1 weight  0.11000E+01 volume  0.76232E-02 ppm1      2.335 ppm2      2.199 CV     1
 ASSI { 1120}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 71   and name HG1 ))
      2.600     2.600     3.400 peak  1120 spectrum    1 weight  0.11000E+01 volume  0.39749E-02 ppm1      2.087 ppm2      2.335 CV     1
 ASSI { 1121}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 71   and name HG2 ))
      2.000     2.000     4.000 peak  1121 spectrum    1 weight  0.11000E+01 volume  0.99142E-02 ppm1      2.087 ppm2      2.177 CV     1
 ASSI { 1122}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 71   and name HG1 ))
      2.700     0.900     0.900 peak  1122 spectrum    1 weight  0.11000E+01 volume  0.46906E-02 ppm1      2.037 ppm2      2.334 CV     1
 ASSI { 1123}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 71   and name HG2 ))
      2.500     0.800     0.800 peak  1123 spectrum    1 weight  0.11000E+01 volume  0.53999E-02 ppm1      2.037 ppm2      2.194 CV     1
 ASSI { 1125}
   (( segid "    " and resid 81   and name HG2 ))
   (( segid "    " and resid 81   and name HG1 ))
      2.000     0.500     0.500 peak  1125 spectrum    1 weight  0.11000E+01 volume  0.36513E-02 ppm1      2.180 ppm2      2.385 CV     1
 ASSI { 1129}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 97   and name HB2 ))
      2.900     1.000     1.000 peak  1129 spectrum    1 weight  0.11000E+01 volume  0.18540E-02 ppm1      4.026 ppm2      2.270 CV     1
 OR { 1129}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 97   and name HB1 ))
 ASSI { 1136}
   (( segid "    " and resid 97   and name HG1 ))
   (( segid "    " and resid 97   and name HG2 ))
      2.300     0.600     0.600 peak  1136 spectrum    1 weight  0.11000E+01 volume  0.35076E-02 ppm1      2.648 ppm2      2.489 CV     1
 ASSI { 1138}
   (( segid "    " and resid 97   and name HG2 ))
   (( segid "    " and resid 97   and name HB1 ))
      2.600     0.900     0.900 peak  1138 spectrum    1 weight  0.11000E+01 volume  0.36421E-02 ppm1      2.462 ppm2      2.264 CV     1
 OR { 1138}
   (( segid "    " and resid 97   and name HG2 ))
   (( segid "    " and resid 97   and name HB2 ))
 ASSI { 1148}
   (( segid "    " and resid 125  and name HB1 ))
   (( segid "    " and resid 125  and name HB2 ))
      2.000     0.500     0.500 peak  1148 spectrum    1 weight  0.11000E+01 volume  0.95243E-02 ppm1      2.262 ppm2      2.131 CV     1
 ASSI { 1154}
   (( segid "    " and resid 125  and name HG1 ))
   (( segid "    " and resid 125  and name HG2 ))
      2.200     0.600     0.600 peak  1154 spectrum    1 weight  0.11000E+01 volume  0.44871E-02 ppm1      2.555 ppm2      2.426 CV     1
 ASSI { 1161}
   (( segid "    " and resid 125  and name HB1 ))
   (( segid "    " and resid 125  and name HG1 ))
      3.700     1.800     1.800 peak  1161 spectrum    1 weight  0.11000E+01 volume  0.12658E-02 ppm1      2.262 ppm2      2.540 CV     1
 ASSI { 1170}
   (( segid "    " and resid 7    and name HG2 ))
   (( segid "    " and resid 7    and name HA  ))
      4.000     2.000     2.000 peak  1170 spectrum    1 weight  0.11000E+01 volume  0.84161E-03 ppm1      2.050 ppm2      4.294 CV     1
 ASSI { 1172}
   (( segid "    " and resid 10   and name HG1 ))
   (( segid "    " and resid 10   and name HG2 ))
      1.700     1.700     4.300 peak  1172 spectrum    1 weight  0.11000E+01 volume  0.37669E-01 ppm1      2.253 ppm2      2.215 CV     1
 ASSI { 1173}
   (( segid "    " and resid 7    and name HG2 ))
   (( segid "    " and resid 7    and name HB1 ))
      1.600     1.600     4.400 peak  1173 spectrum    1 weight  0.11000E+01 volume  0.10212E+00 ppm1      2.050 ppm2      2.057 CV     1
 ASSI { 1174}
   (( segid "    " and resid 7    and name HG2 ))
   (( segid "    " and resid 7    and name HG1 ))
      2.300     0.600     0.600 peak  1174 spectrum    1 weight  0.11000E+01 volume  0.54945E-02 ppm1      2.051 ppm2      2.217 CV     1
 ASSI { 1175}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 7    and name HG1 ))
      3.900     3.900     2.100 peak  1175 spectrum    1 weight  0.11000E+01 volume  0.82384E-03 ppm1      4.293 ppm2      2.208 CV     1
 ASSI { 1177}
   (( segid "    " and resid 7    and name HG2 ))
   (( segid "    " and resid 7    and name HB2 ))
      2.800     1.000     1.000 peak  1177 spectrum    1 weight  0.11000E+01 volume  0.62829E-02 ppm1      2.051 ppm2      1.942 CV     1
 ASSI { 1179}
   (( segid "    " and resid 26   and name HA  ))
   (( segid "    " and resid 26   and name HB1 ))
      4.100     2.100     1.900 peak  1179 spectrum    1 weight  0.11000E+01 volume  0.40631E-03 ppm1      4.562 ppm2      1.912 CV     1
 OR { 1179}
   (( segid "    " and resid 26   and name HA  ))
   (( segid "    " and resid 26   and name HB2 ))
 ASSI { 1180}
   (( segid "    " and resid 26   and name HA  ))
   (( segid "    " and resid 26   and name HG2 ))
      5.000     3.200     1.000 peak  1180 spectrum    1 weight  0.11000E+01 volume  0.20448E-03 ppm1      4.546 ppm2      2.315 CV     1
 OR { 1180}
   (( segid "    " and resid 26   and name HA  ))
   (( segid "    " and resid 26   and name HG1 ))
 ASSI { 1182}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 7    and name HB2 ))
      3.300     1.300     1.300 peak  1182 spectrum    1 weight  0.11000E+01 volume  0.22513E-02 ppm1      4.274 ppm2      1.947 CV     1
 ASSI { 1183}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 7    and name HB1 ))
      3.200     1.300     1.300 peak  1183 spectrum    1 weight  0.11000E+01 volume  0.21385E-02 ppm1      4.283 ppm2      2.067 CV     1
 ASSI { 1184}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 73   and name HA  ))
      2.900     1.000     1.000 peak  1184 spectrum    1 weight  0.11000E+01 volume  0.18714E-02 ppm1      3.723 ppm2      5.546 CV     1
 OR { 1184}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 73   and name HA  ))
 ASSI { 1205}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 82   and name HA  ))
      2.100     0.600     0.600 peak  1205 spectrum    1 weight  0.11000E+01 volume  0.99658E-02 ppm1      5.057 ppm2      5.060 CV     1
 OR { 1205}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 71   and name HA  ))
 ASSI { 1206}
   (( segid "    " and resid 82   and name HG1 ))
   (( segid "    " and resid 82   and name HG2 ))
      1.800     0.400     0.400 peak  1206 spectrum    1 weight  0.11000E+01 volume  0.21970E-01 ppm1      2.212 ppm2      2.050 CV     1
 OR { 1206}
   (( segid "    " and resid 82   and name HG1 ))
   (( segid "    " and resid 82   and name HB2 ))
 ASSI { 1209}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 82   and name HB1 ))
      2.500     2.500     3.500 peak  1209 spectrum    1 weight  0.11000E+01 volume  0.32218E-01 ppm1      2.094 ppm2      2.089 CV     1
 OR { 1209}
   (( segid "    " and resid 82   and name HB1 ))
   (( segid "    " and resid 71   and name HB1 ))
 ASSI { 1219}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 73   and name HB2 ))
      1.900     0.400     0.400 peak  1219 spectrum    1 weight  0.11000E+01 volume  0.12005E-01 ppm1      3.722 ppm2      3.725 CV     1
 OR { 1219}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 73   and name HB1 ))
 ASSI { 1220}
   (( segid "    " and resid 13   and name HA2 ))
   (( segid "    " and resid 13   and name HA1 ))
      1.300     0.200     0.900 peak  1220 spectrum    1 weight  0.11000E+01 volume  0.14556E+00 ppm1      3.942 ppm2      3.943 CV     1
 OR { 1220}
   (( segid "    " and resid 13   and name HA1 ))
   (( segid "    " and resid 13   and name HA2 ))
 ASSI { 1221}
   (( segid "    " and resid 75   and name HB2 ))
   (( segid "    " and resid 75   and name HB1 ))
      1.200     0.200     1.000 peak  1221 spectrum    1 weight  0.11000E+01 volume  0.15552E+00 ppm1      2.047 ppm2      2.044 CV     1
 OR { 1221}
   (( segid "    " and resid 75   and name HB1 ))
   (( segid "    " and resid 75   and name HB2 ))
 ASSI { 1222}
   (( segid "    " and resid 75   and name HG2 ))
   (( segid "    " and resid 75   and name HG1 ))
      1.100     0.200     1.100 peak  1222 spectrum    1 weight  0.11000E+01 volume  0.30540E+00 ppm1      2.237 ppm2      2.257 CV     1
 OR { 1222}
   (( segid "    " and resid 75   and name HG1 ))
   (( segid "    " and resid 75   and name HG2 ))
 ASSI { 1224}
   (( segid "    " and resid 82   and name HB2 ))
   (( segid "    " and resid 82   and name HG2 ))
      2.300     0.600     0.600 peak  1224 spectrum    1 weight  0.11000E+01 volume  0.37701E-01 ppm1      2.041 ppm2      2.037 CV     1
 ASSI { 1225}
   (( segid "    " and resid 83   and name HG1 ))
   (( segid "    " and resid 83   and name HG2 ))
      1.300     0.200     0.900 peak  1225 spectrum    1 weight  0.11000E+01 volume  0.81687E-01 ppm1      2.184 ppm2      2.188 CV     1
 OR { 1225}
   (( segid "    " and resid 83   and name HG2 ))
   (( segid "    " and resid 83   and name HG1 ))
 ASSI { 1226}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 85   and name HG1 ))
      1.200     0.200     1.000 peak  1226 spectrum    1 weight  0.11000E+01 volume  0.10505E+00 ppm1      2.049 ppm2      2.050 CV     1
 OR { 1226}
   (( segid "    " and resid 85   and name HG1 ))
   (( segid "    " and resid 85   and name HG2 ))
 ASSI { 1228}
   (( segid "    " and resid 93   and name HB2 ))
   (( segid "    " and resid 93   and name HB1 ))
      2.100     0.500     0.500 peak  1228 spectrum    1 weight  0.11000E+01 volume  0.90113E-02 ppm1      3.196 ppm2      3.199 CV     1
 OR { 1228}
   (( segid "    " and resid 93   and name HB1 ))
   (( segid "    " and resid 93   and name HB2 ))
 ASSI { 1229}
   (( segid "    " and resid 38   and name HB2 ))
   (( segid "    " and resid 38   and name HB1 ))
      2.500     2.500     3.500 peak  1229 spectrum    1 weight  0.11000E+01 volume  0.18649E-02 ppm1      2.570 ppm2      2.567 CV     1
 OR { 1229}
   (( segid "    " and resid 38   and name HB1 ))
   (( segid "    " and resid 38   and name HB2 ))
 ASSI { 1230}
   (( segid "    " and resid 94   and name HB2 ))
   (( segid "    " and resid 94   and name HB1 ))
      1.600     0.300     0.600 peak  1230 spectrum    1 weight  0.11000E+01 volume  0.24603E-01 ppm1      2.764 ppm2      2.766 CV     1
 OR { 1230}
   (( segid "    " and resid 94   and name HB1 ))
   (( segid "    " and resid 94   and name HB2 ))
 ASSI { 1231}
   (( segid "    " and resid 97   and name HB2 ))
   (( segid "    " and resid 97   and name HB1 ))
      1.600     0.300     0.600 peak  1231 spectrum    1 weight  0.11000E+01 volume  0.23542E-01 ppm1      2.266 ppm2      2.266 CV     1
 OR { 1231}
   (( segid "    " and resid 97   and name HB1 ))
   (( segid "    " and resid 97   and name HB2 ))
 ASSI { 1233}
   (( segid "    " and resid 26   and name HG2 ))
   (( segid "    " and resid 26   and name HG1 ))
      1.100     0.200     1.100 peak  1233 spectrum    1 weight  0.11000E+01 volume  0.38456E+00 ppm1      2.282 ppm2      2.282 CV     1
 OR { 1233}
   (( segid "    " and resid 26   and name HG1 ))
   (( segid "    " and resid 26   and name HG2 ))
 ASSI { 1235}
   (( segid "    " and resid 10   and name HA  ))
   (( segid "    " and resid 10   and name HG1 ))
      4.100     4.100     1.900 peak  1235 spectrum    1 weight  0.11000E+01 volume  0.88237E-03 ppm1      4.292 ppm2      2.209 CV     1
 OR { 1235}
   (( segid "    " and resid 10   and name HA  ))
   (( segid "    " and resid 10   and name HG2 ))
 ASSI { 1237}
   (( segid "    " and resid 104  and name HD2 ))
   (( segid "    " and resid 104  and name HD1 ))
      2.300     0.600     0.600 peak  1237 spectrum    1 weight  0.11000E+01 volume  0.11564E-02 ppm1      3.131 ppm2      3.653 CV     1
 ASSI { 1242}
   (( segid "    " and resid 104  and name HG1 ))
   (( segid "    " and resid 104  and name HD2 ))
      3.800     1.800     1.800 peak  1242 spectrum    1 weight  0.11000E+01 volume  0.53890E-03 ppm1      2.119 ppm2      3.130 CV     1
 ASSI { 1244}
   (( segid "    " and resid 104  and name HG2 ))
   (( segid "    " and resid 104  and name HD2 ))
      3.300     1.400     1.400 peak  1244 spectrum    1 weight  0.11000E+01 volume  0.37482E-03 ppm1      1.801 ppm2      3.127 CV     1
 ASSI { 1245}
   (( segid "    " and resid 104  and name HG2 ))
   (( segid "    " and resid 104  and name HD1 ))
      3.900     1.900     1.900 peak  1245 spectrum    1 weight  0.11000E+01 volume  0.41616E-03 ppm1      1.783 ppm2      3.632 CV     1
 ASSI { 1246}
   (( segid "    " and resid 104  and name HG1 ))
   (( segid "    " and resid 104  and name HD1 ))
      2.900     1.000     1.000 peak  1246 spectrum    1 weight  0.11000E+01 volume  0.67263E-03 ppm1      2.114 ppm2      3.652 CV     1
 ASSI { 1254}
   (( segid "    " and resid 104  and name HA  ))
   (( segid "    " and resid 104  and name HD1 ))
      5.400     3.700     0.600 peak  1254 spectrum    1 weight  0.11000E+01 volume  0.53760E-04 ppm1      4.342 ppm2      3.659 CV     1
 ASSI { 1255}
   (( segid "    " and resid 104  and name HG1 ))
   (( segid "    " and resid 104  and name HG2 ))
      2.300     0.700     0.700 peak  1255 spectrum    1 weight  0.11000E+01 volume  0.16765E-02 ppm1      2.118 ppm2      1.797 CV     1
 ASSI { 1257}
   (( segid "    " and resid 104  and name HB1 ))
   (( segid "    " and resid 104  and name HB2 ))
      2.500     0.800     0.800 peak  1257 spectrum    1 weight  0.11000E+01 volume  0.20182E-02 ppm1      2.431 ppm2      1.650 CV     1
 ASSI { 1265}
   (( segid "    " and resid 104  and name HB2 ))
   (( segid "    " and resid 104  and name HD1 ))
      5.200     3.400     0.800 peak  1265 spectrum    1 weight  0.11000E+01 volume  0.21388E-03 ppm1      1.636 ppm2      3.639 CV     1
 ASSI { 1266}
   (( segid "    " and resid 104  and name HB2 ))
   (( segid "    " and resid 104  and name HD2 ))
      5.500     3.700     0.500 peak  1266 spectrum    1 weight  0.11000E+01 volume  0.14186E-03 ppm1      1.645 ppm2      3.125 CV     1
 ASSI { 1268}
   (( segid "    " and resid 104  and name HB1 ))
   (( segid "    " and resid 104  and name HG2 ))
      3.900     1.900     1.900 peak  1268 spectrum    1 weight  0.11000E+01 volume  0.85852E-03 ppm1      2.428 ppm2      1.809 CV     1
 ASSI { 1271}
   (( segid "    " and resid 104  and name HG2 ))
   (( segid "    " and resid 104  and name HB2 ))
      2.600     0.800     0.800 peak  1271 spectrum    1 weight  0.11000E+01 volume  0.26699E-02 ppm1      1.784 ppm2      1.647 CV     1
 ASSI { 1273}
   (( segid "    " and resid 104  and name HG1 ))
   (( segid "    " and resid 104  and name HB1 ))
      3.100     1.200     1.200 peak  1273 spectrum    1 weight  0.11000E+01 volume  0.78047E-03 ppm1      2.117 ppm2      2.447 CV     1
 ASSI { 1274}
   (( segid "    " and resid 104  and name HG1 ))
   (( segid "    " and resid 104  and name HA  ))
      5.300     3.600     0.700 peak  1274 spectrum    1 weight  0.11000E+01 volume  0.20761E-03 ppm1      2.116 ppm2      4.311 CV     1
 ASSI { 1276}
   (( segid "    " and resid 104  and name HD2 ))
   (( segid "    " and resid 104  and name HA  ))
      5.800     4.200     0.200 peak  1276 spectrum    1 weight  0.11000E+01 volume  0.87457E-04 ppm1      3.129 ppm2      4.341 CV     1
 ASSI { 1277}
   (( segid "    " and resid 104  and name HD1 ))
   (( segid "    " and resid 104  and name HB1 ))
      5.400     3.600     0.600 peak  1277 spectrum    1 weight  0.11000E+01 volume  0.78530E-04 ppm1      3.635 ppm2      2.417 CV     1
 ASSI { 1278}
   (( segid "    " and resid 104  and name HD2 ))
   (( segid "    " and resid 104  and name HB1 ))
      6.000     4.500     0.000 peak  1278 spectrum    1 weight  0.11000E+01 volume  0.11709E-03 ppm1      3.111 ppm2      2.436 CV     1
 ASSI { 1281}
   (( segid "    " and resid 84   and name HG2 ))
   (( segid "    " and resid 84   and name HA  ))
      3.700     1.700     1.700 peak  1281 spectrum    1 weight  0.11000E+01 volume  0.29070E-02 ppm1      2.029 ppm2      4.421 CV     1
 OR { 1281}
   (( segid "    " and resid 84   and name HG1 ))
   (( segid "    " and resid 84   and name HA  ))
 ASSI { 1283}
   (( segid "    " and resid 84   and name HD2 ))
   (( segid "    " and resid 84   and name HG2 ))
      2.300     0.700     0.700 peak  1283 spectrum    1 weight  0.11000E+01 volume  0.62452E-02 ppm1      3.660 ppm2      2.031 CV     1
 ASSI { 1284}
   (( segid "    " and resid 84   and name HG1 ))
   (( segid "    " and resid 84   and name HD1 ))
      2.300     0.600     0.600 peak  1284 spectrum    1 weight  0.11000E+01 volume  0.11892E-01 ppm1      2.031 ppm2      3.813 CV     1
 OR { 1284}
   (( segid "    " and resid 84   and name HG2 ))
   (( segid "    " and resid 84   and name HD1 ))
 ASSI { 1285}
   (( segid "    " and resid 84   and name HG2 ))
   (( segid "    " and resid 84   and name HD2 ))
      2.500     0.800     0.800 peak  1285 spectrum    1 weight  0.11000E+01 volume  0.59795E-02 ppm1      2.034 ppm2      3.651 CV     1
 OR { 1285}
   (( segid "    " and resid 84   and name HG1 ))
   (( segid "    " and resid 84   and name HD2 ))
 ASSI { 1293}
   (( segid "    " and resid 84   and name HG1 ))
   (( segid "    " and resid 84   and name HG2 ))
      1.000     0.100     1.200 peak  1293 spectrum    1 weight  0.11000E+01 volume  0.52309E+00 ppm1      2.038 ppm2      2.034 CV     1
 OR { 1293}
   (( segid "    " and resid 84   and name HG2 ))
   (( segid "    " and resid 84   and name HG1 ))
 ASSI { 1296}
   (( segid "    " and resid 84   and name HB2 ))
   (( segid "    " and resid 84   and name HD1 ))
      4.200     2.200     1.800 peak  1296 spectrum    1 weight  0.11000E+01 volume  0.18564E-02 ppm1      1.914 ppm2      3.813 CV     1
 ASSI { 1297}
   (( segid "    " and resid 84   and name HB1 ))
   (( segid "    " and resid 84   and name HD1 ))
      3.200     1.300     1.300 peak  1297 spectrum    1 weight  0.11000E+01 volume  0.20382E-02 ppm1      2.295 ppm2      3.813 CV     1
 ASSI { 1299}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 84   and name HB2 ))
      3.100     1.200     1.200 peak  1299 spectrum    1 weight  0.11000E+01 volume  0.24056E-02 ppm1      4.417 ppm2      1.911 CV     1
 ASSI { 1300}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 84   and name HB1 ))
      2.500     0.800     0.800 peak  1300 spectrum    1 weight  0.11000E+01 volume  0.42809E-02 ppm1      4.413 ppm2      2.297 CV     1
 ASSI { 1302}
   (( segid "    " and resid 84   and name HB1 ))
   (( segid "    " and resid 84   and name HG1 ))
      2.300     0.600     0.600 peak  1302 spectrum    1 weight  0.11000E+01 volume  0.13184E-01 ppm1      2.291 ppm2      2.038 CV     1
 OR { 1302}
   (( segid "    " and resid 84   and name HB1 ))
   (( segid "    " and resid 84   and name HG2 ))
 ASSI { 1303}
   (( segid "    " and resid 84   and name HB2 ))
   (( segid "    " and resid 84   and name HG2 ))
      2.200     0.600     0.600 peak  1303 spectrum    1 weight  0.11000E+01 volume  0.15174E-01 ppm1      1.911 ppm2      2.020 CV     1
 OR { 1303}
   (( segid "    " and resid 84   and name HB2 ))
   (( segid "    " and resid 84   and name HG1 ))
 ASSI { 1307}
   (( segid "    " and resid 84   and name HD2 ))
   (( segid "    " and resid 84   and name HB2 ))
      3.900     1.900     1.900 peak  1307 spectrum    1 weight  0.11000E+01 volume  0.25262E-02 ppm1      3.663 ppm2      1.916 CV     1
 ASSI { 1309}
   (( segid "    " and resid 84   and name HD2 ))
   (( segid "    " and resid 84   and name HB1 ))
      4.600     2.600     1.400 peak  1309 spectrum    1 weight  0.11000E+01 volume  0.80984E-03 ppm1      3.665 ppm2      2.302 CV     1
 ASSI { 1310}
   (( segid "    " and resid 84   and name HD2 ))
   (( segid "    " and resid 84   and name HA  ))
      4.400     2.500     1.600 peak  1310 spectrum    1 weight  0.11000E+01 volume  0.49863E-03 ppm1      3.652 ppm2      4.425 CV     1
 ASSI { 1311}
   (( segid "    " and resid 84   and name HD1 ))
   (( segid "    " and resid 84   and name HA  ))
      5.000     3.100     1.000 peak  1311 spectrum    1 weight  0.11000E+01 volume  0.19791E-03 ppm1      3.816 ppm2      4.426 CV     1
 ASSI { 1313}
   (( segid "    " and resid 124  and name HB2 ))
   (( segid "    " and resid 124  and name HA  ))
      3.700     1.700     1.700 peak  1313 spectrum    1 weight  0.11000E+01 volume  0.17158E-02 ppm1      1.889 ppm2      3.981 CV     1
 OR { 1313}
   (( segid "    " and resid 124  and name HB2 ))
   (( segid "    " and resid 124  and name HD1 ))
 ASSI { 1314}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 124  and name HD1 ))
      2.500     2.500     3.500 peak  1314 spectrum    1 weight  0.11000E+01 volume  0.14170E-01 ppm1      3.976 ppm2      3.974 CV     1
 ASSI { 1316}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 124  and name HB2 ))
      4.100     2.100     1.900 peak  1316 spectrum    1 weight  0.11000E+01 volume  0.11022E-02 ppm1      3.987 ppm2      1.886 CV     1
 OR { 1316}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 124  and name HG2 ))
 ASSI { 1319}
   (( segid "    " and resid 124  and name HB2 ))
   (( segid "    " and resid 124  and name HB1 ))
      2.200     0.600     0.600 peak  1319 spectrum    1 weight  0.11000E+01 volume  0.52265E-02 ppm1      1.908 ppm2      2.108 CV     1
 ASSI { 1320}
   (( segid "    " and resid 124  and name HB1 ))
   (( segid "    " and resid 124  and name HB2 ))
      2.200     0.600     0.600 peak  1320 spectrum    1 weight  0.11000E+01 volume  0.69666E-02 ppm1      2.113 ppm2      1.890 CV     1
 OR { 1320}
   (( segid "    " and resid 124  and name HB1 ))
   (( segid "    " and resid 124  and name HG2 ))
 ASSI { 1322}
   (( segid "    " and resid 124  and name HB2 ))
   (( segid "    " and resid 124  and name HD2 ))
      4.000     2.000     2.000 peak  1322 spectrum    1 weight  0.11000E+01 volume  0.60852E-03 ppm1      1.917 ppm2      3.582 CV     1
 ASSI { 1323}
   (( segid "    " and resid 124  and name HG1 ))
   (( segid "    " and resid 124  and name HD1 ))
      3.100     1.200     1.200 peak  1323 spectrum    1 weight  0.11000E+01 volume  0.12477E-02 ppm1      2.079 ppm2      3.957 CV     1
 OR { 1323}
   (( segid "    " and resid 124  and name HG1 ))
   (( segid "    " and resid 124  and name HA  ))
 ASSI { 1325}
   (( segid "    " and resid 124  and name HG2 ))
   (( segid "    " and resid 124  and name HD2 ))
      3.100     1.200     1.200 peak  1325 spectrum    1 weight  0.11000E+01 volume  0.10318E-02 ppm1      1.866 ppm2      3.581 CV     1
 ASSI { 1326}
   (( segid "    " and resid 124  and name HD2 ))
   (( segid "    " and resid 124  and name HD1 ))
      2.200     0.600     0.600 peak  1326 spectrum    1 weight  0.11000E+01 volume  0.34548E-02 ppm1      3.571 ppm2      3.937 CV     1
 ASSI { 1330}
   (( segid "    " and resid 124  and name HG1 ))
   (( segid "    " and resid 124  and name HD2 ))
      3.700     1.700     1.700 peak  1330 spectrum    1 weight  0.11000E+01 volume  0.16476E-02 ppm1      2.078 ppm2      3.585 CV     1
 ASSI { 1331}
   (( segid "    " and resid 124  and name HG2 ))
   (( segid "    " and resid 124  and name HG1 ))
      2.000     2.000     4.000 peak  1331 spectrum    1 weight  0.11000E+01 volume  0.84137E-02 ppm1      1.861 ppm2      2.019 CV     1
 ASSI { 1332}
   (( segid "    " and resid 124  and name HG2 ))
   (( segid "    " and resid 124  and name HB2 ))
      2.100     0.500     0.500 peak  1332 spectrum    1 weight  0.11000E+01 volume  0.15865E-01 ppm1      1.861 ppm2      1.870 CV     1
 ASSI { 1333}
   (( segid "    " and resid 124  and name HG2 ))
   (( segid "    " and resid 124  and name HB1 ))
      3.500     1.500     1.500 peak  1333 spectrum    1 weight  0.11000E+01 volume  0.18028E-02 ppm1      1.861 ppm2      2.118 CV     1
 ASSI { 1334}
   (( segid "    " and resid 124  and name HG1 ))
   (( segid "    " and resid 124  and name HB1 ))
      1.300     1.300     4.700 peak  1334 spectrum    1 weight  0.11000E+01 volume  0.20008E+00 ppm1      2.087 ppm2      2.052 CV     1
 ASSI { 1335}
   (( segid "    " and resid 124  and name HG1 ))
   (( segid "    " and resid 124  and name HG2 ))
      2.300     2.300     3.700 peak  1335 spectrum    1 weight  0.11000E+01 volume  0.50919E-02 ppm1      2.087 ppm2      1.921 CV     1
 OR { 1335}
   (( segid "    " and resid 124  and name HG1 ))
   (( segid "    " and resid 124  and name HB2 ))
 ASSI { 1336}
   (( segid "    " and resid 124  and name HD1 ))
   (( segid "    " and resid 124  and name HG2 ))
      4.200     2.200     1.800 peak  1336 spectrum    1 weight  0.11000E+01 volume  0.57731E-03 ppm1      3.931 ppm2      1.874 CV     1
 OR { 1336}
   (( segid "    " and resid 124  and name HD1 ))
   (( segid "    " and resid 124  and name HB2 ))
 ASSI { 1337}
   (( segid "    " and resid 124  and name HD1 ))
   (( segid "    " and resid 124  and name HG1 ))
      3.200     3.200     2.800 peak  1337 spectrum    1 weight  0.11000E+01 volume  0.80776E-03 ppm1      3.928 ppm2      2.015 CV     1
 ASSI { 1338}
   (( segid "    " and resid 124  and name HD1 ))
   (( segid "    " and resid 124  and name HB1 ))
      4.400     2.500     1.600 peak  1338 spectrum    1 weight  0.11000E+01 volume  0.81596E-03 ppm1      3.926 ppm2      2.090 CV     1
 ASSI { 1339}
   (( segid "    " and resid 124  and name HD2 ))
   (( segid "    " and resid 124  and name HB1 ))
      4.300     2.300     1.700 peak  1339 spectrum    1 weight  0.11000E+01 volume  0.12005E-02 ppm1      3.569 ppm2      2.095 CV     1
 ASSI { 1341}
   (( segid "    " and resid 124  and name HD2 ))
   (( segid "    " and resid 124  and name HG2 ))
      3.300     1.400     1.400 peak  1341 spectrum    1 weight  0.11000E+01 volume  0.90179E-03 ppm1      3.582 ppm2      1.874 CV     1
 OR { 1341}
   (( segid "    " and resid 124  and name HD2 ))
   (( segid "    " and resid 124  and name HB2 ))
 ASSI { 1342}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 124  and name HG1 ))
      4.500     4.500     1.500 peak  1342 spectrum    1 weight  0.11000E+01 volume  0.47465E-03 ppm1      3.992 ppm2      2.018 CV     1
 ASSI { 1343}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 124  and name HD2 ))
      5.600     3.900     0.400 peak  1343 spectrum    1 weight  0.11000E+01 volume  0.14291E-03 ppm1      3.983 ppm2      3.587 CV     1
 ASSI { 1345}
   (( segid "    " and resid 124  and name HB2 ))
   (( segid "    " and resid 124  and name HG1 ))
      2.900     2.900     3.100 peak  1345 spectrum    1 weight  0.11000E+01 volume  0.71174E-02 ppm1      1.909 ppm2      2.021 CV     1
 ASSI { 1346}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 52   and name HB2 ))
      3.000     1.100     1.100 peak  1346 spectrum    1 weight  0.11000E+01 volume  0.25490E-02 ppm1      4.417 ppm2      1.911 CV     1
 ASSI { 1347}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 52   and name HB1 ))
      2.400     0.700     0.700 peak  1347 spectrum    1 weight  0.11000E+01 volume  0.48358E-02 ppm1      4.414 ppm2      2.291 CV     1
 ASSI { 1348}
   (( segid "    " and resid 52   and name HG1 ))
   (( segid "    " and resid 52   and name HA  ))
      4.200     2.200     1.800 peak  1348 spectrum    1 weight  0.11000E+01 volume  0.12722E-02 ppm1      2.033 ppm2      4.421 CV     1
 ASSI { 1349}
   (( segid "    " and resid 52   and name HG1 ))
   (( segid "    " and resid 52   and name HB1 ))
      2.300     0.700     0.700 peak  1349 spectrum    1 weight  0.11000E+01 volume  0.57737E-02 ppm1      2.063 ppm2      2.307 CV     1
 ASSI { 1355}
   (( segid "    " and resid 130  and name HB1 ))
   (( segid "    " and resid 130  and name HD2 ))
      5.100     3.300     0.900 peak  1355 spectrum    1 weight  0.11000E+01 volume  0.30233E-03 ppm1      2.359 ppm2      3.395 CV     1
 ASSI { 1356}
   (( segid "    " and resid 130  and name HB2 ))
   (( segid "    " and resid 130  and name HD1 ))
      5.700     4.000     0.300 peak  1356 spectrum    1 weight  0.11000E+01 volume  0.24895E-03 ppm1      1.757 ppm2      3.504 CV     1
 ASSI { 1357}
   (( segid "    " and resid 130  and name HB2 ))
   (( segid "    " and resid 130  and name HD2 ))
      4.800     2.900     1.200 peak  1357 spectrum    1 weight  0.11000E+01 volume  0.22418E-03 ppm1      1.751 ppm2      3.398 CV     1
 ASSI { 1358}
   (( segid "    " and resid 130  and name HB2 ))
   (( segid "    " and resid 130  and name HB1 ))
      2.400     0.700     0.700 peak  1358 spectrum    1 weight  0.11000E+01 volume  0.28197E-02 ppm1      1.756 ppm2      2.362 CV     1
 ASSI { 1359}
   (( segid "    " and resid 130  and name HB1 ))
   (( segid "    " and resid 130  and name HB2 ))
      2.400     0.700     0.700 peak  1359 spectrum    1 weight  0.11000E+01 volume  0.27641E-02 ppm1      2.358 ppm2      1.761 CV     1
 OR { 1359}
   (( segid "    " and resid 130  and name HB1 ))
   (( segid "    " and resid 130  and name HG1 ))
 ASSI { 1362}
   (( segid "    " and resid 130  and name HD1 ))
   (( segid "    " and resid 130  and name HD2 ))
      2.100     0.500     0.500 peak  1362 spectrum    1 weight  0.11000E+01 volume  0.35725E-02 ppm1      3.497 ppm2      3.391 CV     1
 ASSI { 1366}
   (( segid "    " and resid 130  and name HD1 ))
   (( segid "    " and resid 130  and name HB1 ))
      4.800     2.800     1.200 peak  1366 spectrum    1 weight  0.11000E+01 volume  0.40995E-03 ppm1      3.501 ppm2      2.364 CV     1
 ASSI { 1368}
   (( segid "    " and resid 130  and name HD1 ))
   (( segid "    " and resid 130  and name HG1 ))
      3.000     1.200     1.200 peak  1368 spectrum    1 weight  0.11000E+01 volume  0.11689E-02 ppm1      3.497 ppm2      1.784 CV     1
 OR { 1368}
   (( segid "    " and resid 130  and name HD1 ))
   (( segid "    " and resid 130  and name HB2 ))
 ASSI { 1369}
   (( segid "    " and resid 130  and name HD2 ))
   (( segid "    " and resid 130  and name HG1 ))
      3.700     1.700     1.700 peak  1369 spectrum    1 weight  0.11000E+01 volume  0.11958E-02 ppm1      3.390 ppm2      1.783 CV     1
 OR { 1369}
   (( segid "    " and resid 130  and name HD2 ))
   (( segid "    " and resid 130  and name HB2 ))
 ASSI { 1370}
   (( segid "    " and resid 130  and name HA  ))
   (( segid "    " and resid 130  and name HB2 ))
      5.500     3.800     0.500 peak  1370 spectrum    1 weight  0.11000E+01 volume  0.10326E-03 ppm1      4.741 ppm2      1.776 CV     1
 OR { 1370}
   (( segid "    " and resid 130  and name HA  ))
   (( segid "    " and resid 130  and name HG1 ))
 ASSI { 1371}
   (( segid "    " and resid 130  and name HA  ))
   (( segid "    " and resid 130  and name HB1 ))
      3.900     2.000     2.000 peak  1371 spectrum    1 weight  0.11000E+01 volume  0.36987E-03 ppm1      4.723 ppm2      2.366 CV     1
 ASSI { 1372}
   (( segid "    " and resid 130  and name HG2 ))
   (( segid "    " and resid 130  and name HD1 ))
      3.500     1.500     1.500 peak  1372 spectrum    1 weight  0.11000E+01 volume  0.10765E-02 ppm1      1.461 ppm2      3.501 CV     1
 ASSI { 1373}
   (( segid "    " and resid 130  and name HG1 ))
   (( segid "    " and resid 130  and name HD2 ))
      3.600     1.700     1.700 peak  1373 spectrum    1 weight  0.11000E+01 volume  0.12376E-02 ppm1      1.786 ppm2      3.392 CV     1
 ASSI { 1374}
   (( segid "    " and resid 130  and name HG1 ))
   (( segid "    " and resid 130  and name HD1 ))
      2.900     1.000     1.000 peak  1374 spectrum    1 weight  0.11000E+01 volume  0.13032E-02 ppm1      1.790 ppm2      3.502 CV     1
 ASSI { 1376}
   (( segid "    " and resid 130  and name HG1 ))
   (( segid "    " and resid 130  and name HB2 ))
      2.900     1.000     1.000 peak  1376 spectrum    1 weight  0.11000E+01 volume  0.63919E-02 ppm1      1.784 ppm2      1.787 CV     1
 ASSI { 1377}
   (( segid "    " and resid 130  and name HG1 ))
   (( segid "    " and resid 130  and name HG2 ))
      2.200     0.600     0.600 peak  1377 spectrum    1 weight  0.11000E+01 volume  0.32274E-02 ppm1      1.784 ppm2      1.468 CV     1
 ASSI { 1379}
   (( segid "    " and resid 130  and name HG2 ))
   (( segid "    " and resid 130  and name HG1 ))
      2.200     0.600     0.600 peak  1379 spectrum    1 weight  0.11000E+01 volume  0.42261E-02 ppm1      1.449 ppm2      1.783 CV     1
 OR { 1379}
   (( segid "    " and resid 130  and name HG2 ))
   (( segid "    " and resid 130  and name HB2 ))
 ASSI { 1382}
   (( segid "    " and resid 130  and name HB1 ))
   (( segid "    " and resid 130  and name HG2 ))
      4.500     2.500     1.500 peak  1382 spectrum    1 weight  0.11000E+01 volume  0.43395E-03 ppm1      2.352 ppm2      1.465 CV     1
 ASSI { 1383}
   (( segid "    " and resid 130  and name HB2 ))
   (( segid "    " and resid 130  and name HG2 ))
      3.400     1.400     1.400 peak  1383 spectrum    1 weight  0.11000E+01 volume  0.61527E-03 ppm1      1.746 ppm2      1.476 CV     1
 ASSI { 1384}
   (( segid "    " and resid 130  and name HG1 ))
   (( segid "    " and resid 130  and name HB1 ))
      3.200     1.300     1.300 peak  1384 spectrum    1 weight  0.11000E+01 volume  0.88504E-03 ppm1      1.787 ppm2      2.362 CV     1
 ASSI { 1387}
   (( segid "    " and resid 130  and name HD2 ))
   (( segid "    " and resid 130  and name HG2 ))
      3.000     1.100     1.100 peak  1387 spectrum    1 weight  0.11000E+01 volume  0.83480E-03 ppm1      3.395 ppm2      1.463 CV     1
 ASSI { 1388}
   (( segid "    " and resid 130  and name HD1 ))
   (( segid "    " and resid 130  and name HA  ))
      4.100     2.100     1.900 peak  1388 spectrum    1 weight  0.11000E+01 volume  0.83126E-03 ppm1      3.521 ppm2      4.726 CV     1
 ASSI { 1389}
   (( segid "    " and resid 130  and name HD2 ))
   (( segid "    " and resid 130  and name HA  ))
      4.800     2.800     1.200 peak  1389 spectrum    1 weight  0.11000E+01 volume  0.17284E-03 ppm1      3.396 ppm2      4.729 CV     1
 ASSI { 1390}
   (( segid "    " and resid 60   and name HB1 ))
   (( segid "    " and resid 60   and name HA  ))
      4.400     4.400     1.600 peak  1390 spectrum    1 weight  0.11000E+01 volume  0.17965E-03 ppm1      2.019 ppm2      4.898 CV     1
 OR { 1390}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 60   and name HA  ))
 ASSI { 1391}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 60   and name HB1 ))
      1.400     0.200     0.800 peak  1391 spectrum    1 weight  0.11000E+01 volume  0.45979E-01 ppm1      1.989 ppm2      1.995 CV     1
 OR { 1391}
   (( segid "    " and resid 60   and name HB1 ))
   (( segid "    " and resid 60   and name HB2 ))
 ASSI { 1392}
   (( segid "    " and resid 120  and name HA  ))
   (  segid "    " and resid 120  and name HD% )
      4.400     2.400     1.600 peak  1392 spectrum    1 weight  0.11000E+01 volume  0.23056E-03 ppm1      4.704 ppm2      6.943 CV     1
 ASSI { 1398}
   (( segid "    " and resid 36   and name HB2 ))
   (( segid "    " and resid 36   and name HB1 ))
      1.800     0.400     0.400 peak  1398 spectrum    1 weight  0.11000E+01 volume  0.97558E-02 ppm1      2.863 ppm2      3.028 CV     1
 ASSI { 1411}
   (( segid "    " and resid 120  and name HA  ))
   (( segid "    " and resid 120  and name HB2 ))
      5.000     3.100     1.000 peak  1411 spectrum    1 weight  0.11000E+01 volume  0.15380E-03 ppm1      4.719 ppm2      2.555 CV     1
 ASSI { 1412}
   (( segid "    " and resid 120  and name HA  ))
   (( segid "    " and resid 120  and name HB1 ))
      4.500     2.500     1.500 peak  1412 spectrum    1 weight  0.11000E+01 volume  0.12743E-03 ppm1      4.720 ppm2      3.269 CV     1
 ASSI { 1414}
   (( segid "    " and resid 120  and name HA  ))
   (  segid "    " and resid 120  and name HE% )
      6.000     5.100     0.000 peak  1414 spectrum    1 weight  0.11000E+01 volume  0.84418E-04 ppm1      4.732 ppm2      6.702 CV     1
 ASSI { 1419}
   (( segid "    " and resid 122  and name HB1 ))
   (( segid "    " and resid 122  and name HA  ))
      3.500     1.500     1.500 peak  1419 spectrum    1 weight  0.11000E+01 volume  0.48801E-03 ppm1      3.079 ppm2      4.530 CV     1
 ASSI { 1420}
   (( segid "    " and resid 122  and name HB2 ))
   (( segid "    " and resid 122  and name HA  ))
      4.500     2.500     1.500 peak  1420 spectrum    1 weight  0.11000E+01 volume  0.35833E-03 ppm1      2.720 ppm2      4.529 CV     1
 ASSI { 1445}
   (( segid "    " and resid 69   and name HB2 ))
   (( segid "    " and resid 69   and name HB1 ))
      2.300     0.600     0.600 peak  1445 spectrum    1 weight  0.11000E+01 volume  0.18248E-02 ppm1      3.092 ppm2      3.191 CV     1
 ASSI { 1449}
   (( segid "    " and resid 69   and name HB2 ))
   (( segid "    " and resid 69   and name HE1 ))
      6.000     5.200     0.000 peak  1449 spectrum    1 weight  0.11000E+01 volume  0.98505E-04 ppm1      3.071 ppm2      7.782 CV     1
 ASSI { 1451}
   (( segid "    " and resid 88   and name HB2 ))
   (( segid "    " and resid 88   and name HA  ))
      3.100     1.200     1.200 peak  1451 spectrum    1 weight  0.11000E+01 volume  0.15582E-02 ppm1      3.143 ppm2      4.974 CV     1
 OR { 1451}
   (( segid "    " and resid 88   and name HB1 ))
   (( segid "    " and resid 88   and name HA  ))
 ASSI { 1452}
   (( segid "    " and resid 88   and name HB2 ))
   (( segid "    " and resid 88   and name HB1 ))
      2.000     0.500     0.500 peak  1452 spectrum    1 weight  0.11000E+01 volume  0.48164E-02 ppm1      3.154 ppm2      3.162 CV     1
 OR { 1452}
   (( segid "    " and resid 88   and name HB1 ))
   (( segid "    " and resid 88   and name HB2 ))
 ASSI { 1453}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 88   and name HB2 ))
      3.200     1.300     1.300 peak  1453 spectrum    1 weight  0.11000E+01 volume  0.10640E-02 ppm1      4.967 ppm2      3.134 CV     1
 ASSI { 1462}
   (( segid "    " and resid 19   and name HB1 ))
   (( segid "    " and resid 19   and name HA  ))
      3.400     1.500     1.500 peak  1462 spectrum    1 weight  0.11000E+01 volume  0.16637E-02 ppm1      3.182 ppm2      4.611 CV     1
 ASSI { 1466}
   (( segid "    " and resid 19   and name HB2 ))
   (( segid "    " and resid 19   and name HB1 ))
      2.200     0.600     0.600 peak  1466 spectrum    1 weight  0.11000E+01 volume  0.64004E-02 ppm1      3.066 ppm2      3.175 CV     1
 ASSI { 1470}
   (( segid "    " and resid 19   and name HB2 ))
   (  segid "    " and resid 19   and name HE% )
      6.000     6.000     0.000 peak  1470 spectrum    1 weight  0.11000E+01 volume  0.57484E-04 ppm1      3.058 ppm2      7.370 CV     1
 ASSI { 1471}
   (( segid "    " and resid 19   and name HB2 ))
   (( segid "    " and resid 19   and name HZ  ))
      6.000     6.000     0.000 peak  1471 spectrum    1 weight  0.11000E+01 volume  0.73006E-04 ppm1      3.047 ppm2      7.570 CV     1
 ASSI { 1472}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 46   and name HA  ))
      2.600     2.600     3.400 peak  1472 spectrum    1 weight  0.11000E+01 volume  0.10217E-01 ppm1      5.938 ppm2      5.942 CV     1
 ASSI { 1474}
   (( segid "    " and resid 47   and name HB2 ))
   (( segid "    " and resid 47   and name HB1 ))
      2.000     0.500     0.500 peak  1474 spectrum    1 weight  0.11000E+01 volume  0.50405E-02 ppm1      1.787 ppm2      1.784 CV     1
 OR { 1474}
   (( segid "    " and resid 47   and name HB1 ))
   (( segid "    " and resid 47   and name HB2 ))
 OR { 1474}
   (( segid "    " and resid 47   and name HB1 ))
   (( segid "    " and resid 47   and name HD1 ))
 ASSI { 1475}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 47   and name HB2 ))
      2.800     1.000     1.000 peak  1475 spectrum    1 weight  0.11000E+01 volume  0.19645E-02 ppm1      5.940 ppm2      1.793 CV     1
 OR { 1475}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 47   and name HB1 ))
 ASSI { 1477}
   (( segid "    " and resid 47   and name HG2 ))
   (( segid "    " and resid 47   and name HG1 ))
      1.400     0.200     0.800 peak  1477 spectrum    1 weight  0.11000E+01 volume  0.31673E-01 ppm1      1.384 ppm2      1.383 CV     1
 OR { 1477}
   (( segid "    " and resid 47   and name HG1 ))
   (( segid "    " and resid 47   and name HG2 ))
 ASSI { 1478}
   (( segid "    " and resid 47   and name HG2 ))
   (( segid "    " and resid 47   and name HB2 ))
      2.500     2.500     3.500 peak  1478 spectrum    1 weight  0.11000E+01 volume  0.38629E-02 ppm1      1.420 ppm2      1.780 CV     1
 OR { 1478}
   (( segid "    " and resid 47   and name HG2 ))
   (( segid "    " and resid 47   and name HD1 ))
 OR { 1478}
   (( segid "    " and resid 47   and name HG1 ))
   (( segid "    " and resid 47   and name HB1 ))
 OR { 1478}
   (( segid "    " and resid 47   and name HG1 ))
   (( segid "    " and resid 47   and name HB2 ))
 OR { 1478}
   (( segid "    " and resid 47   and name HG1 ))
   (( segid "    " and resid 47   and name HD1 ))
 ASSI { 1480}
   (( segid "    " and resid 47   and name HB2 ))
   (( segid "    " and resid 47   and name HG2 ))
      2.900     1.100     1.100 peak  1480 spectrum    1 weight  0.11000E+01 volume  0.14305E-02 ppm1      1.802 ppm2      1.387 CV     1
 OR { 1480}
   (( segid "    " and resid 47   and name HB1 ))
   (( segid "    " and resid 47   and name HG1 ))
 OR { 1480}
   (( segid "    " and resid 47   and name HB2 ))
   (( segid "    " and resid 47   and name HG1 ))
 OR { 1480}
   (( segid "    " and resid 47   and name HB1 ))
   (( segid "    " and resid 47   and name HG2 ))
 ASSI { 1486}
   (( segid "    " and resid 47   and name HB1 ))
   (( segid "    " and resid 47   and name HD2 ))
      4.900     2.900     1.100 peak  1486 spectrum    1 weight  0.11000E+01 volume  0.36835E-03 ppm1      1.801 ppm2      1.492 CV     1
 OR { 1486}
   (( segid "    " and resid 47   and name HB2 ))
   (( segid "    " and resid 47   and name HD2 ))
 ASSI { 1489}
   (( segid "    " and resid 47   and name HE1 ))
   (( segid "    " and resid 47   and name HB1 ))
      3.000     3.000     3.000 peak  1489 spectrum    1 weight  0.11000E+01 volume  0.11756E-02 ppm1      2.782 ppm2      1.797 CV     1
 OR { 1489}
   (( segid "    " and resid 47   and name HE2 ))
   (( segid "    " and resid 47   and name HB1 ))
 ASSI { 1491}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 47   and name HE1 ))
      5.800     4.100     0.200 peak  1491 spectrum    1 weight  0.11000E+01 volume  0.17931E-03 ppm1      5.921 ppm2      2.592 CV     1
 OR { 1491}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 47   and name HE2 ))
 ASSI { 1493}
   (( segid "    " and resid 47   and name HE1 ))
   (( segid "    " and resid 47   and name HE2 ))
      1.500     0.300     0.700 peak  1493 spectrum    1 weight  0.11000E+01 volume  0.33017E-01 ppm1      2.579 ppm2      2.583 CV     1
 OR { 1493}
   (( segid "    " and resid 47   and name HE2 ))
   (( segid "    " and resid 47   and name HE1 ))
 ASSI { 1494}
   (( segid "    " and resid 47   and name HB1 ))
   (( segid "    " and resid 47   and name HE1 ))
      3.800     1.800     1.800 peak  1494 spectrum    1 weight  0.11000E+01 volume  0.42709E-03 ppm1      1.784 ppm2      2.584 CV     1
 OR { 1494}
   (( segid "    " and resid 47   and name HB1 ))
   (( segid "    " and resid 47   and name HE2 ))
 OR { 1494}
   (( segid "    " and resid 47   and name HB2 ))
   (( segid "    " and resid 47   and name HE2 ))
 ASSI { 1497}
   (( segid "    " and resid 47   and name HE1 ))
   (( segid "    " and resid 47   and name HB2 ))
      4.400     2.400     1.600 peak  1497 spectrum    1 weight  0.11000E+01 volume  0.93819E-03 ppm1      2.580 ppm2      1.750 CV     1
 OR { 1497}
   (( segid "    " and resid 47   and name HE2 ))
   (( segid "    " and resid 47   and name HB2 ))
 ASSI { 1498}
   (( segid "    " and resid 47   and name HE1 ))
   (( segid "    " and resid 47   and name HD1 ))
      3.100     1.200     1.200 peak  1498 spectrum    1 weight  0.11000E+01 volume  0.10346E-02 ppm1      2.573 ppm2      1.785 CV     1
 OR { 1498}
   (( segid "    " and resid 47   and name HE2 ))
   (( segid "    " and resid 47   and name HD1 ))
 OR { 1498}
   (( segid "    " and resid 47   and name HE2 ))
   (( segid "    " and resid 47   and name HB1 ))
 ASSI { 1501}
   (( segid "    " and resid 47   and name HD1 ))
   (( segid "    " and resid 47   and name HG2 ))
      3.100     3.100     2.900 peak  1501 spectrum    1 weight  0.11000E+01 volume  0.12822E-02 ppm1      1.845 ppm2      1.420 CV     1
 OR { 1501}
   (( segid "    " and resid 47   and name HD1 ))
   (( segid "    " and resid 47   and name HG1 ))
 ASSI { 1502}
   (( segid "    " and resid 47   and name HD1 ))
   (( segid "    " and resid 47   and name HD2 ))
      2.800     2.800     3.200 peak  1502 spectrum    1 weight  0.11000E+01 volume  0.58636E-03 ppm1      1.825 ppm2      1.515 CV     1
 ASSI { 1503}
   (( segid "    " and resid 47   and name HD2 ))
   (( segid "    " and resid 47   and name HG2 ))
      1.900     0.500     0.500 peak  1503 spectrum    1 weight  0.11000E+01 volume  0.15140E-01 ppm1      1.464 ppm2      1.382 CV     1
 OR { 1503}
   (( segid "    " and resid 47   and name HD2 ))
   (( segid "    " and resid 47   and name HG1 ))
 ASSI { 1508}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 62   and name HB2 ))
      3.600     1.700     1.700 peak  1508 spectrum    1 weight  0.11000E+01 volume  0.11830E-02 ppm1      3.612 ppm2      1.706 CV     1
 OR { 1508}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 62   and name HD1 ))
 OR { 1508}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 62   and name HD2 ))
 ASSI { 1510}
   (( segid "    " and resid 62   and name HB1 ))
   (( segid "    " and resid 62   and name HB2 ))
      2.000     0.500     0.500 peak  1510 spectrum    1 weight  0.11000E+01 volume  0.77669E-02 ppm1      1.834 ppm2      1.704 CV     1
 OR { 1510}
   (( segid "    " and resid 62   and name HB1 ))
   (( segid "    " and resid 62   and name HD1 ))
 ASSI { 1511}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 62   and name HB1 ))
      2.000     0.500     0.500 peak  1511 spectrum    1 weight  0.11000E+01 volume  0.53327E-02 ppm1      1.706 ppm2      1.836 CV     1
 ASSI { 1512}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 62   and name HD1 ))
      2.100     0.500     0.500 peak  1512 spectrum    1 weight  0.11000E+01 volume  0.15564E-01 ppm1      1.698 ppm2      1.702 CV     1
 OR { 1512}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 62   and name HD2 ))
 ASSI { 1514}
   (( segid "    " and resid 62   and name HG2 ))
   (( segid "    " and resid 62   and name HA  ))
      3.700     1.800     1.800 peak  1514 spectrum    1 weight  0.11000E+01 volume  0.57619E-03 ppm1      1.332 ppm2      3.607 CV     1
 ASSI { 1515}
   (( segid "    " and resid 62   and name HG1 ))
   (( segid "    " and resid 62   and name HA  ))
      3.200     1.300     1.300 peak  1515 spectrum    1 weight  0.11000E+01 volume  0.76003E-03 ppm1      1.526 ppm2      3.607 CV     1
 ASSI { 1516}
   (( segid "    " and resid 62   and name HE1 ))
   (( segid "    " and resid 62   and name HA  ))
      4.700     4.700     1.300 peak  1516 spectrum    1 weight  0.11000E+01 volume  0.75421E-03 ppm1      1.957 ppm2      3.607 CV     1
 ASSI { 1517}
   (( segid "    " and resid 62   and name HE2 ))
   (( segid "    " and resid 62   and name HA  ))
      5.300     3.500     0.700 peak  1517 spectrum    1 weight  0.11000E+01 volume  0.41800E-03 ppm1      1.432 ppm2      3.607 CV     1
 ASSI { 1519}
   (( segid "    " and resid 62   and name HG2 ))
   (( segid "    " and resid 62   and name HG1 ))
      2.000     0.500     0.500 peak  1519 spectrum    1 weight  0.11000E+01 volume  0.46237E-02 ppm1      1.344 ppm2      1.521 CV     1
 ASSI { 1522}
   (( segid "    " and resid 62   and name HE2 ))
   (( segid "    " and resid 62   and name HG1 ))
      3.100     1.200     1.200 peak  1522 spectrum    1 weight  0.11000E+01 volume  0.14791E-02 ppm1      3.041 ppm2      1.523 CV     1
 OR { 1522}
   (( segid "    " and resid 62   and name HE1 ))
   (( segid "    " and resid 62   and name HG1 ))
 ASSI { 1523}
   (( segid "    " and resid 62   and name HE2 ))
   (( segid "    " and resid 62   and name HE1 ))
      1.200     0.200     1.000 peak  1523 spectrum    1 weight  0.11000E+01 volume  0.13916E+00 ppm1      3.041 ppm2      3.040 CV     1
 OR { 1523}
   (( segid "    " and resid 62   and name HE1 ))
   (( segid "    " and resid 62   and name HE2 ))
 ASSI { 1527}
   (( segid "    " and resid 62   and name HD1 ))
   (( segid "    " and resid 62   and name HD2 ))
      1.500     1.500     4.500 peak  1527 spectrum    1 weight  0.11000E+01 volume  0.41686E-01 ppm1      1.760 ppm2      1.761 CV     1
 ASSI { 1529}
   (( segid "    " and resid 62   and name HD2 ))
   (( segid "    " and resid 62   and name HA  ))
      5.300     3.500     0.700 peak  1529 spectrum    1 weight  0.11000E+01 volume  0.24540E-03 ppm1      1.709 ppm2      3.630 CV     1
 ASSI { 1532}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 62   and name HG1 ))
      3.100     1.200     1.200 peak  1532 spectrum    1 weight  0.11000E+01 volume  0.18721E-02 ppm1      1.700 ppm2      1.529 CV     1
 ASSI { 1535}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 62   and name HE1 ))
      5.700     4.000     0.300 peak  1535 spectrum    1 weight  0.11000E+01 volume  0.29033E-03 ppm1      1.687 ppm2      3.027 CV     1
 OR { 1535}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 62   and name HE2 ))
 ASSI { 1536}
   (( segid "    " and resid 62   and name HB1 ))
   (( segid "    " and resid 62   and name HE2 ))
      6.000     4.500     0.000 peak  1536 spectrum    1 weight  0.11000E+01 volume  0.22476E-03 ppm1      1.833 ppm2      3.027 CV     1
 OR { 1536}
   (( segid "    " and resid 62   and name HB1 ))
   (( segid "    " and resid 62   and name HE1 ))
 ASSI { 1539}
   (( segid "    " and resid 62   and name HG1 ))
   (( segid "    " and resid 62   and name HD1 ))
      3.200     1.300     1.300 peak  1539 spectrum    1 weight  0.11000E+01 volume  0.27305E-02 ppm1      1.529 ppm2      1.761 CV     1
 ASSI { 1540}
   (( segid "    " and resid 62   and name HG2 ))
   (( segid "    " and resid 62   and name HD1 ))
      2.800     1.000     1.000 peak  1540 spectrum    1 weight  0.11000E+01 volume  0.19224E-02 ppm1      1.338 ppm2      1.759 CV     1
 ASSI { 1541}
   (( segid "    " and resid 62   and name HG2 ))
   (( segid "    " and resid 62   and name HB1 ))
      2.900     1.100     1.100 peak  1541 spectrum    1 weight  0.11000E+01 volume  0.12709E-02 ppm1      1.340 ppm2      1.841 CV     1
 ASSI { 1542}
   (( segid "    " and resid 62   and name HG1 ))
   (( segid "    " and resid 62   and name HB1 ))
      3.400     1.400     1.400 peak  1542 spectrum    1 weight  0.11000E+01 volume  0.14687E-02 ppm1      1.533 ppm2      1.840 CV     1
 ASSI { 1543}
   (( segid "    " and resid 62   and name HG1 ))
   (( segid "    " and resid 62   and name HD2 ))
      2.500     0.800     0.800 peak  1543 spectrum    1 weight  0.11000E+01 volume  0.46537E-02 ppm1      1.529 ppm2      1.709 CV     1
 OR { 1543}
   (( segid "    " and resid 62   and name HG1 ))
   (( segid "    " and resid 62   and name HB2 ))
 ASSI { 1544}
   (( segid "    " and resid 62   and name HG2 ))
   (( segid "    " and resid 62   and name HB2 ))
      3.100     1.200     1.200 peak  1544 spectrum    1 weight  0.11000E+01 volume  0.31596E-02 ppm1      1.340 ppm2      1.712 CV     1
 OR { 1544}
   (( segid "    " and resid 62   and name HG2 ))
   (( segid "    " and resid 62   and name HD2 ))
 ASSI { 1545}
   (( segid "    " and resid 62   and name HE1 ))
   (( segid "    " and resid 62   and name HA  ))
      6.000     4.700     0.000 peak  1545 spectrum    1 weight  0.11000E+01 volume  0.16749E-03 ppm1      3.042 ppm2      3.622 CV     1
 OR { 1545}
   (( segid "    " and resid 62   and name HE2 ))
   (( segid "    " and resid 62   and name HA  ))
 ASSI { 1546}
   (( segid "    " and resid 62   and name HE2 ))
   (( segid "    " and resid 62   and name HD2 ))
      2.900     1.100     1.100 peak  1546 spectrum    1 weight  0.11000E+01 volume  0.27635E-02 ppm1      3.035 ppm2      1.707 CV     1
 OR { 1546}
   (( segid "    " and resid 62   and name HE1 ))
   (( segid "    " and resid 62   and name HD2 ))
 OR { 1546}
   (( segid "    " and resid 62   and name HE2 ))
   (( segid "    " and resid 62   and name HB2 ))
 ASSI { 1547}
   (( segid "    " and resid 62   and name HE1 ))
   (( segid "    " and resid 62   and name HD1 ))
      2.800     1.000     1.000 peak  1547 spectrum    1 weight  0.11000E+01 volume  0.31279E-02 ppm1      3.036 ppm2      1.738 CV     1
 OR { 1547}
   (( segid "    " and resid 62   and name HE2 ))
   (( segid "    " and resid 62   and name HD1 ))
 ASSI { 1548}
   (( segid "    " and resid 62   and name HE1 ))
   (( segid "    " and resid 62   and name HG2 ))
      3.000     1.200     1.200 peak  1548 spectrum    1 weight  0.11000E+01 volume  0.13927E-02 ppm1      3.040 ppm2      1.336 CV     1
 OR { 1548}
   (( segid "    " and resid 62   and name HE2 ))
   (( segid "    " and resid 62   and name HG2 ))
 ASSI { 1553}
   (( segid "    " and resid 119  and name HB1 ))
   (( segid "    " and resid 119  and name HB2 ))
      2.000     0.500     0.500 peak  1553 spectrum    1 weight  0.11000E+01 volume  0.57147E-02 ppm1      1.641 ppm2      1.263 CV     1
 ASSI { 1558}
   (( segid "    " and resid 119  and name HD1 ))
   (( segid "    " and resid 119  and name HA  ))
      6.000     5.400     0.000 peak  1558 spectrum    1 weight  0.11000E+01 volume  0.15378E-03 ppm1      1.409 ppm2      3.975 CV     1
 ASSI { 1559}
   (( segid "    " and resid 119  and name HD2 ))
   (( segid "    " and resid 119  and name HA  ))
      6.000     5.800     0.000 peak  1559 spectrum    1 weight  0.11000E+01 volume  0.20039E-03 ppm1      1.360 ppm2      3.975 CV     1
 ASSI { 1561}
   (( segid "    " and resid 119  and name HD1 ))
   (( segid "    " and resid 119  and name HD2 ))
      1.400     0.200     0.800 peak  1561 spectrum    1 weight  0.11000E+01 volume  0.48370E-01 ppm1      1.390 ppm2      1.392 CV     1
 OR { 1561}
   (( segid "    " and resid 119  and name HD2 ))
   (( segid "    " and resid 119  and name HD1 ))
 ASSI { 1562}
   (( segid "    " and resid 119  and name HA  ))
   (( segid "    " and resid 119  and name HD1 ))
      6.000     5.900     0.000 peak  1562 spectrum    1 weight  0.11000E+01 volume  0.13968E-03 ppm1      3.961 ppm2      1.411 CV     1
 OR { 1562}
   (( segid "    " and resid 119  and name HA  ))
   (( segid "    " and resid 119  and name HD2 ))
 ASSI { 1566}
   (( segid "    " and resid 119  and name HG2 ))
   (( segid "    " and resid 119  and name HG1 ))
      1.800     0.400     0.400 peak  1566 spectrum    1 weight  0.11000E+01 volume  0.49050E-02 ppm1      0.624 ppm2      0.924 CV     1
 ASSI { 1568}
   (( segid "    " and resid 119  and name HE2 ))
   (( segid "    " and resid 119  and name HB1 ))
      3.200     1.300     1.300 peak  1568 spectrum    1 weight  0.11000E+01 volume  0.61678E-03 ppm1      2.768 ppm2      1.646 CV     1
 OR { 1568}
   (( segid "    " and resid 119  and name HE1 ))
   (( segid "    " and resid 119  and name HB1 ))
 ASSI { 1570}
   (( segid "    " and resid 119  and name HE2 ))
   (( segid "    " and resid 119  and name HE1 ))
      1.100     0.200     1.100 peak  1570 spectrum    1 weight  0.11000E+01 volume  0.13808E+00 ppm1      2.766 ppm2      2.767 CV     1
 OR { 1570}
   (( segid "    " and resid 119  and name HE1 ))
   (( segid "    " and resid 119  and name HE2 ))
 ASSI { 1573}
   (( segid "    " and resid 119  and name HA  ))
   (( segid "    " and resid 119  and name HG1 ))
      5.400     3.600     0.600 peak  1573 spectrum    1 weight  0.11000E+01 volume  0.20026E-03 ppm1      3.965 ppm2      0.928 CV     1
 ASSI { 1580}
   (( segid "    " and resid 119  and name HB2 ))
   (( segid "    " and resid 119  and name HD1 ))
      3.500     1.500     1.500 peak  1580 spectrum    1 weight  0.11000E+01 volume  0.92328E-03 ppm1      1.232 ppm2      1.381 CV     1
 OR { 1580}
   (( segid "    " and resid 119  and name HB2 ))
   (( segid "    " and resid 119  and name HD2 ))
 ASSI { 1582}
   (( segid "    " and resid 119  and name HB2 ))
   (( segid "    " and resid 119  and name HE2 ))
      5.500     3.700     0.500 peak  1582 spectrum    1 weight  0.11000E+01 volume  0.33059E-03 ppm1      1.271 ppm2      2.769 CV     1
 OR { 1582}
   (( segid "    " and resid 119  and name HB2 ))
   (( segid "    " and resid 119  and name HE1 ))
 ASSI { 1591}
   (( segid "    " and resid 119  and name HG2 ))
   (( segid "    " and resid 119  and name HD2 ))
      2.800     1.000     1.000 peak  1591 spectrum    1 weight  0.11000E+01 volume  0.23789E-02 ppm1      0.622 ppm2      1.381 CV     1
 OR { 1591}
   (( segid "    " and resid 119  and name HG2 ))
   (( segid "    " and resid 119  and name HD1 ))
 ASSI { 1594}
   (( segid "    " and resid 119  and name HD2 ))
   (( segid "    " and resid 119  and name HG1 ))
      2.500     0.800     0.800 peak  1594 spectrum    1 weight  0.11000E+01 volume  0.34496E-02 ppm1      1.399 ppm2      0.939 CV     1
 OR { 1594}
   (( segid "    " and resid 119  and name HD1 ))
   (( segid "    " and resid 119  and name HG1 ))
 ASSI { 1596}
   (( segid "    " and resid 119  and name HE2 ))
   (( segid "    " and resid 119  and name HA  ))
      5.700     4.100     0.300 peak  1596 spectrum    1 weight  0.11000E+01 volume  0.33326E-03 ppm1      2.745 ppm2      3.971 CV     1
 OR { 1596}
   (( segid "    " and resid 119  and name HE1 ))
   (( segid "    " and resid 119  and name HA  ))
 ASSI { 1599}
   (( segid "    " and resid 119  and name HE1 ))
   (( segid "    " and resid 119  and name HG1 ))
      3.600     1.600     1.600 peak  1599 spectrum    1 weight  0.11000E+01 volume  0.23904E-02 ppm1      2.767 ppm2      0.938 CV     1
 OR { 1599}
   (( segid "    " and resid 119  and name HE2 ))
   (( segid "    " and resid 119  and name HG1 ))
 ASSI { 1601}
   (( segid "    " and resid 145  and name HA  ))
   (( segid "    " and resid 145  and name HB2 ))
      4.300     2.300     1.700 peak  1601 spectrum    1 weight  0.11000E+01 volume  0.56172E-03 ppm1      4.331 ppm2      1.693 CV     1
 ASSI { 1605}
   (( segid "    " and resid 145  and name HB2 ))
   (( segid "    " and resid 145  and name HD2 ))
      2.400     2.400     3.600 peak  1605 spectrum    1 weight  0.11000E+01 volume  0.14696E-01 ppm1      1.696 ppm2      1.700 CV     1
 OR { 1605}
   (( segid "    " and resid 145  and name HB2 ))
   (( segid "    " and resid 145  and name HD1 ))
 ASSI { 1607}
   (( segid "    " and resid 145  and name HB1 ))
   (( segid "    " and resid 145  and name HB2 ))
      2.100     0.500     0.500 peak  1607 spectrum    1 weight  0.11000E+01 volume  0.65337E-02 ppm1      1.839 ppm2      1.704 CV     1
 OR { 1607}
   (( segid "    " and resid 145  and name HB1 ))
   (( segid "    " and resid 145  and name HD1 ))
 ASSI { 1610}
   (( segid "    " and resid 145  and name HG2 ))
   (( segid "    " and resid 145  and name HA  ))
      3.800     1.800     1.800 peak  1610 spectrum    1 weight  0.11000E+01 volume  0.89413E-03 ppm1      1.416 ppm2      4.331 CV     1
 ASSI { 1614}
   (( segid "    " and resid 145  and name HG1 ))
   (( segid "    " and resid 145  and name HG2 ))
      2.000     0.500     0.500 peak  1614 spectrum    1 weight  0.11000E+01 volume  0.45815E-02 ppm1      1.583 ppm2      1.421 CV     1
 ASSI { 1617}
   (( segid "    " and resid 145  and name HD1 ))
   (( segid "    " and resid 145  and name HA  ))
      5.000     3.100     1.000 peak  1617 spectrum    1 weight  0.11000E+01 volume  0.70022E-03 ppm1      1.753 ppm2      4.322 CV     1
 ASSI { 1618}
   (( segid "    " and resid 145  and name HD2 ))
   (( segid "    " and resid 145  and name HA  ))
      4.800     2.900     1.200 peak  1618 spectrum    1 weight  0.11000E+01 volume  0.78496E-03 ppm1      1.707 ppm2      4.324 CV     1
 ASSI { 1621}
   (( segid "    " and resid 145  and name HD1 ))
   (( segid "    " and resid 145  and name HD2 ))
      1.400     1.400     4.600 peak  1621 spectrum    1 weight  0.11000E+01 volume  0.34298E-01 ppm1      1.764 ppm2      1.762 CV     1
 ASSI { 1623}
   (( segid "    " and resid 145  and name HE1 ))
   (( segid "    " and resid 145  and name HE2 ))
      1.200     0.200     1.000 peak  1623 spectrum    1 weight  0.11000E+01 volume  0.12511E+00 ppm1      3.023 ppm2      3.019 CV     1
 OR { 1623}
   (( segid "    " and resid 145  and name HE2 ))
   (( segid "    " and resid 145  and name HE1 ))
 ASSI { 1628}
   (( segid "    " and resid 145  and name HB2 ))
   (( segid "    " and resid 145  and name HG2 ))
      3.500     1.500     1.500 peak  1628 spectrum    1 weight  0.11000E+01 volume  0.15114E-02 ppm1      1.672 ppm2      1.422 CV     1
 ASSI { 1629}
   (( segid "    " and resid 145  and name HB1 ))
   (( segid "    " and resid 145  and name HG1 ))
      3.800     1.800     1.800 peak  1629 spectrum    1 weight  0.11000E+01 volume  0.87265E-03 ppm1      1.877 ppm2      1.590 CV     1
 ASSI { 1630}
   (( segid "    " and resid 145  and name HB2 ))
   (( segid "    " and resid 145  and name HG1 ))
      2.400     0.700     0.700 peak  1630 spectrum    1 weight  0.11000E+01 volume  0.41963E-02 ppm1      1.663 ppm2      1.596 CV     1
 ASSI { 1632}
   (( segid "    " and resid 145  and name HB2 ))
   (( segid "    " and resid 145  and name HE1 ))
      5.600     4.000     0.400 peak  1632 spectrum    1 weight  0.11000E+01 volume  0.26441E-03 ppm1      1.686 ppm2      3.022 CV     1
 OR { 1632}
   (( segid "    " and resid 145  and name HB2 ))
   (( segid "    " and resid 145  and name HE2 ))
 ASSI { 1633}
   (( segid "    " and resid 145  and name HG1 ))
   (( segid "    " and resid 145  and name HD2 ))
      2.600     0.900     0.900 peak  1633 spectrum    1 weight  0.11000E+01 volume  0.25577E-02 ppm1      1.586 ppm2      1.698 CV     1
 OR { 1633}
   (( segid "    " and resid 145  and name HG1 ))
   (( segid "    " and resid 145  and name HB2 ))
 ASSI { 1635}
   (( segid "    " and resid 145  and name HG2 ))
   (( segid "    " and resid 145  and name HB2 ))
      2.900     1.000     1.000 peak  1635 spectrum    1 weight  0.11000E+01 volume  0.23327E-02 ppm1      1.411 ppm2      1.697 CV     1
 OR { 1635}
   (( segid "    " and resid 145  and name HG2 ))
   (( segid "    " and resid 145  and name HD2 ))
 ASSI { 1637}
   (( segid "    " and resid 145  and name HG2 ))
   (( segid "    " and resid 145  and name HD1 ))
      2.800     1.000     1.000 peak  1637 spectrum    1 weight  0.11000E+01 volume  0.38629E-02 ppm1      1.411 ppm2      1.782 CV     1
 ASSI { 1638}
   (( segid "    " and resid 145  and name HG1 ))
   (( segid "    " and resid 145  and name HD1 ))
      2.800     1.000     1.000 peak  1638 spectrum    1 weight  0.11000E+01 volume  0.20796E-02 ppm1      1.586 ppm2      1.771 CV     1
 ASSI { 1639}
   (( segid "    " and resid 145  and name HE1 ))
   (( segid "    " and resid 145  and name HA  ))
      4.900     2.900     1.100 peak  1639 spectrum    1 weight  0.11000E+01 volume  0.70067E-03 ppm1      3.018 ppm2      4.341 CV     1
 OR { 1639}
   (( segid "    " and resid 145  and name HE2 ))
   (( segid "    " and resid 145  and name HA  ))
 ASSI { 1640}
   (( segid "    " and resid 145  and name HE1 ))
   (( segid "    " and resid 145  and name HD2 ))
      2.900     1.100     1.100 peak  1640 spectrum    1 weight  0.11000E+01 volume  0.28311E-02 ppm1      3.017 ppm2      1.704 CV     1
 OR { 1640}
   (( segid "    " and resid 145  and name HE2 ))
   (( segid "    " and resid 145  and name HD2 ))
 OR { 1640}
   (( segid "    " and resid 145  and name HE2 ))
   (( segid "    " and resid 145  and name HB2 ))
 ASSI { 1641}
   (( segid "    " and resid 145  and name HE2 ))
   (( segid "    " and resid 145  and name HD1 ))
      3.000     1.100     1.100 peak  1641 spectrum    1 weight  0.11000E+01 volume  0.23741E-02 ppm1      3.026 ppm2      1.743 CV     1
 OR { 1641}
   (( segid "    " and resid 145  and name HE1 ))
   (( segid "    " and resid 145  and name HD1 ))
 ASSI { 1645}
   (( segid "    " and resid 46   and name HB1 ))
   (( segid "    " and resid 46   and name HB2 ))
      1.800     0.400     0.400 peak  1645 spectrum    1 weight  0.11000E+01 volume  0.68353E-02 ppm1      1.802 ppm2      1.804 CV     1
 OR { 1645}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 46   and name HB1 ))
 ASSI { 1647}
   (( segid "    " and resid 46   and name HG1 ))
   (( segid "    " and resid 46   and name HA  ))
      3.000     1.100     1.100 peak  1647 spectrum    1 weight  0.11000E+01 volume  0.11932E-02 ppm1      1.342 ppm2      5.938 CV     1
 OR { 1647}
   (( segid "    " and resid 46   and name HG2 ))
   (( segid "    " and resid 46   and name HA  ))
 ASSI { 1648}
   (( segid "    " and resid 46   and name HG2 ))
   (( segid "    " and resid 46   and name HG1 ))
      1.600     1.600     4.400 peak  1648 spectrum    1 weight  0.11000E+01 volume  0.17499E-01 ppm1      1.378 ppm2      1.374 CV     1
 OR { 1648}
   (( segid "    " and resid 46   and name HG1 ))
   (( segid "    " and resid 46   and name HG2 ))
 ASSI { 1649}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 46   and name HA  ))
      4.900     3.000     1.100 peak  1649 spectrum    1 weight  0.11000E+01 volume  0.55564E-03 ppm1      2.778 ppm2      5.935 CV     1
 OR { 1649}
   (( segid "    " and resid 46   and name HD1 ))
   (( segid "    " and resid 46   and name HA  ))
 ASSI { 1650}
   (( segid "    " and resid 46   and name HD1 ))
   (( segid "    " and resid 46   and name HD2 ))
      1.500     0.300     0.700 peak  1650 spectrum    1 weight  0.11000E+01 volume  0.36066E-01 ppm1      2.783 ppm2      2.785 CV     1
 OR { 1650}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 46   and name HD1 ))
 ASSI { 1654}
   (( segid "    " and resid 46   and name HG2 ))
   (( segid "    " and resid 46   and name HB2 ))
      3.000     1.100     1.100 peak  1654 spectrum    1 weight  0.11000E+01 volume  0.15252E-02 ppm1      1.352 ppm2      1.815 CV     1
 OR { 1654}
   (( segid "    " and resid 46   and name HG1 ))
   (( segid "    " and resid 46   and name HB1 ))
 OR { 1654}
   (( segid "    " and resid 46   and name HG1 ))
   (( segid "    " and resid 46   and name HB2 ))
 OR { 1654}
   (( segid "    " and resid 46   and name HG2 ))
   (( segid "    " and resid 46   and name HB1 ))
 ASSI { 1657}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 46   and name HG1 ))
      2.600     0.900     0.900 peak  1657 spectrum    1 weight  0.11000E+01 volume  0.31658E-02 ppm1      2.781 ppm2      1.343 CV     1
 OR { 1657}
   (( segid "    " and resid 46   and name HD1 ))
   (( segid "    " and resid 46   and name HG2 ))
 OR { 1657}
   (( segid "    " and resid 46   and name HD1 ))
   (( segid "    " and resid 46   and name HG1 ))
 OR { 1657}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 46   and name HG2 ))
 ASSI { 1660}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 46   and name HH12))
      5.400     3.700     0.600 peak  1660 spectrum    1 weight  0.11000E+01 volume  0.49792E-03 ppm1      5.945 ppm2      7.018 CV     1
 OR { 1660}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 46   and name HH21))
 OR { 1660}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 46   and name HH11))
 ASSI { 1662}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 46   and name HE  ))
      3.500     1.500     1.500 peak  1662 spectrum    1 weight  0.11000E+01 volume  0.69710E-03 ppm1      1.796 ppm2      7.230 CV     1
 OR { 1662}
   (( segid "    " and resid 46   and name HB1 ))
   (( segid "    " and resid 46   and name HE  ))
 ASSI { 1663}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 46   and name HH21))
      5.500     3.800     0.500 peak  1663 spectrum    1 weight  0.11000E+01 volume  0.16967E-03 ppm1      1.796 ppm2      7.020 CV     1
 OR { 1663}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 46   and name HH12))
 OR { 1663}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 46   and name HH22))
 OR { 1663}
   (( segid "    " and resid 46   and name HB1 ))
   (( segid "    " and resid 46   and name HH21))
 OR { 1663}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 46   and name HH11))
 OR { 1663}
   (( segid "    " and resid 46   and name HB1 ))
   (( segid "    " and resid 46   and name HH11))
 ASSI { 1664}
   (( segid "    " and resid 46   and name HG2 ))
   (( segid "    " and resid 46   and name HE  ))
      4.500     2.500     1.500 peak  1664 spectrum    1 weight  0.11000E+01 volume  0.27131E-03 ppm1      1.340 ppm2      7.226 CV     1
 OR { 1664}
   (( segid "    " and resid 46   and name HG1 ))
   (( segid "    " and resid 46   and name HE  ))
 ASSI { 1665}
   (( segid "    " and resid 46   and name HG2 ))
   (( segid "    " and resid 46   and name HH12))
      6.000     5.100     0.000 peak  1665 spectrum    1 weight  0.11000E+01 volume  0.98186E-04 ppm1      1.345 ppm2      7.016 CV     1
 OR { 1665}
   (( segid "    " and resid 46   and name HG1 ))
   (( segid "    " and resid 46   and name HH12))
 OR { 1665}
   (( segid "    " and resid 46   and name HG2 ))
   (( segid "    " and resid 46   and name HH11))
 OR { 1665}
   (( segid "    " and resid 46   and name HG1 ))
   (( segid "    " and resid 46   and name HH11))
 OR { 1665}
   (( segid "    " and resid 46   and name HG1 ))
   (( segid "    " and resid 46   and name HH21))
 OR { 1665}
   (( segid "    " and resid 46   and name HG1 ))
   (( segid "    " and resid 46   and name HH22))
 ASSI { 1666}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 46   and name HE  ))
      3.900     1.900     1.900 peak  1666 spectrum    1 weight  0.11000E+01 volume  0.38528E-03 ppm1      2.787 ppm2      7.230 CV     1
 OR { 1666}
   (( segid "    " and resid 46   and name HD1 ))
   (( segid "    " and resid 46   and name HE  ))
 ASSI { 1667}
   (( segid "    " and resid 46   and name HD1 ))
   (( segid "    " and resid 46   and name HH12))
      4.900     4.900     1.100 peak  1667 spectrum    1 weight  0.11000E+01 volume  0.14495E-03 ppm1      2.763 ppm2      7.013 CV     1
 OR { 1667}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 46   and name HH12))
 OR { 1667}
   (( segid "    " and resid 46   and name HD1 ))
   (( segid "    " and resid 46   and name HH11))
 OR { 1667}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 46   and name HH11))
 OR { 1667}
   (( segid "    " and resid 46   and name HD1 ))
   (( segid "    " and resid 46   and name HH21))
 ASSI { 1669}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 59   and name HB2 ))
      3.600     1.600     1.600 peak  1669 spectrum    1 weight  0.11000E+01 volume  0.65641E-03 ppm1      5.200 ppm2      1.572 CV     1
 OR { 1669}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 59   and name HG2 ))
 ASSI { 1671}
   (( segid "    " and resid 59   and name HB2 ))
   (( segid "    " and resid 59   and name HA  ))
      4.300     2.300     1.700 peak  1671 spectrum    1 weight  0.11000E+01 volume  0.36903E-03 ppm1      1.546 ppm2      5.204 CV     1
 ASSI { 1673}
   (( segid "    " and resid 59   and name HB1 ))
   (( segid "    " and resid 59   and name HB2 ))
      2.600     0.800     0.800 peak  1673 spectrum    1 weight  0.11000E+01 volume  0.17811E-02 ppm1      1.925 ppm2      1.555 CV     1
 OR { 1673}
   (( segid "    " and resid 59   and name HB1 ))
   (( segid "    " and resid 59   and name HG2 ))
 ASSI { 1674}
   (( segid "    " and resid 59   and name HB2 ))
   (( segid "    " and resid 59   and name HG2 ))
      3.100     1.200     1.200 peak  1674 spectrum    1 weight  0.11000E+01 volume  0.35610E-02 ppm1      1.540 ppm2      1.543 CV     1
 ASSI { 1675}
   (( segid "    " and resid 59   and name HB2 ))
   (( segid "    " and resid 59   and name HB1 ))
      2.300     0.600     0.600 peak  1675 spectrum    1 weight  0.11000E+01 volume  0.31598E-02 ppm1      1.551 ppm2      1.929 CV     1
 ASSI { 1677}
   (( segid "    " and resid 59   and name HG2 ))
   (( segid "    " and resid 59   and name HA  ))
      3.000     1.100     1.100 peak  1677 spectrum    1 weight  0.11000E+01 volume  0.12438E-02 ppm1      1.581 ppm2      5.197 CV     1
 ASSI { 1679}
   (( segid "    " and resid 59   and name HD1 ))
   (( segid "    " and resid 59   and name HA  ))
      6.000     5.300     0.000 peak  1679 spectrum    1 weight  0.11000E+01 volume  0.15218E-03 ppm1      3.202 ppm2      5.212 CV     1
 ASSI { 1680}
   (( segid "    " and resid 59   and name HD2 ))
   (( segid "    " and resid 59   and name HA  ))
      5.300     3.500     0.700 peak  1680 spectrum    1 weight  0.11000E+01 volume  0.18076E-03 ppm1      3.064 ppm2      5.200 CV     1
 ASSI { 1684}
   (( segid "    " and resid 59   and name HB2 ))
   (( segid "    " and resid 59   and name HG1 ))
      2.900     1.100     1.100 peak  1684 spectrum    1 weight  0.11000E+01 volume  0.12754E-02 ppm1      1.545 ppm2      1.773 CV     1
 ASSI { 1686}
   (( segid "    " and resid 59   and name HB2 ))
   (( segid "    " and resid 59   and name HD2 ))
      4.900     3.000     1.100 peak  1686 spectrum    1 weight  0.11000E+01 volume  0.47562E-03 ppm1      1.539 ppm2      3.075 CV     1
 ASSI { 1687}
   (( segid "    " and resid 59   and name HB2 ))
   (( segid "    " and resid 59   and name HD1 ))
      5.200     3.400     0.800 peak  1687 spectrum    1 weight  0.11000E+01 volume  0.45240E-03 ppm1      1.538 ppm2      3.188 CV     1
 ASSI { 1689}
   (( segid "    " and resid 59   and name HB1 ))
   (( segid "    " and resid 59   and name HD1 ))
      5.200     3.300     0.800 peak  1689 spectrum    1 weight  0.11000E+01 volume  0.33189E-03 ppm1      1.934 ppm2      3.187 CV     1
 ASSI { 1690}
   (( segid "    " and resid 59   and name HG1 ))
   (( segid "    " and resid 59   and name HG2 ))
      2.200     0.600     0.600 peak  1690 spectrum    1 weight  0.11000E+01 volume  0.41247E-02 ppm1      1.773 ppm2      1.591 CV     1
 OR { 1690}
   (( segid "    " and resid 59   and name HG1 ))
   (( segid "    " and resid 59   and name HB2 ))
 ASSI { 1692}
   (( segid "    " and resid 59   and name HG1 ))
   (( segid "    " and resid 59   and name HB1 ))
      3.000     1.100     1.100 peak  1692 spectrum    1 weight  0.11000E+01 volume  0.44615E-02 ppm1      1.761 ppm2      1.885 CV     1
 ASSI { 1693}
   (( segid "    " and resid 59   and name HG2 ))
   (( segid "    " and resid 59   and name HG1 ))
      1.900     0.400     0.400 peak  1693 spectrum    1 weight  0.11000E+01 volume  0.87413E-02 ppm1      1.586 ppm2      1.783 CV     1
 ASSI { 1695}
   (( segid "    " and resid 59   and name HG2 ))
   (( segid "    " and resid 59   and name HD2 ))
      3.600     1.600     1.600 peak  1695 spectrum    1 weight  0.11000E+01 volume  0.50122E-03 ppm1      1.584 ppm2      3.079 CV     1
 ASSI { 1696}
   (( segid "    " and resid 59   and name HG2 ))
   (( segid "    " and resid 59   and name HD1 ))
      3.200     1.300     1.300 peak  1696 spectrum    1 weight  0.11000E+01 volume  0.12199E-02 ppm1      1.586 ppm2      3.189 CV     1
 ASSI { 1698}
   (( segid "    " and resid 59   and name HD2 ))
   (( segid "    " and resid 59   and name HG2 ))
      3.500     1.500     1.500 peak  1698 spectrum    1 weight  0.11000E+01 volume  0.87526E-03 ppm1      3.068 ppm2      1.567 CV     1
 OR { 1698}
   (( segid "    " and resid 59   and name HD2 ))
   (( segid "    " and resid 59   and name HB2 ))
 ASSI { 1699}
   (( segid "    " and resid 59   and name HD1 ))
   (( segid "    " and resid 59   and name HG2 ))
      3.700     1.700     1.700 peak  1699 spectrum    1 weight  0.11000E+01 volume  0.71114E-03 ppm1      3.188 ppm2      1.569 CV     1
 OR { 1699}
   (( segid "    " and resid 59   and name HD1 ))
   (( segid "    " and resid 59   and name HB2 ))
 ASSI { 1701}
   (( segid "    " and resid 59   and name HD2 ))
   (( segid "    " and resid 59   and name HB1 ))
      3.500     1.600     1.600 peak  1701 spectrum    1 weight  0.11000E+01 volume  0.44585E-03 ppm1      3.069 ppm2      1.927 CV     1
 ASSI { 1703}
   (( segid "    " and resid 59   and name HD1 ))
   (( segid "    " and resid 59   and name HG1 ))
      3.700     1.700     1.700 peak  1703 spectrum    1 weight  0.11000E+01 volume  0.37523E-03 ppm1      3.202 ppm2      1.781 CV     1
 ASSI { 1706}
   (( segid "    " and resid 59   and name HD2 ))
   (( segid "    " and resid 59   and name HD1 ))
      2.100     0.600     0.600 peak  1706 spectrum    1 weight  0.11000E+01 volume  0.41071E-02 ppm1      3.071 ppm2      3.187 CV     1
 ASSI { 1708}
   (( segid "    " and resid 79   and name HG2 ))
   (( segid "    " and resid 79   and name HA  ))
      2.800     2.800     3.200 peak  1708 spectrum    1 weight  0.11000E+01 volume  0.10135E-02 ppm1      1.698 ppm2      4.506 CV     1
 ASSI { 1709}
   (( segid "    " and resid 79   and name HD1 ))
   (( segid "    " and resid 79   and name HA  ))
      3.600     1.600     1.600 peak  1709 spectrum    1 weight  0.11000E+01 volume  0.28176E-02 ppm1      3.234 ppm2      4.506 CV     1
 OR { 1709}
   (( segid "    " and resid 79   and name HD2 ))
   (( segid "    " and resid 79   and name HA  ))
 ASSI { 1710}
   (( segid "    " and resid 79   and name HD2 ))
   (( segid "    " and resid 79   and name HD1 ))
      1.100     0.100     1.100 peak  1710 spectrum    1 weight  0.11000E+01 volume  0.23936E+00 ppm1      3.238 ppm2      3.236 CV     1
 OR { 1710}
   (( segid "    " and resid 79   and name HD1 ))
   (( segid "    " and resid 79   and name HD2 ))
 ASSI { 1711}
   (( segid "    " and resid 79   and name HG2 ))
   (( segid "    " and resid 79   and name HD1 ))
      2.500     0.800     0.800 peak  1711 spectrum    1 weight  0.11000E+01 volume  0.54223E-02 ppm1      1.692 ppm2      3.241 CV     1
 OR { 1711}
   (( segid "    " and resid 79   and name HG1 ))
   (( segid "    " and resid 79   and name HD2 ))
 OR { 1711}
   (( segid "    " and resid 79   and name HG2 ))
   (( segid "    " and resid 79   and name HD2 ))
 OR { 1711}
   (( segid "    " and resid 79   and name HG1 ))
   (( segid "    " and resid 79   and name HD1 ))
 ASSI { 1714}
   (( segid "    " and resid 79   and name HG1 ))
   (( segid "    " and resid 79   and name HG2 ))
      1.200     0.200     1.000 peak  1714 spectrum    1 weight  0.11000E+01 volume  0.91079E-01 ppm1      1.698 ppm2      1.689 CV     1
 OR { 1714}
   (( segid "    " and resid 79   and name HG2 ))
   (( segid "    " and resid 79   and name HG1 ))
 ASSI { 1715}
   (( segid "    " and resid 79   and name HD1 ))
   (( segid "    " and resid 79   and name HB1 ))
      3.000     1.100     1.100 peak  1715 spectrum    1 weight  0.11000E+01 volume  0.23531E-02 ppm1      3.240 ppm2      1.882 CV     1
 OR { 1715}
   (( segid "    " and resid 79   and name HD2 ))
   (( segid "    " and resid 79   and name HB1 ))
 OR { 1715}
   (( segid "    " and resid 79   and name HD2 ))
   (( segid "    " and resid 79   and name HB2 ))
 OR { 1715}
   (( segid "    " and resid 79   and name HD1 ))
   (( segid "    " and resid 79   and name HB2 ))
 ASSI { 1716}
   (( segid "    " and resid 79   and name HD2 ))
   (( segid "    " and resid 79   and name HG1 ))
      2.500     0.800     0.800 peak  1716 spectrum    1 weight  0.11000E+01 volume  0.53907E-02 ppm1      3.240 ppm2      1.705 CV     1
 OR { 1716}
   (( segid "    " and resid 79   and name HD1 ))
   (( segid "    " and resid 79   and name HG1 ))
 ASSI { 1717}
   (( segid "    " and resid 79   and name HD1 ))
   (( segid "    " and resid 79   and name HG2 ))
      2.500     0.800     0.800 peak  1717 spectrum    1 weight  0.11000E+01 volume  0.47974E-02 ppm1      3.237 ppm2      1.660 CV     1
 OR { 1717}
   (( segid "    " and resid 79   and name HD2 ))
   (( segid "    " and resid 79   and name HG2 ))
 ASSI { 1718}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 79   and name HB1 ))
      3.500     1.500     1.500 peak  1718 spectrum    1 weight  0.11000E+01 volume  0.64205E-03 ppm1      4.508 ppm2      1.886 CV     1
 OR { 1718}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 79   and name HB2 ))
 ASSI { 1720}
   (( segid "    " and resid 79   and name HD1 ))
   (( segid "    " and resid 79   and name HH11))
      4.200     2.200     1.800 peak  1720 spectrum    1 weight  0.11000E+01 volume  0.21726E-03 ppm1      3.246 ppm2      6.800 CV     1
 OR { 1720}
   (( segid "    " and resid 79   and name HD2 ))
   (( segid "    " and resid 79   and name HH11))
 OR { 1720}
   (( segid "    " and resid 79   and name HD1 ))
   (( segid "    " and resid 79   and name HH12))
 ASSI { 1721}
   (( segid "    " and resid 79   and name HD2 ))
   (( segid "    " and resid 79   and name HE  ))
      4.200     2.200     1.800 peak  1721 spectrum    1 weight  0.11000E+01 volume  0.28993E-03 ppm1      3.240 ppm2      7.197 CV     1
 OR { 1721}
   (( segid "    " and resid 79   and name HD1 ))
   (( segid "    " and resid 79   and name HE  ))
 ASSI { 1722}
   (( segid "    " and resid 79   and name HG1 ))
   (( segid "    " and resid 79   and name HE  ))
      4.600     4.600     1.400 peak  1722 spectrum    1 weight  0.11000E+01 volume  0.13263E-03 ppm1      1.729 ppm2      7.195 CV     1
 OR { 1722}
   (( segid "    " and resid 79   and name HG2 ))
   (( segid "    " and resid 79   and name HE  ))
 ASSI { 1723}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 79   and name HE  ))
      6.000     6.000     0.000 peak  1723 spectrum    1 weight  0.11000E+01 volume  0.26192E-03 ppm1      4.440 ppm2      7.195 CV     1
 ASSI { 1724}
   (( segid "    " and resid 79   and name HG1 ))
   (( segid "    " and resid 79   and name HH11))
      6.000     6.000     0.000 peak  1724 spectrum    1 weight  0.11000E+01 volume  0.65727E-04 ppm1      1.747 ppm2      6.796 CV     1
 OR { 1724}
   (( segid "    " and resid 79   and name HG1 ))
   (( segid "    " and resid 79   and name HH12))
 ASSI { 1727}
   (( segid "    " and resid 128  and name HG1 ))
   (( segid "    " and resid 128  and name HA  ))
      4.500     2.600     1.500 peak  1727 spectrum    1 weight  0.11000E+01 volume  0.55689E-03 ppm1      1.728 ppm2      4.453 CV     1
 ASSI { 1728}
   (( segid "    " and resid 128  and name HG2 ))
   (( segid "    " and resid 128  and name HA  ))
      4.400     2.400     1.600 peak  1728 spectrum    1 weight  0.11000E+01 volume  0.60308E-03 ppm1      1.631 ppm2      4.450 CV     1
 ASSI { 1729}
   (( segid "    " and resid 128  and name HG1 ))
   (( segid "    " and resid 128  and name HD2 ))
      2.700     2.700     3.300 peak  1729 spectrum    1 weight  0.11000E+01 volume  0.41711E-02 ppm1      1.691 ppm2      3.241 CV     1
 OR { 1729}
   (( segid "    " and resid 128  and name HG1 ))
   (( segid "    " and resid 128  and name HD1 ))
 OR { 1729}
   (( segid "    " and resid 128  and name HB1 ))
   (( segid "    " and resid 128  and name HD1 ))
 ASSI { 1730}
   (( segid "    " and resid 128  and name HG2 ))
   (( segid "    " and resid 128  and name HG1 ))
      1.300     1.300     4.700 peak  1730 spectrum    1 weight  0.11000E+01 volume  0.84364E-01 ppm1      1.650 ppm2      1.654 CV     1
 ASSI { 1732}
   (( segid "    " and resid 52   and name HG1 ))
   (( segid "    " and resid 52   and name HD1 ))
      2.400     0.700     0.700 peak  1732 spectrum    1 weight  0.11000E+01 volume  0.53795E-02 ppm1      2.034 ppm2      3.815 CV     1
 ASSI { 1733}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 50   and name HB2 ))
      6.000     6.000     0.000 peak  1733 spectrum    1 weight  0.11000E+01 volume  0.86452E-04 ppm1      4.496 ppm2      1.417 CV     1
 ASSI { 1735}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 111  and name HB  ))
      4.800     2.800     1.200 peak  1735 spectrum    1 weight  0.11000E+01 volume  0.54687E-03 ppm1      4.507 ppm2      3.784 CV     1
 ASSI { 1736}
   (( segid "    " and resid 51   and name HB  ))
   (  segid "    " and resid 111  and name HG2%)
      4.900     3.100     1.100 peak  1736 spectrum    1 weight  0.11000E+01 volume  0.55956E-03 ppm1      2.054 ppm2      1.201 CV     1
 ASSI { 1737}
   (( segid "    " and resid 51   and name HB  ))
   (( segid "    " and resid 50   and name HG  ))
      5.800     4.200     0.200 peak  1737 spectrum    1 weight  0.11000E+01 volume  0.26936E-03 ppm1      2.062 ppm2      1.597 CV     1
 ASSI { 1738}
   (( segid "    " and resid 51   and name HB  ))
   (( segid "    " and resid 52   and name HB2 ))
      3.100     3.100     2.900 peak  1738 spectrum    1 weight  0.11000E+01 volume  0.10597E-01 ppm1      2.062 ppm2      1.883 CV     1
 ASSI { 1741}
   (( segid "    " and resid 51   and name HB  ))
   (( segid "    " and resid 111  and name HA  ))
      4.800     2.900     1.200 peak  1741 spectrum    1 weight  0.11000E+01 volume  0.47223E-03 ppm1      2.053 ppm2      5.616 CV     1
 ASSI { 1742}
   (  segid "    " and resid 51   and name HG1%)
   (( segid "    " and resid 50   and name HB2 ))
      4.800     4.800     1.200 peak  1742 spectrum    1 weight  0.11000E+01 volume  0.11570E-02 ppm1      1.036 ppm2      1.418 CV     1
 ASSI { 1743}
   (  segid "    " and resid 51   and name HG1%)
   (( segid "    " and resid 50   and name HG  ))
      4.800     4.800     1.200 peak  1743 spectrum    1 weight  0.11000E+01 volume  0.13490E-02 ppm1      1.054 ppm2      1.583 CV     1
 ASSI { 1744}
   (  segid "    " and resid 51   and name HG1%)
   (( segid "    " and resid 52   and name HG2 ))
      4.900     4.900     1.100 peak  1744 spectrum    1 weight  0.11000E+01 volume  0.89119E-03 ppm1      1.060 ppm2      1.754 CV     1
 ASSI { 1745}
   (  segid "    " and resid 51   and name HG1%)
   (( segid "    " and resid 52   and name HB2 ))
      4.400     4.400     1.600 peak  1745 spectrum    1 weight  0.11000E+01 volume  0.14179E-02 ppm1      1.060 ppm2      1.892 CV     1
 ASSI { 1747}
   (  segid "    " and resid 51   and name HG1%)
   (( segid "    " and resid 110  and name HB1 ))
      4.600     4.600     1.400 peak  1747 spectrum    1 weight  0.11000E+01 volume  0.13191E-02 ppm1      1.097 ppm2      2.230 CV     1
 ASSI { 1748}
   (  segid "    " and resid 51   and name HG1%)
   (( segid "    " and resid 52   and name HD2 ))
      3.700     3.700     2.300 peak  1748 spectrum    1 weight  0.11000E+01 volume  0.90633E-03 ppm1      1.063 ppm2      3.636 CV     1
 ASSI { 1749}
   (  segid "    " and resid 51   and name HG1%)
   (( segid "    " and resid 111  and name HB  ))
      4.000     2.000     2.000 peak  1749 spectrum    1 weight  0.11000E+01 volume  0.23833E-02 ppm1      1.066 ppm2      3.781 CV     1
 ASSI { 1750}
   (  segid "    " and resid 51   and name HG1%)
   (( segid "    " and resid 49   and name HA  ))
      3.700     3.700     2.300 peak  1750 spectrum    1 weight  0.11000E+01 volume  0.32103E-02 ppm1      1.065 ppm2      3.990 CV     1
 ASSI { 1751}
   (  segid "    " and resid 51   and name HG1%)
   (( segid "    " and resid 52   and name HA  ))
      4.000     4.000     2.000 peak  1751 spectrum    1 weight  0.11000E+01 volume  0.11124E-02 ppm1      1.066 ppm2      4.393 CV     1
 ASSI { 1753}
   (  segid "    " and resid 51   and name HG2%)
   (  segid "    " and resid 111  and name HG2%)
      4.200     4.200     1.800 peak  1753 spectrum    1 weight  0.11000E+01 volume  0.15203E-02 ppm1      0.910 ppm2      1.198 CV     1
 ASSI { 1754}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 50   and name HB2 ))
      3.100     3.100     2.900 peak  1754 spectrum    1 weight  0.11000E+01 volume  0.13657E-02 ppm1      0.911 ppm2      1.459 CV     1
 ASSI { 1755}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 50   and name HB1 ))
      3.700     3.700     2.300 peak  1755 spectrum    1 weight  0.11000E+01 volume  0.19170E-02 ppm1      0.915 ppm2      1.545 CV     1
 ASSI { 1756}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 52   and name HB2 ))
      5.100     5.100     0.900 peak  1756 spectrum    1 weight  0.11000E+01 volume  0.97193E-03 ppm1      0.918 ppm2      1.888 CV     1
 ASSI { 1757}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 110  and name HB2 ))
      4.200     4.200     1.800 peak  1757 spectrum    1 weight  0.11000E+01 volume  0.16087E-02 ppm1      0.910 ppm2      1.977 CV     1
 ASSI { 1758}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 52   and name HD2 ))
      4.800     2.900     1.200 peak  1758 spectrum    1 weight  0.11000E+01 volume  0.12347E-02 ppm1      0.920 ppm2      3.628 CV     1
 ASSI { 1759}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 111  and name HB  ))
      3.100     3.100     2.900 peak  1759 spectrum    1 weight  0.11000E+01 volume  0.24846E-02 ppm1      0.906 ppm2      3.780 CV     1
 ASSI { 1760}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 111  and name HA  ))
      3.800     3.800     2.200 peak  1760 spectrum    1 weight  0.11000E+01 volume  0.27174E-02 ppm1      0.923 ppm2      5.620 CV     1
 ASSI { 1762}
   (( segid "    " and resid 51   and name HB  ))
   (( segid "    " and resid 50   and name HB2 ))
      4.900     4.900     1.100 peak  1762 spectrum    1 weight  0.11000E+01 volume  0.27156E-03 ppm1      2.033 ppm2      1.417 CV     1
 ASSI { 1763}
   (( segid "    " and resid 51   and name HB  ))
   (( segid "    " and resid 52   and name HD2 ))
      5.800     4.300     0.200 peak  1763 spectrum    1 weight  0.11000E+01 volume  0.18829E-03 ppm1      2.059 ppm2      3.622 CV     1
 ASSI { 1764}
   (( segid "    " and resid 51   and name HB  ))
   (( segid "    " and resid 49   and name HA  ))
      5.400     3.600     0.600 peak  1764 spectrum    1 weight  0.11000E+01 volume  0.25184E-03 ppm1      2.054 ppm2      3.976 CV     1
 ASSI { 1765}
   (( segid "    " and resid 51   and name HB  ))
   (( segid "    " and resid 52   and name HA  ))
      4.400     2.400     1.600 peak  1765 spectrum    1 weight  0.11000E+01 volume  0.58771E-03 ppm1      2.044 ppm2      4.398 CV     1
 ASSI { 1766}
   (  segid "    " and resid 114  and name HG1%)
   (( segid "    " and resid 47   and name HA  ))
      3.200     1.300     1.300 peak  1766 spectrum    1 weight  0.11000E+01 volume  0.13494E-02 ppm1      0.922 ppm2      5.945 CV     1
 ASSI { 1767}
   (  segid "    " and resid 61   and name HG1%)
   (( segid "    " and resid 62   and name HD1 ))
      3.900     1.900     1.900 peak  1767 spectrum    1 weight  0.11000E+01 volume  0.24779E-02 ppm1      0.935 ppm2      1.743 CV     1
 ASSI { 1771}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 89   and name HA  ))
      3.400     1.400     1.400 peak  1771 spectrum    1 weight  0.11000E+01 volume  0.94006E-03 ppm1      4.266 ppm2      4.589 CV     1
 ASSI { 1777}
   (  segid "    " and resid 108  and name HG2%)
   (  segid "    " and resid 66   and name HG1%)
      3.300     3.300     2.700 peak  1777 spectrum    1 weight  0.10000E+01 volume  0.53684E-02 ppm1      0.861 ppm2      0.690 CV     1
 ASSI { 1781}
   (  segid "    " and resid 65   and name HG1%)
   (( segid "    " and resid 66   and name HA  ))
      3.500     3.500     2.500 peak  1781 spectrum    1 weight  0.11000E+01 volume  0.19827E-02 ppm1      0.847 ppm2      5.066 CV     1
 ASSI { 1784}
   (  segid "    " and resid 65   and name HG1%)
   (( segid "    " and resid 87   and name HA  ))
      4.800     4.800     1.200 peak  1784 spectrum    1 weight  0.11000E+01 volume  0.80894E-03 ppm1      0.843 ppm2      5.377 CV     1
 ASSI { 1787}
   (  segid "    " and resid 44   and name HD2%)
   (( segid "    " and resid 45   and name HN  ))
      4.000     2.000     2.000 peak  1787 spectrum    1 weight  0.10000E+01 volume  0.12658E-03 ppm1      0.830 ppm2      8.368 CV     1
 ASSI { 1788}
   (  segid "    " and resid 65   and name HG2%)
   (  segid "    " and resid 66   and name HG2%)
      5.700     5.700     0.300 peak  1788 spectrum    1 weight  0.11000E+01 volume  0.23437E-03 ppm1      0.478 ppm2      0.031 CV     1
 ASSI { 1789}
   (  segid "    " and resid 65   and name HG2%)
   (  segid "    " and resid 87   and name HG2%)
      2.600     0.800     0.800 peak  1789 spectrum    1 weight  0.11000E+01 volume  0.58676E-02 ppm1      0.466 ppm2      0.730 CV     1
 ASSI { 1793}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 87   and name HB  ))
      5.300     3.500     0.700 peak  1793 spectrum    1 weight  0.10000E+01 volume  0.31087E-03 ppm1      0.463 ppm2      1.896 CV     1
 ASSI { 1794}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 148  and name HB  ))
      5.000     3.100     1.000 peak  1794 spectrum    1 weight  0.11000E+01 volume  0.21996E-03 ppm1      0.467 ppm2      2.114 CV     1
 ASSI { 1797}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 89   and name HA  ))
      4.800     2.800     1.200 peak  1797 spectrum    1 weight  0.11000E+01 volume  0.50486E-03 ppm1      0.462 ppm2      4.591 CV     1
 ASSI { 1800}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 66   and name HA  ))
      4.100     2.100     1.900 peak  1800 spectrum    1 weight  0.11000E+01 volume  0.44158E-03 ppm1      0.466 ppm2      5.061 CV     1
 ASSI { 1805}
   (( segid "    " and resid 66   and name HA  ))
   (  segid "    " and resid 144  and name HD2%)
      5.700     5.700     0.300 peak  1805 spectrum    1 weight  0.11000E+01 volume  0.33292E-03 ppm1      5.067 ppm2      0.898 CV     1
 ASSI { 1807}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 65   and name HA  ))
      5.400     3.600     0.600 peak  1807 spectrum    1 weight  0.11000E+01 volume  0.18035E-03 ppm1      5.072 ppm2      4.288 CV     1
 ASSI { 1812}
   (( segid "    " and resid 66   and name HA  ))
   (  segid "    " and resid 88   and name HE% )
      6.000     6.000     0.000 peak  1812 spectrum    1 weight  0.11000E+01 volume  0.11578E-03 ppm1      5.040 ppm2      7.174 CV     1
 ASSI { 1814}
   (( segid "    " and resid 66   and name HB  ))
   (  segid "    " and resid 65   and name HG2%)
      5.900     4.400     0.100 peak  1814 spectrum    1 weight  0.11000E+01 volume  0.13957E-03 ppm1      1.701 ppm2      0.453 CV     1
 ASSI { 1815}
   (( segid "    " and resid 66   and name HB  ))
   (  segid "    " and resid 90   and name HD2%)
      5.000     5.000     1.000 peak  1815 spectrum    1 weight  0.11000E+01 volume  0.50909E-03 ppm1      1.681 ppm2      0.765 CV     1
 ASSI { 1816}
   (( segid "    " and resid 66   and name HB  ))
   (  segid "    " and resid 148  and name HG1%)
      4.200     4.200     1.800 peak  1816 spectrum    1 weight  0.11000E+01 volume  0.14829E-02 ppm1      1.688 ppm2      0.893 CV     1
 ASSI { 1817}
   (( segid "    " and resid 66   and name HB  ))
   (  segid "    " and resid 103  and name HG2%)
      4.300     2.300     1.700 peak  1817 spectrum    1 weight  0.11000E+01 volume  0.77027E-03 ppm1      1.687 ppm2      1.054 CV     1
 ASSI { 1820}
   (( segid "    " and resid 66   and name HB  ))
   (( segid "    " and resid 60   and name HG2 ))
      4.000     2.000     2.000 peak  1820 spectrum    1 weight  0.10000E+01 volume  0.15508E-02 ppm1      1.696 ppm2      1.875 CV     1
 ASSI { 1824}
   (( segid "    " and resid 66   and name HB  ))
   (( segid "    " and resid 68   and name HA  ))
      6.000     4.500     0.000 peak  1824 spectrum    1 weight  0.11000E+01 volume  0.80307E-04 ppm1      1.688 ppm2      5.595 CV     1
 ASSI { 1825}
   (( segid "    " and resid 66   and name HB  ))
   (  segid "    " and resid 88   and name HE% )
      6.000     5.500     0.000 peak  1825 spectrum    1 weight  0.11000E+01 volume  0.47444E-04 ppm1      1.697 ppm2      7.186 CV     1
 ASSI { 1826}
   (( segid "    " and resid 66   and name HB  ))
   (  segid "    " and resid 88   and name HD% )
      6.000     5.700     0.000 peak  1826 spectrum    1 weight  0.11000E+01 volume  0.52731E-04 ppm1      1.691 ppm2      6.968 CV     1
 ASSI { 1833}
   (  segid "    " and resid 66   and name HG1%)
   (( segid "    " and resid 64   and name HB1 ))
      4.800     2.900     1.200 peak  1833 spectrum    1 weight  0.10000E+01 volume  0.38302E-03 ppm1      0.685 ppm2      2.209 CV     1
 ASSI { 1834}
   (  segid "    " and resid 66   and name HG1%)
   (( segid "    " and resid 103  and name HB  ))
      5.100     3.300     0.900 peak  1834 spectrum    1 weight  0.11000E+01 volume  0.32354E-03 ppm1      0.685 ppm2      2.305 CV     1
 ASSI { 1835}
   (  segid "    " and resid 66   and name HG1%)
   (( segid "    " and resid 64   and name HG1 ))
      5.800     4.200     0.200 peak  1835 spectrum    1 weight  0.10000E+01 volume  0.15126E-03 ppm1      0.685 ppm2      2.466 CV     1
 ASSI { 1836}
   (  segid "    " and resid 66   and name HG1%)
   (( segid "    " and resid 146  and name HB  ))
      6.000     6.000     0.000 peak  1836 spectrum    1 weight  0.11000E+01 volume  0.12826E-03 ppm1      0.678 ppm2      4.026 CV     1
 ASSI { 1837}
   (  segid "    " and resid 66   and name HG1%)
   (( segid "    " and resid 65   and name HA  ))
      4.900     3.000     1.100 peak  1837 spectrum    1 weight  0.11000E+01 volume  0.22743E-03 ppm1      0.675 ppm2      4.277 CV     1
 ASSI { 1838}
   (  segid "    " and resid 66   and name HG1%)
   (( segid "    " and resid 90   and name HA  ))
      5.500     5.500     0.500 peak  1838 spectrum    1 weight  0.11000E+01 volume  0.19842E-03 ppm1      0.670 ppm2      4.336 CV     1
 ASSI { 1839}
   (  segid "    " and resid 66   and name HG1%)
   (( segid "    " and resid 64   and name HA  ))
      4.600     2.600     1.400 peak  1839 spectrum    1 weight  0.10000E+01 volume  0.47133E-03 ppm1      0.685 ppm2      4.455 CV     1
 ASSI { 1841}
   (  segid "    " and resid 66   and name HG1%)
   (( segid "    " and resid 88   and name HZ  ))
      5.800     5.800     0.200 peak  1841 spectrum    1 weight  0.11000E+01 volume  0.15123E-03 ppm1      0.670 ppm2      6.838 CV     1
 ASSI { 1842}
   (  segid "    " and resid 66   and name HG1%)
   (  segid "    " and resid 88   and name HD% )
      6.000     6.000     0.000 peak  1842 spectrum    1 weight  0.11000E+01 volume  0.13593E-03 ppm1      0.675 ppm2      6.965 CV     1
 ASSI { 1843}
   (  segid "    " and resid 66   and name HG1%)
   (  segid "    " and resid 88   and name HE% )
      5.600     4.000     0.400 peak  1843 spectrum    1 weight  0.11000E+01 volume  0.26024E-03 ppm1      0.683 ppm2      7.179 CV     1
 ASSI { 1845}
   (  segid "    " and resid 66   and name HG2%)
   (  segid "    " and resid 90   and name HD2%)
      3.800     1.800     1.800 peak  1845 spectrum    1 weight  0.11000E+01 volume  0.12723E-02 ppm1      0.033 ppm2      0.749 CV     1
 ASSI { 1846}
   (  segid "    " and resid 66   and name HG2%)
   (  segid "    " and resid 144  and name HD2%)
      4.100     2.100     1.900 peak  1846 spectrum    1 weight  0.11000E+01 volume  0.11565E-02 ppm1      0.029 ppm2      0.901 CV     1
 ASSI { 1847}
   (  segid "    " and resid 66   and name HG2%)
   (  segid "    " and resid 68   and name HG2%)
      3.600     1.600     1.600 peak  1847 spectrum    1 weight  0.11000E+01 volume  0.15242E-02 ppm1      0.026 ppm2      0.964 CV     1
 ASSI { 1848}
   (  segid "    " and resid 66   and name HG2%)
   (  segid "    " and resid 103  and name HG2%)
      2.800     1.000     1.000 peak  1848 spectrum    1 weight  0.11000E+01 volume  0.28305E-02 ppm1      0.025 ppm2      1.038 CV     1
 ASSI { 1849}
   (  segid "    " and resid 66   and name HG2%)
   (  segid "    " and resid 103  and name HG1%)
      3.300     1.300     1.300 peak  1849 spectrum    1 weight  0.11000E+01 volume  0.90768E-03 ppm1      0.031 ppm2      1.307 CV     1
 ASSI { 1850}
   (  segid "    " and resid 66   and name HG2%)
   (( segid "    " and resid 90   and name HB2 ))
      3.500     1.500     1.500 peak  1850 spectrum    1 weight  0.11000E+01 volume  0.62338E-03 ppm1      0.023 ppm2      1.447 CV     1
 ASSI { 1851}
   (  segid "    " and resid 66   and name HG2%)
   (( segid "    " and resid 90   and name HG  ))
      4.800     2.900     1.200 peak  1851 spectrum    1 weight  0.11000E+01 volume  0.61170E-03 ppm1      0.022 ppm2      1.603 CV     1
 ASSI { 1853}
   (  segid "    " and resid 66   and name HG2%)
   (( segid "    " and resid 103  and name HB  ))
      5.400     3.700     0.600 peak  1853 spectrum    1 weight  0.11000E+01 volume  0.17567E-03 ppm1      0.032 ppm2      2.288 CV     1
 ASSI { 1855}
   (  segid "    " and resid 66   and name HG2%)
   (( segid "    " and resid 67   and name HB  ))
      6.000     6.000     0.000 peak  1855 spectrum    1 weight  0.11000E+01 volume  0.95253E-04 ppm1      0.035 ppm2      4.003 CV     1
 ASSI { 1856}
   (  segid "    " and resid 66   and name HG2%)
   (( segid "    " and resid 90   and name HA  ))
      5.200     3.400     0.800 peak  1856 spectrum    1 weight  0.11000E+01 volume  0.28680E-03 ppm1      0.031 ppm2      4.357 CV     1
 ASSI { 1858}
   (  segid "    " and resid 66   and name HG2%)
   (( segid "    " and resid 89   and name HA  ))
      5.500     5.500     0.500 peak  1858 spectrum    1 weight  0.11000E+01 volume  0.33364E-03 ppm1      0.024 ppm2      4.603 CV     1
 ASSI { 1859}
   (  segid "    " and resid 66   and name HG2%)
   (( segid "    " and resid 144  and name HA  ))
      4.800     2.900     1.200 peak  1859 spectrum    1 weight  0.10000E+01 volume  0.56324E-03 ppm1      0.025 ppm2      4.693 CV     1
 ASSI { 1860}
   (  segid "    " and resid 66   and name HG2%)
   (( segid "    " and resid 87   and name HA  ))
      5.200     3.400     0.800 peak  1860 spectrum    1 weight  0.11000E+01 volume  0.17314E-03 ppm1      0.022 ppm2      5.348 CV     1
 ASSI { 1865}
   (  segid "    " and resid 147  and name HB% )
   (( segid "    " and resid 66   and name HA  ))
      3.900     1.900     1.900 peak  1865 spectrum    1 weight  0.11000E+01 volume  0.27370E-02 ppm1      1.123 ppm2      5.074 CV     1
 ASSI { 1866}
   (  segid "    " and resid 147  and name HB% )
   (( segid "    " and resid 66   and name HB  ))
      3.600     1.600     1.600 peak  1866 spectrum    1 weight  0.11000E+01 volume  0.31851E-02 ppm1      1.128 ppm2      1.684 CV     1
 ASSI { 1868}
   (  segid "    " and resid 103  and name HG2%)
   (  segid "    " and resid 66   and name HG1%)
      3.900     1.900     1.900 peak  1868 spectrum    1 weight  0.11000E+01 volume  0.16467E-02 ppm1      1.029 ppm2      0.680 CV     1
 ASSI { 1879}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 67   and name HB  ))
      6.000     6.000     0.000 peak  1879 spectrum    1 weight  0.11000E+01 volume  0.75811E-04 ppm1      5.050 ppm2      4.003 CV     1
 ASSI { 1880}
   (( segid "    " and resid 67   and name HB  ))
   (( segid "    " and resid 66   and name HB  ))
      4.400     2.400     1.600 peak  1880 spectrum    1 weight  0.11000E+01 volume  0.73347E-03 ppm1      3.992 ppm2      1.694 CV     1
 ASSI { 1884}
   (( segid "    " and resid 68   and name HA  ))
   (  segid "    " and resid 66   and name HG2%)
      6.000     6.000     0.000 peak  1884 spectrum    1 weight  0.11000E+01 volume  0.45131E-04 ppm1      5.591 ppm2      0.035 CV     1
 ASSI { 1885}
   (( segid "    " and resid 68   and name HA  ))
   (  segid "    " and resid 144  and name HD2%)
      5.400     5.400     0.600 peak  1885 spectrum    1 weight  0.11000E+01 volume  0.43786E-03 ppm1      5.595 ppm2      0.871 CV     1
 ASSI { 1886}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 144  and name HB2 ))
      5.600     3.900     0.400 peak  1886 spectrum    1 weight  0.11000E+01 volume  0.16729E-03 ppm1      5.592 ppm2      1.304 CV     1
 ASSI { 1888}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 86   and name HB1 ))
      6.000     6.000     0.000 peak  1888 spectrum    1 weight  0.11000E+01 volume  0.46373E-04 ppm1      5.593 ppm2      2.052 CV     1
 ASSI { 1893}
   (( segid "    " and resid 68   and name HB  ))
   (  segid "    " and resid 142  and name HG1%)
      3.400     1.400     1.400 peak  1893 spectrum    1 weight  0.11000E+01 volume  0.13601E-02 ppm1      2.237 ppm2      0.859 CV     1
 OR { 1893}
   (( segid "    " and resid 68   and name HB  ))
   (  segid "    " and resid 142  and name HG2%)
 ASSI { 1894}
   (( segid "    " and resid 68   and name HB  ))
   (( segid "    " and resid 144  and name HB2 ))
      4.700     4.700     1.300 peak  1894 spectrum    1 weight  0.11000E+01 volume  0.49681E-03 ppm1      2.189 ppm2      1.303 CV     1
 ASSI { 1895}
   (( segid "    " and resid 68   and name HB  ))
   (( segid "    " and resid 86   and name HB1 ))
      3.600     1.600     1.600 peak  1895 spectrum    1 weight  0.11000E+01 volume  0.31574E-02 ppm1      2.219 ppm2      2.051 CV     1
 ASSI { 1897}
   (( segid "    " and resid 68   and name HB  ))
   (( segid "    " and resid 88   and name HZ  ))
      6.000     6.000     0.000 peak  1897 spectrum    1 weight  0.11000E+01 volume  0.85103E-04 ppm1      2.231 ppm2      6.836 CV     1
 ASSI { 1898}
   (( segid "    " and resid 68   and name HB  ))
   (( segid "    " and resid 69   and name HD2 ))
      5.500     3.800     0.500 peak  1898 spectrum    1 weight  0.11000E+01 volume  0.15700E-03 ppm1      2.201 ppm2      6.915 CV     1
 ASSI { 1899}
   (( segid "    " and resid 68   and name HB  ))
   (  segid "    " and resid 88   and name HE% )
      5.800     4.200     0.200 peak  1899 spectrum    1 weight  0.11000E+01 volume  0.18303E-03 ppm1      2.224 ppm2      7.176 CV     1
 ASSI { 1901}
   (  segid "    " and resid 68   and name HG1%)
   (( segid "    " and resid 86   and name HB1 ))
      4.000     2.000     2.000 peak  1901 spectrum    1 weight  0.11000E+01 volume  0.34088E-02 ppm1      1.098 ppm2      2.062 CV     1
 ASSI { 1902}
   (  segid "    " and resid 68   and name HG1%)
   (( segid "    " and resid 144  and name HB2 ))
      3.100     1.200     1.200 peak  1902 spectrum    1 weight  0.11000E+01 volume  0.14530E-02 ppm1      1.085 ppm2      1.307 CV     1
 ASSI { 1904}
   (  segid "    " and resid 68   and name HG1%)
   (( segid "    " and resid 143  and name HB  ))
      4.100     2.100     1.900 peak  1904 spectrum    1 weight  0.10000E+01 volume  0.18385E-02 ppm1      1.085 ppm2      4.103 CV     1
 ASSI { 1907}
   (  segid "    " and resid 68   and name HG1%)
   (  segid "    " and resid 88   and name HD% )
      4.800     2.800     1.200 peak  1907 spectrum    1 weight  0.11000E+01 volume  0.62330E-03 ppm1      1.093 ppm2      6.968 CV     1
 ASSI { 1911}
   (  segid "    " and resid 68   and name HG2%)
   (  segid "    " and resid 99   and name HD2%)
      2.100     2.100     3.900 peak  1911 spectrum    1 weight  0.11000E+01 volume  0.87261E-02 ppm1      0.960 ppm2      0.776 CV     1
 ASSI { 1912}
   (  segid "    " and resid 68   and name HG2%)
   (( segid "    " and resid 144  and name HB2 ))
      3.800     3.800     2.200 peak  1912 spectrum    1 weight  0.11000E+01 volume  0.24203E-02 ppm1      0.961 ppm2      1.307 CV     1
 ASSI { 1916}
   (  segid "    " and resid 68   and name HG2%)
   (( segid "    " and resid 88   and name HZ  ))
      5.300     3.600     0.700 peak  1916 spectrum    1 weight  0.11000E+01 volume  0.28845E-03 ppm1      0.958 ppm2      6.849 CV     1
 ASSI { 1917}
   (  segid "    " and resid 68   and name HG2%)
   (  segid "    " and resid 88   and name HD% )
      3.800     1.800     1.800 peak  1917 spectrum    1 weight  0.11000E+01 volume  0.43281E-03 ppm1      0.961 ppm2      6.962 CV     1
 ASSI { 1919}
   (  segid "    " and resid 143  and name HG2%)
   (( segid "    " and resid 145  and name HG1 ))
      4.200     2.200     1.800 peak  1919 spectrum    1 weight  0.11000E+01 volume  0.17239E-02 ppm1      1.069 ppm2      1.586 CV     1
 ASSI { 1921}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 87   and name HA  ))
      6.000     6.000     0.000 peak  1921 spectrum    1 weight  0.11000E+01 volume  0.10851E-03 ppm1      5.612 ppm2      5.378 CV     1
 ASSI { 1926}
   (( segid "    " and resid 80   and name HB  ))
   (  segid "    " and resid 72   and name HG2%)
      4.700     4.700     1.300 peak  1926 spectrum    1 weight  0.11000E+01 volume  0.87254E-03 ppm1      2.004 ppm2      1.179 CV     1
 ASSI { 1929}
   (( segid "    " and resid 80   and name HB  ))
   (( segid "    " and resid 72   and name HB  ))
      5.000     3.100     1.000 peak  1929 spectrum    1 weight  0.11000E+01 volume  0.77787E-03 ppm1      2.008 ppm2      4.024 CV     1
 ASSI { 1930}
   (( segid "    " and resid 80   and name HB  ))
   (( segid "    " and resid 73   and name HA  ))
      6.000     6.000     0.000 peak  1930 spectrum    1 weight  0.11000E+01 volume  0.19081E-03 ppm1      2.009 ppm2      5.563 CV     1
 ASSI { 1931}
   (  segid "    " and resid 80   and name HG1%)
   (( segid "    " and resid 81   and name HG1 ))
      6.000     6.000     0.000 peak  1931 spectrum    1 weight  0.11000E+01 volume  0.47597E-03 ppm1      0.928 ppm2      2.363 CV     1
 ASSI { 1933}
   (  segid "    " and resid 80   and name HG2%)
   (( segid "    " and resid 81   and name HB1 ))
      3.600     1.600     1.600 peak  1933 spectrum    1 weight  0.11000E+01 volume  0.91358E-03 ppm1      0.792 ppm2      2.128 CV     1
 ASSI { 1934}
   (( segid "    " and resid 80   and name HA  ))
   (  segid "    " and resid 72   and name HG2%)
      5.500     5.500     0.500 peak  1934 spectrum    1 weight  0.11000E+01 volume  0.31746E-03 ppm1      4.418 ppm2      1.184 CV     1
 ASSI { 1936}
   (( segid "    " and resid 72   and name HB  ))
   (( segid "    " and resid 81   and name HB2 ))
      4.200     4.200     1.800 peak  1936 spectrum    1 weight  0.11000E+01 volume  0.18691E-02 ppm1      4.028 ppm2      1.996 CV     1
 ASSI { 1937}
   (( segid "    " and resid 72   and name HB  ))
   (  segid "    " and resid 80   and name HG2%)
      4.400     2.400     1.600 peak  1937 spectrum    1 weight  0.11000E+01 volume  0.75916E-03 ppm1      4.030 ppm2      0.830 CV     1
 ASSI { 1939}
   (  segid "    " and resid 80   and name HG2%)
   (( segid "    " and resid 73   and name HA  ))
      4.100     2.100     1.900 peak  1939 spectrum    1 weight  0.11000E+01 volume  0.14675E-02 ppm1      0.824 ppm2      5.547 CV     1
 ASSI { 1942}
   (( segid "    " and resid 87   and name HA  ))
   (( segid "    " and resid 67   and name HB  ))
      5.400     3.600     0.600 peak  1942 spectrum    1 weight  0.11000E+01 volume  0.33686E-03 ppm1      5.359 ppm2      3.993 CV     1
 ASSI { 1947}
   (( segid "    " and resid 87   and name HA  ))
   (( segid "    " and resid 88   and name HA  ))
      6.000     6.000     0.000 peak  1947 spectrum    1 weight  0.11000E+01 volume  0.77802E-04 ppm1      5.367 ppm2      4.963 CV     1
 ASSI { 1948}
   (( segid "    " and resid 87   and name HA  ))
   (  segid "    " and resid 88   and name HD% )
      4.700     2.700     1.300 peak  1948 spectrum    1 weight  0.11000E+01 volume  0.25160E-03 ppm1      5.353 ppm2      6.965 CV     1
 ASSI { 1949}
   (( segid "    " and resid 87   and name HA  ))
   (  segid "    " and resid 88   and name HE% )
      6.000     5.000     0.000 peak  1949 spectrum    1 weight  0.11000E+01 volume  0.74376E-04 ppm1      5.363 ppm2      7.172 CV     1
 ASSI { 1952}
   (( segid "    " and resid 87   and name HB  ))
   (  segid "    " and resid 67   and name HG2%)
      4.500     2.500     1.500 peak  1952 spectrum    1 weight  0.11000E+01 volume  0.40807E-03 ppm1      1.883 ppm2      1.072 CV     1
 ASSI { 1953}
   (( segid "    " and resid 23   and name HB2 ))
   (  segid "    " and resid 22   and name HB% )
      4.300     2.300     1.700 peak  1953 spectrum    1 weight  0.10000E+01 volume  0.75370E-03 ppm1      1.876 ppm2      1.422 CV     1
 ASSI { 1954}
   (( segid "    " and resid 87   and name HB  ))
   (( segid "    " and resid 86   and name HG  ))
      5.100     3.300     0.900 peak  1954 spectrum    1 weight  0.11000E+01 volume  0.40757E-03 ppm1      1.877 ppm2      1.595 CV     1
 ASSI { 1956}
   (( segid "    " and resid 87   and name HB  ))
   (( segid "    " and resid 67   and name HN  ))
      6.000     6.000     0.000 peak  1956 spectrum    1 weight  0.11000E+01 volume  0.53523E-04 ppm1      1.876 ppm2      7.775 CV     1
 ASSI { 1958}
   (  segid "    " and resid 87   and name HG1%)
   (  segid "    " and resid 66   and name HG2%)
      4.400     4.400     1.600 peak  1958 spectrum    1 weight  0.11000E+01 volume  0.10961E-02 ppm1      0.965 ppm2      0.027 CV     1
 ASSI { 1959}
   (  segid "    " and resid 87   and name HG1%)
   (  segid "    " and resid 65   and name HG2%)
      3.100     1.200     1.200 peak  1959 spectrum    1 weight  0.11000E+01 volume  0.19943E-02 ppm1      0.985 ppm2      0.464 CV     1
 ASSI { 1961}
   (  segid "    " and resid 87   and name HG1%)
   (  segid "    " and resid 88   and name HD% )
      5.100     3.200     0.900 peak  1961 spectrum    1 weight  0.11000E+01 volume  0.38163E-03 ppm1      0.962 ppm2      6.962 CV     1
 ASSI { 1965}
   (  segid "    " and resid 87   and name HG2%)
   (  segid "    " and resid 65   and name HG1%)
      3.100     3.100     2.900 peak  1965 spectrum    1 weight  0.11000E+01 volume  0.68690E-02 ppm1      0.735 ppm2      0.855 CV     1
 ASSI { 1967}
   (  segid "    " and resid 87   and name HG2%)
   (( segid "    " and resid 66   and name HB  ))
      4.500     4.500     1.500 peak  1967 spectrum    1 weight  0.11000E+01 volume  0.59206E-03 ppm1      0.725 ppm2      1.721 CV     1
 ASSI { 1968}
   (  segid "    " and resid 87   and name HG2%)
   (( segid "    " and resid 88   and name HB1 ))
      5.800     5.800     0.200 peak  1968 spectrum    1 weight  0.11000E+01 volume  0.21384E-03 ppm1      0.735 ppm2      3.136 CV     1
 OR { 1968}
   (  segid "    " and resid 87   and name HG2%)
   (( segid "    " and resid 88   and name HB2 ))
 ASSI { 1969}
   (  segid "    " and resid 87   and name HG2%)
   (( segid "    " and resid 67   and name HB  ))
      6.000     5.400     0.000 peak  1969 spectrum    1 weight  0.11000E+01 volume  0.91847E-04 ppm1      0.750 ppm2      3.985 CV     1
 ASSI { 1970}
   (  segid "    " and resid 87   and name HG2%)
   (( segid "    " and resid 65   and name HA  ))
      5.100     3.300     0.900 peak  1970 spectrum    1 weight  0.11000E+01 volume  0.39398E-03 ppm1      0.732 ppm2      4.269 CV     1
 ASSI { 1972}
   (  segid "    " and resid 87   and name HG2%)
   (( segid "    " and resid 88   and name HA  ))
      4.600     4.600     1.400 peak  1972 spectrum    1 weight  0.11000E+01 volume  0.61668E-03 ppm1      0.729 ppm2      4.969 CV     1
 ASSI { 1973}
   (  segid "    " and resid 87   and name HG2%)
   (( segid "    " and resid 66   and name HA  ))
      4.400     2.400     1.600 peak  1973 spectrum    1 weight  0.11000E+01 volume  0.37437E-03 ppm1      0.726 ppm2      5.066 CV     1
 ASSI { 1975}
   (  segid "    " and resid 87   and name HG2%)
   (  segid "    " and resid 88   and name HD% )
      6.000     6.000     0.000 peak  1975 spectrum    1 weight  0.11000E+01 volume  0.17034E-03 ppm1      0.732 ppm2      6.966 CV     1
 ASSI { 1977}
   (  segid "    " and resid 87   and name HG2%)
   (  segid "    " and resid 66   and name HG2%)
      5.300     5.300     0.700 peak  1977 spectrum    1 weight  0.11000E+01 volume  0.25807E-03 ppm1      0.727 ppm2      0.020 CV     1
 ASSI { 1978}
   (( segid "    " and resid 87   and name HA  ))
   (  segid "    " and resid 67   and name HG2%)
      3.800     1.800     1.800 peak  1978 spectrum    1 weight  0.11000E+01 volume  0.18414E-02 ppm1      5.322 ppm2      1.070 CV     1
 ASSI { 1979}
   (( segid "    " and resid 87   and name HA  ))
   (( segid "    " and resid 86   and name HG  ))
      5.400     3.600     0.600 peak  1979 spectrum    1 weight  0.11000E+01 volume  0.11276E-03 ppm1      5.346 ppm2      1.604 CV     1
 ASSI { 1980}
   (( segid "    " and resid 87   and name HA  ))
   (( segid "    " and resid 66   and name HB  ))
      5.800     4.200     0.200 peak  1980 spectrum    1 weight  0.11000E+01 volume  0.85188E-04 ppm1      5.333 ppm2      1.705 CV     1
 ASSI { 1982}
   (( segid "    " and resid 87   and name HA  ))
   (( segid "    " and resid 88   and name HB1 ))
      6.000     6.000     0.000 peak  1982 spectrum    1 weight  0.11000E+01 volume  0.35390E-04 ppm1      5.342 ppm2      3.130 CV     1
 ASSI { 1983}
   (( segid "    " and resid 87   and name HB  ))
   (( segid "    " and resid 88   and name HB1 ))
      6.000     5.400     0.000 peak  1983 spectrum    1 weight  0.11000E+01 volume  0.74206E-04 ppm1      1.919 ppm2      3.146 CV     1
 OR { 1983}
   (( segid "    " and resid 87   and name HB  ))
   (( segid "    " and resid 88   and name HB2 ))
 ASSI { 1985}
   (( segid "    " and resid 87   and name HB  ))
   (( segid "    " and resid 67   and name HB  ))
      4.900     2.900     1.100 peak  1985 spectrum    1 weight  0.11000E+01 volume  0.49216E-03 ppm1      1.891 ppm2      3.980 CV     1
 ASSI { 1986}
   (  segid "    " and resid 87   and name HG1%)
   (( segid "    " and resid 67   and name HB  ))
      5.600     5.600     0.400 peak  1986 spectrum    1 weight  0.11000E+01 volume  0.39572E-03 ppm1      0.978 ppm2      3.992 CV     1
 ASSI { 1992}
   (( segid "    " and resid 87   and name HB  ))
   (( segid "    " and resid 88   and name HA  ))
      6.000     4.700     0.000 peak  1992 spectrum    1 weight  0.11000E+01 volume  0.83111E-04 ppm1      1.907 ppm2      4.966 CV     1
 ASSI { 1993}
   (( segid "    " and resid 87   and name HB  ))
   (( segid "    " and resid 66   and name HA  ))
      6.000     6.000     0.000 peak  1993 spectrum    1 weight  0.11000E+01 volume  0.12985E-03 ppm1      1.912 ppm2      5.049 CV     1
 ASSI { 1994}
   (  segid "    " and resid 87   and name HG2%)
   (  segid "    " and resid 88   and name HE% )
      6.000     6.000     0.000 peak  1994 spectrum    1 weight  0.11000E+01 volume  0.27319E-04 ppm1      0.759 ppm2      7.190 CV     1
 ASSI { 1995}
   (( segid "    " and resid 95   and name HA  ))
   (  segid "    " and resid 99   and name HD2%)
      6.000     6.000     0.000 peak  1995 spectrum    1 weight  0.11000E+01 volume  0.21611E-03 ppm1      4.284 ppm2      0.779 CV     1
 ASSI { 1999}
   (( segid "    " and resid 95   and name HB  ))
   (( segid "    " and resid 99   and name HB2 ))
      3.800     1.800     1.800 peak  1999 spectrum    1 weight  0.11000E+01 volume  0.16632E-02 ppm1      1.819 ppm2      1.378 CV     1
 OR { 1999}
   (( segid "    " and resid 95   and name HB  ))
   (( segid "    " and resid 99   and name HG  ))
 ASSI { 2000}
   (( segid "    " and resid 95   and name HB  ))
   (( segid "    " and resid 94   and name HB1 ))
      5.000     3.200     1.000 peak  2000 spectrum    1 weight  0.11000E+01 volume  0.47073E-03 ppm1      1.801 ppm2      2.786 CV     1
 ASSI { 2003}
   (( segid "    " and resid 95   and name HB  ))
   (( segid "    " and resid 88   and name HB2 ))
      6.000     6.000     0.000 peak  2003 spectrum    1 weight  0.11000E+01 volume  0.10992E-03 ppm1      1.811 ppm2      3.183 CV     1
 OR { 2003}
   (( segid "    " and resid 95   and name HB  ))
   (( segid "    " and resid 88   and name HB1 ))
 ASSI { 2006}
   (( segid "    " and resid 95   and name HB  ))
   (  segid "    " and resid 88   and name HD% )
      6.000     6.000     0.000 peak  2006 spectrum    1 weight  0.11000E+01 volume  0.81784E-04 ppm1      1.808 ppm2      6.949 CV     1
 ASSI { 2014}
   (  segid "    " and resid 95   and name HG2%)
   (( segid "    " and resid 88   and name HB2 ))
      4.300     2.300     1.700 peak  2014 spectrum    1 weight  0.11000E+01 volume  0.52297E-03 ppm1      0.091 ppm2      3.153 CV     1
 OR { 2014}
   (  segid "    " and resid 95   and name HG2%)
   (( segid "    " and resid 88   and name HB1 ))
 ASSI { 2023}
   (  segid "    " and resid 95   and name HG1%)
   (( segid "    " and resid 96   and name HG12))
      6.000     5.600     0.000 peak  2023 spectrum    1 weight  0.11000E+01 volume  0.85145E-04 ppm1      0.307 ppm2      1.165 CV     1
 ASSI { 2024}
   (  segid "    " and resid 95   and name HG1%)
   (( segid "    " and resid 99   and name HB2 ))
      5.900     4.400     0.100 peak  2024 spectrum    1 weight  0.11000E+01 volume  0.28686E-03 ppm1      0.318 ppm2      1.309 CV     1
 ASSI { 2025}
   (  segid "    " and resid 95   and name HG1%)
   (( segid "    " and resid 99   and name HG  ))
      4.900     3.000     1.100 peak  2025 spectrum    1 weight  0.11000E+01 volume  0.30670E-03 ppm1      0.315 ppm2      1.382 CV     1
 ASSI { 2026}
   (  segid "    " and resid 95   and name HG1%)
   (( segid "    " and resid 99   and name HB1 ))
      5.000     3.100     1.000 peak  2026 spectrum    1 weight  0.11000E+01 volume  0.27071E-03 ppm1      0.321 ppm2      1.499 CV     1
 ASSI { 2027}
   (  segid "    " and resid 95   and name HG1%)
   (( segid "    " and resid 86   and name HG  ))
      5.000     3.100     1.000 peak  2027 spectrum    1 weight  0.11000E+01 volume  0.27758E-03 ppm1      0.326 ppm2      1.602 CV     1
 ASSI { 2028}
   (  segid "    " and resid 95   and name HG1%)
   (( segid "    " and resid 100  and name HB2 ))
      6.000     5.500     0.000 peak  2028 spectrum    1 weight  0.11000E+01 volume  0.11324E-03 ppm1      0.325 ppm2      2.407 CV     1
 ASSI { 2031}
   (  segid "    " and resid 95   and name HG1%)
   (( segid "    " and resid 88   and name HB1 ))
      3.100     1.200     1.200 peak  2031 spectrum    1 weight  0.11000E+01 volume  0.13474E-02 ppm1      0.323 ppm2      3.150 CV     1
 OR { 2031}
   (  segid "    " and resid 95   and name HG1%)
   (( segid "    " and resid 88   and name HB2 ))
 ASSI { 2032}
   (  segid "    " and resid 95   and name HG1%)
   (( segid "    " and resid 100  and name HA  ))
      5.200     3.400     0.800 peak  2032 spectrum    1 weight  0.11000E+01 volume  0.41339E-03 ppm1      0.326 ppm2      4.642 CV     1
 ASSI { 2033}
   (  segid "    " and resid 95   and name HG1%)
   (( segid "    " and resid 88   and name HA  ))
      2.500     2.500     3.500 peak  2033 spectrum    1 weight  0.11000E+01 volume  0.35411E-03 ppm1      0.327 ppm2      4.977 CV     1
 ASSI { 2034}
   (  segid "    " and resid 95   and name HG1%)
   (( segid "    " and resid 88   and name HZ  ))
      5.700     4.100     0.300 peak  2034 spectrum    1 weight  0.11000E+01 volume  0.11448E-03 ppm1      0.322 ppm2      6.859 CV     1
 ASSI { 2036}
   (  segid "    " and resid 95   and name HG1%)
   (  segid "    " and resid 88   and name HE% )
      4.400     2.400     1.600 peak  2036 spectrum    1 weight  0.11000E+01 volume  0.47677E-03 ppm1      0.320 ppm2      7.179 CV     1
 ASSI { 2045}
   (( segid "    " and resid 95   and name HA  ))
   (( segid "    " and resid 100  and name HB2 ))
      6.000     6.000     0.000 peak  2045 spectrum    1 weight  0.11000E+01 volume  0.93624E-04 ppm1      4.268 ppm2      2.407 CV     1
 ASSI { 2046}
   (( segid "    " and resid 100  and name HB2 ))
   (( segid "    " and resid 93   and name HA  ))
      4.100     2.100     1.900 peak  2046 spectrum    1 weight  0.11000E+01 volume  0.17590E-03 ppm1      2.404 ppm2      4.273 CV     1
 ASSI { 2048}
   (  segid "    " and resid 95   and name HG1%)
   (( segid "    " and resid 100  and name HB1 ))
      6.000     6.000     0.000 peak  2048 spectrum    1 weight  0.11000E+01 volume  0.71765E-04 ppm1      0.318 ppm2      2.581 CV     1
 ASSI { 2049}
   (( segid "    " and resid 95   and name HB  ))
   (( segid "    " and resid 100  and name HB1 ))
      6.000     6.000     0.000 peak  2049 spectrum    1 weight  0.11000E+01 volume  0.27041E-04 ppm1      1.813 ppm2      2.590 CV     1
 ASSI { 2057}
   (( segid "    " and resid 99   and name HA  ))
   (  segid "    " and resid 95   and name HG2%)
      5.800     4.200     0.200 peak  2057 spectrum    1 weight  0.11000E+01 volume  0.17545E-03 ppm1      4.186 ppm2      0.093 CV     1
 ASSI { 2058}
   (( segid "    " and resid 95   and name HB  ))
   (( segid "    " and resid 99   and name HA  ))
      6.000     6.000     0.000 peak  2058 spectrum    1 weight  0.11000E+01 volume  0.43996E-04 ppm1      1.827 ppm2      4.194 CV     1
 ASSI { 2064}
   (( segid "    " and resid 103  and name HA  ))
   (  segid "    " and resid 99   and name HD2%)
      6.000     6.000     0.000 peak  2064 spectrum    1 weight  0.11000E+01 volume  0.20363E-03 ppm1      3.974 ppm2      0.774 CV     1
 ASSI { 2065}
   (( segid "    " and resid 103  and name HA  ))
   (  segid "    " and resid 114  and name HG2%)
      6.000     6.000     0.000 peak  2065 spectrum    1 weight  0.11000E+01 volume  0.12054E-03 ppm1      3.968 ppm2      0.889 CV     1
 ASSI { 2066}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 106  and name HB2 ))
      5.900     5.900     0.100 peak  2066 spectrum    1 weight  0.11000E+01 volume  0.20076E-03 ppm1      3.959 ppm2      1.866 CV     1
 ASSI { 2067}
   (( segid "    " and resid 103  and name HA  ))
   (  segid "    " and resid 106  and name HE% )
      4.900     3.000     1.100 peak  2067 spectrum    1 weight  0.11000E+01 volume  0.17871E-03 ppm1      3.970 ppm2      1.970 CV     1
 ASSI { 2068}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 104  and name HG1 ))
      6.000     4.700     0.000 peak  2068 spectrum    1 weight  0.11000E+01 volume  0.23285E-03 ppm1      3.966 ppm2      2.117 CV     1
 ASSI { 2075}
   (( segid "    " and resid 103  and name HB  ))
   (( segid "    " and resid 99   and name HG  ))
      5.200     3.400     0.800 peak  2075 spectrum    1 weight  0.10000E+01 volume  0.23069E-03 ppm1      2.312 ppm2      1.414 CV     1
 ASSI { 2076}
   (( segid "    " and resid 103  and name HB  ))
   (( segid "    " and resid 104  and name HB2 ))
      6.000     5.000     0.000 peak  2076 spectrum    1 weight  0.11000E+01 volume  0.25614E-03 ppm1      2.312 ppm2      1.651 CV     1
 ASSI { 2077}
   (( segid "    " and resid 103  and name HB  ))
   (( segid "    " and resid 105  and name HB2 ))
      5.600     5.600     0.400 peak  2077 spectrum    1 weight  0.11000E+01 volume  0.19483E-03 ppm1      2.312 ppm2      1.696 CV     1
 ASSI { 2078}
   (( segid "    " and resid 103  and name HB  ))
   (( segid "    " and resid 104  and name HG2 ))
      5.300     3.500     0.700 peak  2078 spectrum    1 weight  0.10000E+01 volume  0.42461E-03 ppm1      2.279 ppm2      1.805 CV     1
 ASSI { 2080}
   (( segid "    " and resid 103  and name HB  ))
   (( segid "    " and resid 62   and name HE1 ))
      5.800     4.200     0.200 peak  2080 spectrum    1 weight  0.10000E+01 volume  0.31123E-03 ppm1      2.322 ppm2      3.029 CV     1
 OR { 2080}
   (( segid "    " and resid 103  and name HB  ))
   (( segid "    " and resid 62   and name HE2 ))
 ASSI { 2081}
   (( segid "    " and resid 103  and name HB  ))
   (( segid "    " and resid 104  and name HD2 ))
      4.000     2.000     2.000 peak  2081 spectrum    1 weight  0.11000E+01 volume  0.22215E-03 ppm1      2.304 ppm2      3.133 CV     1
 ASSI { 2083}
   (( segid "    " and resid 103  and name HB  ))
   (( segid "    " and resid 90   and name HA  ))
      6.000     4.500     0.000 peak  2083 spectrum    1 weight  0.10000E+01 volume  0.28228E-03 ppm1      2.318 ppm2      4.378 CV     1
 ASSI { 2085}
   (( segid "    " and resid 103  and name HB  ))
   (  segid "    " and resid 88   and name HE% )
      5.700     4.100     0.300 peak  2085 spectrum    1 weight  0.11000E+01 volume  0.16960E-03 ppm1      2.307 ppm2      7.178 CV     1
 ASSI { 2086}
   (( segid "    " and resid 103  and name HB  ))
   (( segid "    " and resid 106  and name HN  ))
      5.800     4.200     0.200 peak  2086 spectrum    1 weight  0.11000E+01 volume  0.10927E-03 ppm1      2.307 ppm2      7.897 CV     1
 ASSI { 2088}
   (  segid "    " and resid 103  and name HG1%)
   (  segid "    " and resid 144  and name HD1%)
      3.100     3.100     2.900 peak  2088 spectrum    1 weight  0.11000E+01 volume  0.25798E-02 ppm1      1.323 ppm2      0.888 CV     1
 ASSI { 2091}
   (  segid "    " and resid 103  and name HG1%)
   (  segid "    " and resid 106  and name HE% )
      4.300     2.300     1.700 peak  2091 spectrum    1 weight  0.11000E+01 volume  0.57384E-03 ppm1      1.307 ppm2      1.971 CV     1
 ASSI { 2092}
   (  segid "    " and resid 103  and name HG1%)
   (( segid "    " and resid 104  and name HB1 ))
      6.000     6.000     0.000 peak  2092 spectrum    1 weight  0.11000E+01 volume  0.12691E-03 ppm1      1.312 ppm2      2.469 CV     1
 ASSI { 2093}
   (  segid "    " and resid 103  and name HG1%)
   (( segid "    " and resid 104  and name HD2 ))
      6.000     4.700     0.000 peak  2093 spectrum    1 weight  0.11000E+01 volume  0.14503E-03 ppm1      1.297 ppm2      3.133 CV     1
 ASSI { 2094}
   (  segid "    " and resid 103  and name HG1%)
   (( segid "    " and resid 104  and name HD1 ))
      4.100     2.100     1.900 peak  2094 spectrum    1 weight  0.11000E+01 volume  0.50809E-03 ppm1      1.316 ppm2      3.628 CV     1
 ASSI { 2098}
   (  segid "    " and resid 99   and name HD1%)
   (  segid "    " and resid 88   and name HD% )
      5.400     3.600     0.600 peak  2098 spectrum    1 weight  0.11000E+01 volume  0.25906E-03 ppm1      1.304 ppm2      6.964 CV     1
 ASSI { 2102}
   (  segid "    " and resid 103  and name HG2%)
   (  segid "    " and resid 99   and name HD2%)
      3.600     1.600     1.600 peak  2102 spectrum    1 weight  0.11000E+01 volume  0.31289E-02 ppm1      1.027 ppm2      0.758 CV     1
 ASSI { 2103}
   (  segid "    " and resid 103  and name HG2%)
   (( segid "    " and resid 105  and name HB2 ))
      3.500     3.500     2.500 peak  2103 spectrum    1 weight  0.11000E+01 volume  0.31799E-02 ppm1      1.011 ppm2      1.717 CV     1
 ASSI { 2108}
   (  segid "    " and resid 103  and name HG2%)
   (( segid "    " and resid 88   and name HZ  ))
      3.300     1.400     1.400 peak  2108 spectrum    1 weight  0.11000E+01 volume  0.45333E-03 ppm1      1.037 ppm2      6.852 CV     1
 ASSI { 2109}
   (  segid "    " and resid 103  and name HG2%)
   (  segid "    " and resid 88   and name HD% )
      2.900     2.900     3.100 peak  2109 spectrum    1 weight  0.11000E+01 volume  0.15764E-03 ppm1      1.035 ppm2      6.962 CV     1
 ASSI { 2110}
   (  segid "    " and resid 103  and name HG2%)
   (  segid "    " and resid 88   and name HE% )
      4.400     2.400     1.600 peak  2110 spectrum    1 weight  0.11000E+01 volume  0.40796E-03 ppm1      1.036 ppm2      7.177 CV     1
 ASSI { 2113}
   (  segid "    " and resid 99   and name HD2%)
   (( segid "    " and resid 103  and name HB  ))
      5.100     5.100     0.900 peak  2113 spectrum    1 weight  0.11000E+01 volume  0.69363E-03 ppm1      0.736 ppm2      2.306 CV     1
 ASSI { 2114}
   (( segid "    " and resid 104  and name HD1 ))
   (  segid "    " and resid 103  and name HG2%)
      4.500     2.500     1.500 peak  2114 spectrum    1 weight  0.11000E+01 volume  0.83236E-03 ppm1      3.644 ppm2      1.057 CV     1
 ASSI { 2117}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 104  and name HD1 ))
      5.800     4.200     0.200 peak  2117 spectrum    1 weight  0.11000E+01 volume  0.12987E-03 ppm1      3.975 ppm2      3.635 CV     1
 ASSI { 2118}
   (( segid "    " and resid 104  and name HD2 ))
   (  segid "    " and resid 103  and name HG2%)
      5.100     3.300     0.900 peak  2118 spectrum    1 weight  0.11000E+01 volume  0.37128E-03 ppm1      3.129 ppm2      1.055 CV     1
 ASSI { 2122}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 104  and name HD2 ))
      6.000     4.600     0.000 peak  2122 spectrum    1 weight  0.11000E+01 volume  0.70330E-04 ppm1      3.964 ppm2      3.135 CV     1
 ASSI { 2124}
   (( segid "    " and resid 106  and name HB1 ))
   (  segid "    " and resid 103  and name HG1%)
      4.300     2.300     1.700 peak  2124 spectrum    1 weight  0.11000E+01 volume  0.60711E-03 ppm1      2.185 ppm2      1.302 CV     1
 ASSI { 2126}
   (( segid "    " and resid 104  and name HG1 ))
   (  segid "    " and resid 103  and name HG1%)
      6.000     5.100     0.000 peak  2126 spectrum    1 weight  0.11000E+01 volume  0.13400E-03 ppm1      2.133 ppm2      1.297 CV     1
 ASSI { 2131}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 103  and name HA  ))
      5.600     3.900     0.400 peak  2131 spectrum    1 weight  0.11000E+01 volume  0.12668E-03 ppm1      1.704 ppm2      3.951 CV     1
 ASSI { 2134}
   (( segid "    " and resid 108  and name HA  ))
   (  segid "    " and resid 147  and name HB% )
      6.000     5.000     0.000 peak  2134 spectrum    1 weight  0.11000E+01 volume  0.10439E-03 ppm1      3.335 ppm2      1.133 CV     1
 ASSI { 2135}
   (( segid "    " and resid 108  and name HA  ))
   (( segid "    " and resid 144  and name HB2 ))
      5.600     3.900     0.400 peak  2135 spectrum    1 weight  0.11000E+01 volume  0.34056E-03 ppm1      3.332 ppm2      1.321 CV     1
 ASSI { 2136}
   (( segid "    " and resid 108  and name HA  ))
   (( segid "    " and resid 144  and name HG  ))
      3.000     1.100     1.100 peak  2136 spectrum    1 weight  0.11000E+01 volume  0.13705E-02 ppm1      3.336 ppm2      1.459 CV     1
 ASSI { 2137}
   (( segid "    " and resid 108  and name HA  ))
   (( segid "    " and resid 60   and name HG1 ))
      6.000     5.000     0.000 peak  2137 spectrum    1 weight  0.11000E+01 volume  0.11493E-03 ppm1      3.324 ppm2      1.972 CV     1
 OR { 2137}
   (( segid "    " and resid 108  and name HA  ))
   (( segid "    " and resid 60   and name HB1 ))
 ASSI { 2138}
   (( segid "    " and resid 108  and name HA  ))
   (( segid "    " and resid 144  and name HB1 ))
      4.300     2.300     1.700 peak  2138 spectrum    1 weight  0.11000E+01 volume  0.37998E-03 ppm1      3.341 ppm2      2.366 CV     1
 ASSI { 2139}
   (( segid "    " and resid 108  and name HA  ))
   (( segid "    " and resid 107  and name HB2 ))
      6.000     4.700     0.000 peak  2139 spectrum    1 weight  0.10000E+01 volume  0.96790E-04 ppm1      3.344 ppm2      2.257 CV     1
 ASSI { 2141}
   (( segid "    " and resid 108  and name HA  ))
   (( segid "    " and resid 58   and name HB2 ))
      6.000     4.700     0.000 peak  2141 spectrum    1 weight  0.10000E+01 volume  0.15092E-03 ppm1      3.350 ppm2      3.785 CV     1
 ASSI { 2142}
   (( segid "    " and resid 108  and name HA  ))
   (( segid "    " and resid 146  and name HA  ))
      5.700     4.000     0.300 peak  2142 spectrum    1 weight  0.11000E+01 volume  0.10929E-03 ppm1      3.323 ppm2      4.528 CV     1
 ASSI { 2143}
   (( segid "    " and resid 108  and name HA  ))
   (( segid "    " and resid 144  and name HA  ))
      6.000     6.000     0.000 peak  2143 spectrum    1 weight  0.10000E+01 volume  0.57399E-04 ppm1      3.338 ppm2      4.687 CV     1
 ASSI { 2144}
   (( segid "    " and resid 108  and name HA  ))
   (( segid "    " and resid 59   and name HA  ))
      6.000     5.600     0.000 peak  2144 spectrum    1 weight  0.11000E+01 volume  0.74548E-04 ppm1      3.336 ppm2      5.198 CV     1
 ASSI { 2149}
   (( segid "    " and resid 108  and name HB  ))
   (  segid "    " and resid 147  and name HB% )
      5.400     3.700     0.600 peak  2149 spectrum    1 weight  0.11000E+01 volume  0.29937E-03 ppm1      2.044 ppm2      1.127 CV     1
 ASSI { 2154}
   (( segid "    " and resid 35   and name HB1 ))
   (( segid "    " and resid 36   and name HB2 ))
      5.100     3.200     0.900 peak  2154 spectrum    1 weight  0.10000E+01 volume  0.35559E-03 ppm1      2.038 ppm2      2.877 CV     1
 OR { 2154}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 36   and name HB2 ))
 ASSI { 2156}
   (( segid "    " and resid 10   and name HB1 ))
   (( segid "    " and resid 12   and name HD2 ))
      4.900     3.000     1.100 peak  2156 spectrum    1 weight  0.10000E+01 volume  0.34679E-03 ppm1      2.048 ppm2      3.682 CV     1
 ASSI { 2157}
   (( segid "    " and resid 108  and name HB  ))
   (( segid "    " and resid 58   and name HB2 ))
      5.300     3.500     0.700 peak  2157 spectrum    1 weight  0.10000E+01 volume  0.16269E-03 ppm1      2.043 ppm2      3.816 CV     1
 ASSI { 2160}
   (( segid "    " and resid 151  and name HB1 ))
   (( segid "    " and resid 64   and name HE22))
      5.000     3.100     1.000 peak  2160 spectrum    1 weight  0.11000E+01 volume  0.18084E-03 ppm1      2.054 ppm2      7.280 CV     1
 ASSI { 2162}
   (  segid "    " and resid 108  and name HG1%)
   (( segid "    " and resid 107  and name HB1 ))
      6.000     6.000     0.000 peak  2162 spectrum    1 weight  0.11000E+01 volume  0.12891E-03 ppm1      0.935 ppm2      2.574 CV     1
 ASSI { 2163}
   (  segid "    " and resid 108  and name HG1%)
   (( segid "    " and resid 109  and name HA2 ))
      4.500     2.600     1.500 peak  2163 spectrum    1 weight  0.11000E+01 volume  0.50216E-03 ppm1      0.949 ppm2      3.740 CV     1
 ASSI { 2164}
   (  segid "    " and resid 108  and name HG1%)
   (( segid "    " and resid 57   and name HB2 ))
      2.500     2.500     3.500 peak  2164 spectrum    1 weight  0.11000E+01 volume  0.40072E-03 ppm1      0.957 ppm2      4.018 CV     1
 ASSI { 2165}
   (  segid "    " and resid 40   and name HD1%)
   (  segid "    " and resid 101  and name HD1%)
      2.700     2.700     3.300 peak  2165 spectrum    1 weight  0.11000E+01 volume  0.73495E-02 ppm1      0.834 ppm2      0.687 CV     1
 ASSI { 2167}
   (  segid "    " and resid 108  and name HG2%)
   (  segid "    " and resid 147  and name HB% )
      3.000     3.000     3.000 peak  2167 spectrum    1 weight  0.11000E+01 volume  0.22028E-02 ppm1      0.844 ppm2      1.167 CV     1
 ASSI { 2169}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 45   and name HB1 ))
      3.000     3.000     3.000 peak  2169 spectrum    1 weight  0.11000E+01 volume  0.43851E-02 ppm1      0.859 ppm2      1.734 CV     1
 ASSI { 2170}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 60   and name HG1 ))
      3.300     1.400     1.400 peak  2170 spectrum    1 weight  0.11000E+01 volume  0.28564E-02 ppm1      0.843 ppm2      1.969 CV     1
 OR { 2170}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 60   and name HB1 ))
 ASSI { 2172}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 107  and name HB1 ))
      5.600     5.600     0.400 peak  2172 spectrum    1 weight  0.11000E+01 volume  0.32545E-03 ppm1      0.840 ppm2      2.574 CV     1
 ASSI { 2173}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 109  and name HA2 ))
      6.000     5.200     0.000 peak  2173 spectrum    1 weight  0.11000E+01 volume  0.16945E-03 ppm1      0.841 ppm2      3.732 CV     1
 ASSI { 2174}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 57   and name HB1 ))
      4.600     2.600     1.400 peak  2174 spectrum    1 weight  0.11000E+01 volume  0.97230E-03 ppm1      0.855 ppm2      4.061 CV     1
 ASSI { 2177}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 146  and name HA  ))
      3.800     1.800     1.800 peak  2177 spectrum    1 weight  0.11000E+01 volume  0.81153E-03 ppm1      0.850 ppm2      4.523 CV     1
 ASSI { 2178}
   (  segid "    " and resid 144  and name HD2%)
   (( segid "    " and resid 108  and name HA  ))
      3.500     1.500     1.500 peak  2178 spectrum    1 weight  0.11000E+01 volume  0.48426E-03 ppm1      0.893 ppm2      3.341 CV     1
 ASSI { 2182}
   (  segid "    " and resid 108  and name HG1%)
   (  segid "    " and resid 146  and name HG2%)
      3.500     3.500     2.500 peak  2182 spectrum    1 weight  0.11000E+01 volume  0.31506E-02 ppm1      0.947 ppm2      1.126 CV     1
 ASSI { 2183}
   (  segid "    " and resid 108  and name HG1%)
   (( segid "    " and resid 144  and name HB1 ))
      5.300     3.500     0.700 peak  2183 spectrum    1 weight  0.10000E+01 volume  0.38169E-03 ppm1      0.944 ppm2      2.367 CV     1
 ASSI { 2187}
   (( segid "    " and resid 108  and name HB  ))
   (( segid "    " and resid 59   and name HA  ))
      5.100     5.100     0.900 peak  2187 spectrum    1 weight  0.11000E+01 volume  0.36768E-03 ppm1      2.029 ppm2      5.230 CV     1
 ASSI { 2188}
   (( segid "    " and resid 114  and name HA  ))
   (  segid "    " and resid 140  and name HD2%)
      6.000     6.000     0.000 peak  2188 spectrum    1 weight  0.11000E+01 volume  0.57956E-04 ppm1      5.638 ppm2      0.706 CV     1
 ASSI { 2189}
   (( segid "    " and resid 114  and name HA  ))
   (  segid "    " and resid 115  and name HG2%)
      6.000     6.000     0.000 peak  2189 spectrum    1 weight  0.11000E+01 volume  0.18022E-03 ppm1      5.619 ppm2      1.121 CV     1
 ASSI { 2191}
   (( segid "    " and resid 114  and name HA  ))
   (( segid "    " and resid 47   and name HB2 ))
      4.900     3.000     1.100 peak  2191 spectrum    1 weight  0.11000E+01 volume  0.29616E-03 ppm1      5.614 ppm2      1.800 CV     1
 ASSI { 2193}
   (( segid "    " and resid 114  and name HA  ))
   (( segid "    " and resid 47   and name HE1 ))
      3.300     3.300     2.700 peak  2193 spectrum    1 weight  0.11000E+01 volume  0.73328E-04 ppm1      5.619 ppm2      2.575 CV     1
 OR { 2193}
   (( segid "    " and resid 114  and name HA  ))
   (( segid "    " and resid 47   and name HE2 ))
 ASSI { 2195}
   (( segid "    " and resid 114  and name HA  ))
   (( segid "    " and resid 102  and name HB1 ))
      6.000     6.000     0.000 peak  2195 spectrum    1 weight  0.11000E+01 volume  0.53460E-04 ppm1      5.603 ppm2      3.616 CV     1
 ASSI { 2196}
   (( segid "    " and resid 114  and name HA  ))
   (( segid "    " and resid 48   and name HA  ))
      2.700     2.700     3.300 peak  2196 spectrum    1 weight  0.11000E+01 volume  0.21476E-03 ppm1      5.617 ppm2      4.653 CV     1
 ASSI { 2198}
   (( segid "    " and resid 114  and name HA  ))
   (( segid "    " and resid 115  and name HA  ))
      5.800     5.800     0.200 peak  2198 spectrum    1 weight  0.11000E+01 volume  0.98008E-04 ppm1      5.635 ppm2      5.089 CV     1
 ASSI { 2200}
   (( segid "    " and resid 114  and name HA  ))
   (( segid "    " and resid 36   and name HZ3 ))
      3.400     1.400     1.400 peak  2200 spectrum    1 weight  0.11000E+01 volume  0.52231E-03 ppm1      5.617 ppm2      7.016 CV     1
 ASSI { 2202}
   (( segid "    " and resid 114  and name HA  ))
   (( segid "    " and resid 36   and name HZ2 ))
      6.000     6.000     0.000 peak  2202 spectrum    1 weight  0.11000E+01 volume  0.48642E-04 ppm1      5.614 ppm2      7.473 CV     1
 ASSI { 2204}
   (( segid "    " and resid 114  and name HB  ))
   (  segid "    " and resid 140  and name HD2%)
      4.100     2.100     1.900 peak  2204 spectrum    1 weight  0.11000E+01 volume  0.78997E-03 ppm1      2.044 ppm2      0.709 CV     1
 ASSI { 2205}
   (( segid "    " and resid 114  and name HB  ))
   (  segid "    " and resid 115  and name HG2%)
      5.400     5.400     0.600 peak  2205 spectrum    1 weight  0.11000E+01 volume  0.27241E-03 ppm1      2.035 ppm2      1.126 CV     1
 ASSI { 2207}
   (( segid "    " and resid 114  and name HB  ))
   (( segid "    " and resid 140  and name HG  ))
      4.000     2.000     2.000 peak  2207 spectrum    1 weight  0.10000E+01 volume  0.29453E-03 ppm1      2.037 ppm2      1.686 CV     1
 ASSI { 2210}
   (( segid "    " and resid 114  and name HB  ))
   (( segid "    " and resid 140  and name HA  ))
      6.000     4.900     0.000 peak  2210 spectrum    1 weight  0.11000E+01 volume  0.13376E-03 ppm1      2.064 ppm2      5.296 CV     1
 ASSI { 2212}
   (( segid "    " and resid 114  and name HB  ))
   (( segid "    " and resid 36   and name HZ3 ))
      5.700     5.700     0.300 peak  2212 spectrum    1 weight  0.11000E+01 volume  0.23908E-03 ppm1      2.053 ppm2      7.018 CV     1
 ASSI { 2214}
   (  segid "    " and resid 114  and name HG1%)
   (( segid "    " and resid 47   and name HD2 ))
      4.700     4.700     1.300 peak  2214 spectrum    1 weight  0.11000E+01 volume  0.14601E-02 ppm1      0.915 ppm2      1.446 CV     1
 ASSI { 2216}
   (  segid "    " and resid 114  and name HG1%)
   (( segid "    " and resid 47   and name HB2 ))
      3.000     1.100     1.100 peak  2216 spectrum    1 weight  0.11000E+01 volume  0.14419E-02 ppm1      0.921 ppm2      1.775 CV     1
 ASSI { 2217}
   (  segid "    " and resid 114  and name HG1%)
   (( segid "    " and resid 102  and name HB2 ))
      3.700     1.700     1.700 peak  2217 spectrum    1 weight  0.11000E+01 volume  0.79704E-03 ppm1      0.926 ppm2      3.545 CV     1
 ASSI { 2218}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 102  and name HB1 ))
      3.400     3.400     2.600 peak  2218 spectrum    1 weight  0.11000E+01 volume  0.13168E-02 ppm1      0.919 ppm2      3.628 CV     1
 ASSI { 2220}
   (  segid "    " and resid 114  and name HG1%)
   (( segid "    " and resid 36   and name HZ3 ))
      5.700     5.700     0.300 peak  2220 spectrum    1 weight  0.11000E+01 volume  0.23067E-03 ppm1      0.932 ppm2      7.019 CV     1
 ASSI { 2221}
   (  segid "    " and resid 114  and name HG1%)
   (( segid "    " and resid 36   and name HE3 ))
      6.000     4.800     0.000 peak  2221 spectrum    1 weight  0.11000E+01 volume  0.88379E-04 ppm1      0.910 ppm2      7.227 CV     1
 ASSI { 2223}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 140  and name HB2 ))
      3.500     3.500     2.500 peak  2223 spectrum    1 weight  0.11000E+01 volume  0.38652E-02 ppm1      0.854 ppm2      1.305 CV     1
 ASSI { 2225}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 47   and name HB2 ))
      2.600     2.600     3.400 peak  2225 spectrum    1 weight  0.11000E+01 volume  0.36552E-02 ppm1      0.860 ppm2      1.732 CV     1
 ASSI { 2233}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 36   and name HE3 ))
      6.000     6.000     0.000 peak  2233 spectrum    1 weight  0.11000E+01 volume  0.10968E-03 ppm1      0.860 ppm2      7.189 CV     1
 ASSI { 2235}
   (  segid "    " and resid 114  and name HG2%)
   (  segid "    " and resid 140  and name HD2%)
      4.200     4.200     1.800 peak  2235 spectrum    1 weight  0.11000E+01 volume  0.12531E-02 ppm1      0.912 ppm2      0.707 CV     1
 ASSI { 2237}
   (( segid "    " and resid 47   and name HB2 ))
   (( segid "    " and resid 114  and name HA  ))
      5.300     3.500     0.700 peak  2237 spectrum    1 weight  0.11000E+01 volume  0.27044E-03 ppm1      1.793 ppm2      5.619 CV     1
 OR { 2237}
   (( segid "    " and resid 47   and name HB1 ))
   (( segid "    " and resid 114  and name HA  ))
 ASSI { 2239}
   (( segid "    " and resid 102  and name HB2 ))
   (  segid "    " and resid 114  and name HG1%)
      4.000     2.000     2.000 peak  2239 spectrum    1 weight  0.11000E+01 volume  0.51903E-03 ppm1      3.575 ppm2      0.932 CV     1
 OR { 2239}
   (( segid "    " and resid 102  and name HB1 ))
   (  segid "    " and resid 114  and name HG1%)
 ASSI { 2241}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 102  and name HB2 ))
      3.500     1.500     1.500 peak  2241 spectrum    1 weight  0.11000E+01 volume  0.49027E-03 ppm1      0.869 ppm2      3.545 CV     1
 ASSI { 2242}
   (( segid "    " and resid 114  and name HB  ))
   (( segid "    " and resid 102  and name HB1 ))
      5.900     4.400     0.100 peak  2242 spectrum    1 weight  0.11000E+01 volume  0.12518E-03 ppm1      2.059 ppm2      3.630 CV     1
 ASSI { 2244}
   (( segid "    " and resid 114  and name HB  ))
   (( segid "    " and resid 47   and name HA  ))
      6.000     5.300     0.000 peak  2244 spectrum    1 weight  0.11000E+01 volume  0.89278E-04 ppm1      2.030 ppm2      5.959 CV     1
 ASSI { 2249}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 36   and name HZ3 ))
      6.000     6.000     0.000 peak  2249 spectrum    1 weight  0.11000E+01 volume  0.12146E-03 ppm1      0.913 ppm2      7.016 CV     1
 ASSI { 2250}
   (( segid "    " and resid 114  and name HB  ))
   (( segid "    " and resid 36   and name HE3 ))
      6.000     6.000     0.000 peak  2250 spectrum    1 weight  0.11000E+01 volume  0.61852E-04 ppm1      2.005 ppm2      7.219 CV     1
 ASSI { 2252}
   (  segid "    " and resid 114  and name HG1%)
   (( segid "    " and resid 47   and name HE1 ))
      2.500     2.500     3.500 peak  2252 spectrum    1 weight  0.11000E+01 volume  0.38764E-03 ppm1      0.918 ppm2      2.552 CV     1
 OR { 2252}
   (  segid "    " and resid 114  and name HG1%)
   (( segid "    " and resid 47   and name HE2 ))
 ASSI { 2253}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 47   and name HE1 ))
      3.400     3.400     2.600 peak  2253 spectrum    1 weight  0.11000E+01 volume  0.62066E-04 ppm1      0.836 ppm2      2.567 CV     1
 OR { 2253}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 47   and name HE2 ))
 ASSI { 2254}
   (  segid "    " and resid 114  and name HG2%)
   (  segid "    " and resid 115  and name HG2%)
      3.700     3.700     2.300 peak  2254 spectrum    1 weight  0.11000E+01 volume  0.41569E-02 ppm1      0.867 ppm2      1.111 CV     1
 ASSI { 2255}
   (( segid "    " and resid 140  and name HB2 ))
   (( segid "    " and resid 114  and name HB  ))
      4.300     2.300     1.700 peak  2255 spectrum    1 weight  0.11000E+01 volume  0.14252E-02 ppm1      1.306 ppm2      2.051 CV     1
 ASSI { 2261}
   (( segid "    " and resid 142  and name HA  ))
   (( segid "    " and resid 143  and name HA  ))
      5.700     4.100     0.300 peak  2261 spectrum    1 weight  0.11000E+01 volume  0.13186E-03 ppm1      5.056 ppm2      5.617 CV     1
 ASSI { 2270}
   (( segid "    " and resid 142  and name HB  ))
   (  segid "    " and resid 112  and name HB% )
      4.600     4.600     1.400 peak  2270 spectrum    1 weight  0.11000E+01 volume  0.66836E-03 ppm1      1.961 ppm2      1.541 CV     1
 ASSI { 2273}
   (( segid "    " and resid 142  and name HB  ))
   (( segid "    " and resid 141  and name HA  ))
      6.000     4.500     0.000 peak  2273 spectrum    1 weight  0.11000E+01 volume  0.26486E-03 ppm1      1.948 ppm2      5.231 CV     1
 ASSI { 2274}
   (( segid "    " and resid 113  and name HB1 ))
   (( segid "    " and resid 36   and name HH2 ))
      5.500     3.700     0.500 peak  2274 spectrum    1 weight  0.10000E+01 volume  0.31367E-03 ppm1      2.016 ppm2      7.017 CV     1
 ASSI { 2278}
   (  segid "    " and resid 148  and name HG1%)
   (  segid "    " and resid 65   and name HG2%)
      3.200     3.200     2.800 peak  2278 spectrum    1 weight  0.11000E+01 volume  0.47892E-02 ppm1      0.910 ppm2      0.463 CV     1
 ASSI { 2279}
   (  segid "    " and resid 61   and name HG1%)
   (( segid "    " and resid 62   and name HB2 ))
      3.100     1.200     1.200 peak  2279 spectrum    1 weight  0.10000E+01 volume  0.39143E-02 ppm1      0.910 ppm2      1.742 CV     1
 OR { 2279}
   (  segid "    " and resid 61   and name HG1%)
   (( segid "    " and resid 62   and name HD1 ))
 ASSI { 2284}
   (  segid "    " and resid 142  and name HG2%)
   (( segid "    " and resid 144  and name HA  ))
      3.400     3.400     2.600 peak  2284 spectrum    1 weight  0.10000E+01 volume  0.21858E-02 ppm1      0.887 ppm2      4.672 CV     1
 OR { 2284}
   (  segid "    " and resid 142  and name HG1%)
   (( segid "    " and resid 144  and name HA  ))
 ASSI { 2286}
   (  segid "    " and resid 138  and name HD2%)
   (  segid "    " and resid 132  and name HD1%)
      2.500     2.500     3.500 peak  2286 spectrum    1 weight  0.10000E+01 volume  0.67375E-02 ppm1      0.861 ppm2      0.465 CV     1
 ASSI { 2288}
   (  segid "    " and resid 150  and name HD2%)
   (( segid "    " and resid 150  and name HB2 ))
      3.100     1.200     1.200 peak  2288 spectrum    1 weight  0.10000E+01 volume  0.29929E-02 ppm1      0.839 ppm2      1.581 CV     1
 OR { 2288}
   (  segid "    " and resid 150  and name HD2%)
   (( segid "    " and resid 150  and name HB1 ))
 ASSI { 2290}
   (  segid "    " and resid 142  and name HG2%)
   (( segid "    " and resid 68   and name HB  ))
      3.900     1.900     1.900 peak  2290 spectrum    1 weight  0.11000E+01 volume  0.23614E-02 ppm1      0.855 ppm2      2.230 CV     1
 ASSI { 2291}
   (  segid "    " and resid 142  and name HG2%)
   (( segid "    " and resid 144  and name HA  ))
      3.100     3.100     2.900 peak  2291 spectrum    1 weight  0.10000E+01 volume  0.18125E-02 ppm1      0.860 ppm2      4.666 CV     1
 ASSI { 2293}
   (  segid "    " and resid 142  and name HG2%)
   (( segid "    " and resid 70   and name HA  ))
      4.100     4.100     1.900 peak  2293 spectrum    1 weight  0.11000E+01 volume  0.16409E-02 ppm1      0.849 ppm2      5.374 CV     1
 ASSI { 2301}
   (( segid "    " and resid 142  and name HA  ))
   (( segid "    " and resid 141  and name HA  ))
      6.000     4.500     0.000 peak  2301 spectrum    1 weight  0.11000E+01 volume  0.70180E-04 ppm1      5.093 ppm2      5.227 CV     1
 ASSI { 2305}
   (( segid "    " and resid 148  and name HA  ))
   (  segid "    " and resid 148  and name HG2%)
      6.000     6.000     0.000 peak  2305 spectrum    1 weight  0.11000E+01 volume  0.36418E-04 ppm1      4.585 ppm2      0.786 CV     1
 ASSI { 2313}
   (( segid "    " and resid 148  and name HB  ))
   (( segid "    " and resid 149  and name HB2 ))
      4.500     2.500     1.500 peak  2313 spectrum    1 weight  0.11000E+01 volume  0.96705E-03 ppm1      2.124 ppm2      2.490 CV     1
 ASSI { 2315}
   (( segid "    " and resid 148  and name HB  ))
   (( segid "    " and resid 150  and name HA  ))
      4.100     2.100     1.900 peak  2315 spectrum    1 weight  0.10000E+01 volume  0.79750E-03 ppm1      2.111 ppm2      4.154 CV     1
 ASSI { 2317}
   (  segid "    " and resid 148  and name HG2%)
   (  segid "    " and resid 65   and name HG2%)
      2.900     2.900     3.100 peak  2317 spectrum    1 weight  0.11000E+01 volume  0.36218E-02 ppm1      0.835 ppm2      0.461 CV     1
 ASSI { 2318}
   (  segid "    " and resid 80   and name HG2%)
   (  segid "    " and resid 74   and name HD1%)
      3.900     3.900     2.100 peak  2318 spectrum    1 weight  0.11000E+01 volume  0.18963E-02 ppm1      0.821 ppm2      1.178 CV     1
 ASSI { 2319}
   (  segid "    " and resid 148  and name HG2%)
   (( segid "    " and resid 65   and name HB  ))
      1.700     1.700     4.300 peak  2319 spectrum    1 weight  0.11000E+01 volume  0.40082E-02 ppm1      0.838 ppm2      1.734 CV     1
 ASSI { 2323}
   (  segid "    " and resid 80   and name HG2%)
   (( segid "    " and resid 73   and name HB2 ))
      6.000     6.000     0.000 peak  2323 spectrum    1 weight  0.11000E+01 volume  0.20990E-03 ppm1      0.836 ppm2      3.745 CV     1
 OR { 2323}
   (  segid "    " and resid 80   and name HG2%)
   (( segid "    " and resid 73   and name HB1 ))
 ASSI { 2331}
   (( segid "    " and resid 44   and name HB1 ))
   (( segid "    " and resid 117  and name HB2 ))
      5.600     3.900     0.400 peak  2331 spectrum    1 weight  0.10000E+01 volume  0.14288E-03 ppm1      1.933 ppm2      2.486 CV     1
 ASSI { 2332}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 117  and name HB2 ))
      6.000     4.800     0.000 peak  2332 spectrum    1 weight  0.10000E+01 volume  0.11478E-03 ppm1      1.731 ppm2      2.489 CV     1
 ASSI { 2335}
   (( segid "    " and resid 37   and name HB1 ))
   (( segid "    " and resid 47   and name HE1 ))
      5.000     3.100     1.000 peak  2335 spectrum    1 weight  0.11000E+01 volume  0.10864E-03 ppm1      1.916 ppm2      2.585 CV     1
 OR { 2335}
   (( segid "    " and resid 37   and name HB1 ))
   (( segid "    " and resid 47   and name HE2 ))
 ASSI { 2336}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 47   and name HE1 ))
      5.700     4.100     0.300 peak  2336 spectrum    1 weight  0.11000E+01 volume  0.83497E-04 ppm1      1.715 ppm2      2.597 CV     1
 OR { 2336}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 47   and name HE2 ))
 ASSI { 2337}
   (( segid "    " and resid 37   and name HB1 ))
   (( segid "    " and resid 38   and name HA  ))
      5.000     3.100     1.000 peak  2337 spectrum    1 weight  0.10000E+01 volume  0.21091E-03 ppm1      1.929 ppm2      4.802 CV     1
 ASSI { 2341}
   (( segid "    " and resid 37   and name HB1 ))
   (( segid "    " and resid 47   and name HA  ))
      5.800     4.100     0.200 peak  2341 spectrum    1 weight  0.11000E+01 volume  0.89363E-04 ppm1      1.927 ppm2      5.939 CV     1
 ASSI { 2342}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 46   and name HA  ))
      6.000     6.000     0.000 peak  2342 spectrum    1 weight  0.11000E+01 volume  0.48579E-04 ppm1      1.719 ppm2      5.945 CV     1
 ASSI { 2355}
   (( segid "    " and resid 37   and name HG  ))
   (( segid "    " and resid 39   and name HA  ))
      3.800     1.800     1.800 peak  2355 spectrum    1 weight  0.11000E+01 volume  0.54947E-03 ppm1      1.492 ppm2      3.470 CV     1
 ASSI { 2356}
   (( segid "    " and resid 37   and name HG  ))
   (( segid "    " and resid 38   and name HA  ))
      4.500     2.500     1.500 peak  2356 spectrum    1 weight  0.10000E+01 volume  0.34283E-03 ppm1      1.486 ppm2      4.792 CV     1
 ASSI { 2361}
   (  segid "    " and resid 37   and name HD1%)
   (( segid "    " and resid 47   and name HE1 ))
      5.100     3.300     0.900 peak  2361 spectrum    1 weight  0.11000E+01 volume  0.38747E-03 ppm1      1.001 ppm2      2.598 CV     1
 OR { 2361}
   (  segid "    " and resid 37   and name HD1%)
   (( segid "    " and resid 47   and name HE2 ))
 ASSI { 2363}
   (  segid "    " and resid 37   and name HD1%)
   (( segid "    " and resid 39   and name HA  ))
      5.800     5.800     0.200 peak  2363 spectrum    1 weight  0.11000E+01 volume  0.19024E-03 ppm1      0.995 ppm2      3.471 CV     1
 ASSI { 2366}
   (  segid "    " and resid 89   and name HG2%)
   (( segid "    " and resid 92   and name HB2 ))
      3.700     1.800     1.800 peak  2366 spectrum    1 weight  0.11000E+01 volume  0.49852E-03 ppm1      0.985 ppm2      2.687 CV     1
 ASSI { 2370}
   (( segid "    " and resid 37   and name HB1 ))
   (( segid "    " and resid 39   and name HA  ))
      5.600     4.000     0.400 peak  2370 spectrum    1 weight  0.11000E+01 volume  0.75061E-04 ppm1      1.925 ppm2      3.473 CV     1
 ASSI { 2371}
   (( segid "    " and resid 37   and name HG  ))
   (( segid "    " and resid 46   and name HA  ))
      5.800     4.200     0.200 peak  2371 spectrum    1 weight  0.11000E+01 volume  0.13098E-03 ppm1      1.471 ppm2      5.945 CV     1
 ASSI { 2372}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 45   and name HB1 ))
      5.800     4.100     0.200 peak  2372 spectrum    1 weight  0.11000E+01 volume  0.22020E-03 ppm1      4.598 ppm2      1.738 CV     1
 ASSI { 2374}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 12   and name HB2 ))
      6.000     6.000     0.000 peak  2374 spectrum    1 weight  0.11000E+01 volume  0.19861E-03 ppm1      4.625 ppm2      2.123 CV     1
 ASSI { 2375}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 12   and name HB1 ))
      6.000     5.000     0.000 peak  2375 spectrum    1 weight  0.10000E+01 volume  0.86516E-04 ppm1      4.612 ppm2      2.304 CV     1
 ASSI { 2376}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 11   and name HG2 ))
      5.900     4.400     0.100 peak  2376 spectrum    1 weight  0.10000E+01 volume  0.74248E-04 ppm1      4.622 ppm2      2.368 CV     1
 OR { 2376}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 11   and name HG1 ))
 ASSI { 2379}
   (( segid "    " and resid 40   and name HB1 ))
   (  segid "    " and resid 45   and name HD2%)
      6.000     6.000     0.000 peak  2379 spectrum    1 weight  0.10000E+01 volume  0.75340E-04 ppm1      1.814 ppm2      0.488 CV     1
 ASSI { 2381}
   (( segid "    " and resid 40   and name HB1 ))
   (( segid "    " and resid 42   and name HB2 ))
      6.000     5.000     0.000 peak  2381 spectrum    1 weight  0.10000E+01 volume  0.10431E-03 ppm1      1.806 ppm2      2.782 CV     1
 ASSI { 2382}
   (( segid "    " and resid 40   and name HB1 ))
   (( segid "    " and resid 42   and name HB1 ))
      4.800     2.900     1.200 peak  2382 spectrum    1 weight  0.10000E+01 volume  0.72835E-04 ppm1      1.812 ppm2      3.272 CV     1
 ASSI { 2383}
   (( segid "    " and resid 40   and name HG  ))
   (  segid "    " and resid 45   and name HD2%)
      3.400     1.500     1.500 peak  2383 spectrum    1 weight  0.10000E+01 volume  0.90548E-03 ppm1      1.343 ppm2      0.522 CV     1
 ASSI { 2385}
   (( segid "    " and resid 46   and name HG2 ))
   (( segid "    " and resid 45   and name HA  ))
      6.000     4.600     0.000 peak  2385 spectrum    1 weight  0.11000E+01 volume  0.12229E-03 ppm1      1.346 ppm2      5.236 CV     1
 ASSI { 2386}
   (( segid "    " and resid 99   and name HG  ))
   (( segid "    " and resid 104  and name HD2 ))
      5.600     3.900     0.400 peak  2386 spectrum    1 weight  0.10000E+01 volume  0.15165E-03 ppm1      1.356 ppm2      3.129 CV     1
 ASSI { 2387}
   (( segid "    " and resid 46   and name HG2 ))
   (( segid "    " and resid 43   and name HA2 ))
      4.200     2.300     1.800 peak  2387 spectrum    1 weight  0.11000E+01 volume  0.19579E-03 ppm1      1.343 ppm2      3.487 CV     1
 OR { 2387}
   (( segid "    " and resid 46   and name HG1 ))
   (( segid "    " and resid 43   and name HA2 ))
 ASSI { 2388}
   (( segid "    " and resid 99   and name HG  ))
   (( segid "    " and resid 100  and name HB1 ))
      6.000     5.000     0.000 peak  2388 spectrum    1 weight  0.11000E+01 volume  0.99555E-04 ppm1      1.345 ppm2      2.597 CV     1
 ASSI { 2389}
   (( segid "    " and resid 40   and name HG  ))
   (( segid "    " and resid 45   and name HB1 ))
      3.800     1.800     1.800 peak  2389 spectrum    1 weight  0.11000E+01 volume  0.68343E-03 ppm1      1.327 ppm2      1.716 CV     1
 ASSI { 2392}
   (  segid "    " and resid 40   and name HD1%)
   (  segid "    " and resid 120  and name HE% )
      3.600     1.600     1.600 peak  2392 spectrum    1 weight  0.11000E+01 volume  0.70039E-03 ppm1      0.833 ppm2      6.703 CV     1
 ASSI { 2395}
   (  segid "    " and resid 40   and name HD2%)
   (  segid "    " and resid 101  and name HD1%)
      2.600     2.600     3.400 peak  2395 spectrum    1 weight  0.11000E+01 volume  0.52710E-02 ppm1      0.584 ppm2      0.694 CV     1
 ASSI { 2402}
   (  segid "    " and resid 40   and name HD2%)
   (  segid "    " and resid 120  and name HE% )
      3.900     1.900     1.900 peak  2402 spectrum    1 weight  0.11000E+01 volume  0.12512E-02 ppm1      0.597 ppm2      6.703 CV     1
 ASSI { 2403}
   (  segid "    " and resid 40   and name HD2%)
   (  segid "    " and resid 120  and name HD% )
      4.600     2.600     1.400 peak  2403 spectrum    1 weight  0.11000E+01 volume  0.48240E-03 ppm1      0.600 ppm2      6.934 CV     1
 ASSI { 2411}
   (( segid "    " and resid 44   and name HB1 ))
   (( segid "    " and resid 119  and name HD2 ))
      4.300     4.300     1.700 peak  2411 spectrum    1 weight  0.11000E+01 volume  0.79554E-03 ppm1      1.927 ppm2      1.417 CV     1
 ASSI { 2423}
   (( segid "    " and resid 44   and name HB1 ))
   (  segid "    " and resid 120  and name HD% )
      6.000     6.000     0.000 peak  2423 spectrum    1 weight  0.11000E+01 volume  0.24869E-03 ppm1      1.972 ppm2      6.934 CV     1
 ASSI { 2425}
   (( segid "    " and resid 44   and name HG  ))
   (( segid "    " and resid 44   and name HB1 ))
      2.900     1.000     1.000 peak  2425 spectrum    1 weight  0.11000E+01 volume  0.23122E-02 ppm1      1.583 ppm2      1.943 CV     1
 ASSI { 2433}
   (  segid "    " and resid 44   and name HD1%)
   (( segid "    " and resid 119  and name HE1 ))
      4.400     4.400     1.600 peak  2433 spectrum    1 weight  0.11000E+01 volume  0.87462E-03 ppm1      0.945 ppm2      2.767 CV     1
 OR { 2433}
   (  segid "    " and resid 44   and name HD1%)
   (( segid "    " and resid 119  and name HE2 ))
 ASSI { 2434}
   (  segid "    " and resid 44   and name HD1%)
   (( segid "    " and resid 43   and name HA2 ))
      4.400     4.400     1.600 peak  2434 spectrum    1 weight  0.11000E+01 volume  0.88100E-03 ppm1      0.969 ppm2      3.472 CV     1
 ASSI { 2441}
   (  segid "    " and resid 44   and name HD1%)
   (( segid "    " and resid 42   and name HN  ))
      5.700     4.100     0.300 peak  2441 spectrum    1 weight  0.10000E+01 volume  0.36940E-03 ppm1      0.960 ppm2      7.103 CV     1
 ASSI { 2443}
   (  segid "    " and resid 44   and name HD2%)
   (( segid "    " and resid 119  and name HG2 ))
      3.800     3.800     2.200 peak  2443 spectrum    1 weight  0.11000E+01 volume  0.24439E-02 ppm1      0.824 ppm2      0.593 CV     1
 ASSI { 2447}
   (  segid "    " and resid 44   and name HD2%)
   (  segid "    " and resid 120  and name HE% )
      3.300     1.300     1.300 peak  2447 spectrum    1 weight  0.11000E+01 volume  0.83585E-03 ppm1      0.831 ppm2      6.704 CV     1
 ASSI { 2452}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 44   and name HB1 ))
      5.800     4.300     0.200 peak  2452 spectrum    1 weight  0.11000E+01 volume  0.22365E-03 ppm1      5.202 ppm2      1.915 CV     1
 ASSI { 2457}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 117  and name HB1 ))
      6.000     6.000     0.000 peak  2457 spectrum    1 weight  0.11000E+01 volume  0.61274E-04 ppm1      4.423 ppm2      2.991 CV     1
 ASSI { 2459}
   (( segid "    " and resid 44   and name HG  ))
   (( segid "    " and resid 117  and name HB2 ))
      4.500     2.500     1.500 peak  2459 spectrum    1 weight  0.11000E+01 volume  0.16427E-03 ppm1      1.614 ppm2      2.473 CV     1
 ASSI { 2461}
   (( segid "    " and resid 117  and name HB2 ))
   (  segid "    " and resid 44   and name HD1%)
      5.800     4.100     0.200 peak  2461 spectrum    1 weight  0.11000E+01 volume  0.27509E-03 ppm1      2.481 ppm2      0.953 CV     1
 ASSI { 2462}
   (  segid "    " and resid 44   and name HD1%)
   (( segid "    " and resid 119  and name HD2 ))
      3.300     3.300     2.700 peak  2462 spectrum    1 weight  0.11000E+01 volume  0.28852E-02 ppm1      0.940 ppm2      1.385 CV     1
 ASSI { 2463}
   (( segid "    " and resid 46   and name HG1 ))
   (  segid "    " and resid 44   and name HD1%)
      2.100     2.100     3.900 peak  2463 spectrum    1 weight  0.11000E+01 volume  0.10501E-02 ppm1      1.393 ppm2      0.960 CV     1
 ASSI { 2464}
   (  segid "    " and resid 44   and name HD2%)
   (( segid "    " and resid 119  and name HD2 ))
      3.400     1.500     1.500 peak  2464 spectrum    1 weight  0.11000E+01 volume  0.20501E-02 ppm1      0.837 ppm2      1.380 CV     1
 ASSI { 2465}
   (  segid "    " and resid 44   and name HD2%)
   (( segid "    " and resid 119  and name HE2 ))
      6.000     6.000     0.000 peak  2465 spectrum    1 weight  0.11000E+01 volume  0.22780E-04 ppm1      0.828 ppm2      2.776 CV     1
 ASSI { 2466}
   (( segid "    " and resid 119  and name HE1 ))
   (  segid "    " and resid 44   and name HD2%)
      5.400     3.700     0.600 peak  2466 spectrum    1 weight  0.11000E+01 volume  0.24803E-03 ppm1      2.765 ppm2      0.834 CV     1
 ASSI { 2467}
   (( segid "    " and resid 44   and name HG  ))
   (( segid "    " and resid 119  and name HE1 ))
      5.700     4.000     0.300 peak  2467 spectrum    1 weight  0.11000E+01 volume  0.67933E-04 ppm1      1.617 ppm2      2.759 CV     1
 ASSI { 2468}
   (( segid "    " and resid 44   and name HB1 ))
   (( segid "    " and resid 119  and name HG2 ))
      6.000     6.000     0.000 peak  2468 spectrum    1 weight  0.11000E+01 volume  0.12938E-03 ppm1      1.978 ppm2      0.592 CV     1
 ASSI { 2469}
   (( segid "    " and resid 44   and name HG  ))
   (( segid "    " and resid 119  and name HG2 ))
      5.900     4.300     0.100 peak  2469 spectrum    1 weight  0.11000E+01 volume  0.12141E-03 ppm1      1.603 ppm2      0.616 CV     1
 ASSI { 2472}
   (( segid "    " and resid 45   and name HA  ))
   (  segid "    " and resid 120  and name HE% )
      6.000     6.000     0.000 peak  2472 spectrum    1 weight  0.11000E+01 volume  0.65363E-04 ppm1      5.214 ppm2      6.700 CV     1
 ASSI { 2473}
   (( segid "    " and resid 45   and name HA  ))
   (  segid "    " and resid 120  and name HD% )
      6.000     5.100     0.000 peak  2473 spectrum    1 weight  0.11000E+01 volume  0.98186E-04 ppm1      5.222 ppm2      6.936 CV     1
 ASSI { 2476}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 116  and name HA  ))
      6.000     4.800     0.000 peak  2476 spectrum    1 weight  0.11000E+01 volume  0.16723E-03 ppm1      1.687 ppm2      5.353 CV     1
 ASSI { 2478}
   (( segid "    " and resid 45   and name HB2 ))
   (  segid "    " and resid 40   and name HD2%)
      5.100     3.200     0.900 peak  2478 spectrum    1 weight  0.11000E+01 volume  0.46292E-03 ppm1      0.847 ppm2      0.593 CV     1
 ASSI { 2482}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 98   and name HA  ))
      5.900     4.300     0.100 peak  2482 spectrum    1 weight  0.11000E+01 volume  0.11643E-03 ppm1      0.839 ppm2      3.854 CV     1
 ASSI { 2483}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 44   and name HA  ))
      6.000     6.000     0.000 peak  2483 spectrum    1 weight  0.11000E+01 volume  0.57442E-04 ppm1      0.839 ppm2      4.390 CV     1
 ASSI { 2485}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 116  and name HA  ))
      4.600     2.600     1.400 peak  2485 spectrum    1 weight  0.11000E+01 volume  0.21243E-03 ppm1      0.854 ppm2      5.350 CV     1
 ASSI { 2487}
   (( segid "    " and resid 45   and name HB2 ))
   (  segid "    " and resid 120  and name HE% )
      5.900     4.400     0.100 peak  2487 spectrum    1 weight  0.11000E+01 volume  0.10441E-03 ppm1      0.833 ppm2      6.708 CV     1
 ASSI { 2488}
   (( segid "    " and resid 45   and name HB2 ))
   (  segid "    " and resid 120  and name HD% )
      4.500     2.500     1.500 peak  2488 spectrum    1 weight  0.11000E+01 volume  0.18091E-03 ppm1      0.849 ppm2      6.939 CV     1
 ASSI { 2490}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 45   and name HN  ))
      5.700     4.100     0.300 peak  2490 spectrum    1 weight  0.10000E+01 volume  0.69281E-04 ppm1      0.859 ppm2      8.344 CV     1
 ASSI { 2500}
   (  segid "    " and resid 45   and name HD1%)
   (( segid "    " and resid 120  and name HB2 ))
      5.100     3.200     0.900 peak  2500 spectrum    1 weight  0.11000E+01 volume  0.45816E-03 ppm1      0.812 ppm2      2.552 CV     1
 ASSI { 2504}
   (  segid "    " and resid 45   and name HD1%)
   (( segid "    " and resid 38   and name HA  ))
      3.800     1.800     1.800 peak  2504 spectrum    1 weight  0.10000E+01 volume  0.22243E-02 ppm1      0.782 ppm2      4.762 CV     1
 ASSI { 2506}
   (  segid "    " and resid 45   and name HD1%)
   (  segid "    " and resid 120  and name HE% )
      5.800     5.800     0.200 peak  2506 spectrum    1 weight  0.11000E+01 volume  0.19821E-03 ppm1      0.795 ppm2      6.705 CV     1
 ASSI { 2507}
   (  segid "    " and resid 45   and name HD1%)
   (  segid "    " and resid 120  and name HD% )
      4.300     2.300     1.700 peak  2507 spectrum    1 weight  0.11000E+01 volume  0.94015E-03 ppm1      0.784 ppm2      6.946 CV     1
 ASSI { 2508}
   (  segid "    " and resid 45   and name HD1%)
   (( segid "    " and resid 46   and name HE  ))
      4.300     4.300     1.700 peak  2508 spectrum    1 weight  0.11000E+01 volume  0.12538E-02 ppm1      0.764 ppm2      7.178 CV     1
 ASSI { 2510}
   (  segid "    " and resid 45   and name HD2%)
   (( segid "    " and resid 39   and name HG12))
      6.000     4.500     0.000 peak  2510 spectrum    1 weight  0.11000E+01 volume  0.24075E-03 ppm1      0.507 ppm2      0.981 CV     1
 ASSI { 2511}
   (  segid "    " and resid 45   and name HD2%)
   (( segid "    " and resid 39   and name HB  ))
      3.200     1.300     1.300 peak  2511 spectrum    1 weight  0.11000E+01 volume  0.22183E-02 ppm1      0.526 ppm2      1.619 CV     1
 ASSI { 2512}
   (  segid "    " and resid 45   and name HD2%)
   (( segid "    " and resid 39   and name HG11))
      4.500     2.600     1.500 peak  2512 spectrum    1 weight  0.11000E+01 volume  0.75970E-03 ppm1      0.514 ppm2      1.815 CV     1
 ASSI { 2514}
   (  segid "    " and resid 45   and name HD2%)
   (( segid "    " and resid 120  and name HB2 ))
      5.700     4.000     0.300 peak  2514 spectrum    1 weight  0.11000E+01 volume  0.16637E-03 ppm1      0.530 ppm2      2.566 CV     1
 ASSI { 2515}
   (  segid "    " and resid 45   and name HD2%)
   (( segid "    " and resid 120  and name HB1 ))
      4.800     2.900     1.200 peak  2515 spectrum    1 weight  0.11000E+01 volume  0.91953E-04 ppm1      0.512 ppm2      3.265 CV     1
 ASSI { 2516}
   (  segid "    " and resid 45   and name HD2%)
   (( segid "    " and resid 39   and name HA  ))
      6.000     6.000     0.000 peak  2516 spectrum    1 weight  0.11000E+01 volume  0.13263E-03 ppm1      0.509 ppm2      3.482 CV     1
 ASSI { 2522}
   (  segid "    " and resid 45   and name HD2%)
   (  segid "    " and resid 120  and name HD% )
      4.200     2.200     1.800 peak  2522 spectrum    1 weight  0.11000E+01 volume  0.26308E-03 ppm1      0.518 ppm2      6.933 CV     1
 ASSI { 2526}
   (( segid "    " and resid 45   and name HG  ))
   (  segid "    " and resid 120  and name HD% )
      6.000     5.700     0.000 peak  2526 spectrum    1 weight  0.11000E+01 volume  0.49927E-04 ppm1      1.274 ppm2      6.945 CV     1
 ASSI { 2527}
   (( segid "    " and resid 45   and name HG  ))
   (  segid "    " and resid 120  and name HE% )
      6.000     6.000     0.000 peak  2527 spectrum    1 weight  0.11000E+01 volume  0.43141E-04 ppm1      1.258 ppm2      6.725 CV     1
 ASSI { 2528}
   (  segid "    " and resid 45   and name HD2%)
   (  segid "    " and resid 120  and name HE% )
      4.700     2.800     1.300 peak  2528 spectrum    1 weight  0.11000E+01 volume  0.23245E-03 ppm1      0.520 ppm2      6.702 CV     1
 ASSI { 2532}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 45   and name HG  ))
      6.000     5.800     0.000 peak  2532 spectrum    1 weight  0.11000E+01 volume  0.85745E-04 ppm1      5.333 ppm2      1.287 CV     1
 ASSI { 2537}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 45   and name HG  ))
      5.800     4.200     0.200 peak  2537 spectrum    1 weight  0.11000E+01 volume  0.14165E-03 ppm1      3.841 ppm2      1.282 CV     1
 ASSI { 2539}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 120  and name HB1 ))
      6.000     6.000     0.000 peak  2539 spectrum    1 weight  0.11000E+01 volume  0.30658E-04 ppm1      1.716 ppm2      3.292 CV     1
 ASSI { 2544}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 120  and name HB2 ))
      4.800     2.900     1.200 peak  2544 spectrum    1 weight  0.11000E+01 volume  0.80200E-04 ppm1      0.840 ppm2      2.552 CV     1
 ASSI { 2547}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 44   and name HA  ))
      5.200     3.400     0.800 peak  2547 spectrum    1 weight  0.11000E+01 volume  0.12649E-03 ppm1      5.212 ppm2      4.376 CV     1
 ASSI { 2548}
   (( segid "    " and resid 50   and name HA  ))
   (  segid "    " and resid 111  and name HG2%)
      6.000     6.000     0.000 peak  2548 spectrum    1 weight  0.11000E+01 volume  0.14706E-03 ppm1      4.459 ppm2      1.205 CV     1
 ASSI { 2553}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 111  and name HB  ))
      4.000     2.000     2.000 peak  2553 spectrum    1 weight  0.11000E+01 volume  0.21270E-03 ppm1      1.465 ppm2      3.783 CV     1
 ASSI { 2554}
   (( segid "    " and resid 90   and name HB2 ))
   (  segid "    " and resid 88   and name HE% )
      5.600     3.900     0.400 peak  2554 spectrum    1 weight  0.11000E+01 volume  0.10651E-03 ppm1      1.467 ppm2      7.154 CV     1
 ASSI { 2560}
   (( segid "    " and resid 50   and name HG  ))
   (( segid "    " and resid 113  and name HG2 ))
      6.000     6.000     0.000 peak  2560 spectrum    1 weight  0.11000E+01 volume  0.21810E-03 ppm1      1.617 ppm2      2.462 CV     1
 ASSI { 2564}
   (( segid "    " and resid 59   and name HG2 ))
   (( segid "    " and resid 59   and name HN  ))
      6.000     4.800     0.000 peak  2564 spectrum    1 weight  0.10000E+01 volume  0.34919E-04 ppm1      1.596 ppm2      8.022 CV     1
 ASSI { 2566}
   (  segid "    " and resid 50   and name HD1%)
   (  segid "    " and resid 111  and name HG2%)
      2.600     0.800     0.800 peak  2566 spectrum    1 weight  0.11000E+01 volume  0.44476E-02 ppm1      0.836 ppm2      1.195 CV     1
 ASSI { 2568}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 113  and name HB1 ))
      3.300     1.400     1.400 peak  2568 spectrum    1 weight  0.11000E+01 volume  0.23496E-02 ppm1      0.837 ppm2      2.025 CV     1
 ASSI { 2569}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 110  and name HB1 ))
      4.200     4.200     1.800 peak  2569 spectrum    1 weight  0.11000E+01 volume  0.16178E-02 ppm1      0.839 ppm2      2.146 CV     1
 ASSI { 2570}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 113  and name HA  ))
      4.200     2.200     1.800 peak  2570 spectrum    1 weight  0.11000E+01 volume  0.56369E-03 ppm1      0.842 ppm2      5.533 CV     1
 ASSI { 2571}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 111  and name HA  ))
      5.100     3.200     0.900 peak  2571 spectrum    1 weight  0.11000E+01 volume  0.28905E-03 ppm1      0.840 ppm2      5.616 CV     1
 ASSI { 2572}
   (  segid "    " and resid 50   and name HD2%)
   (( segid "    " and resid 113  and name HB2 ))
      3.700     1.700     1.700 peak  2572 spectrum    1 weight  0.11000E+01 volume  0.12240E-02 ppm1      0.755 ppm2      1.919 CV     1
 ASSI { 2573}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 83   and name HG2 ))
      4.000     4.000     2.000 peak  2573 spectrum    1 weight  0.11000E+01 volume  0.95412E-03 ppm1      0.750 ppm2      2.147 CV     1
 ASSI { 2574}
   (  segid "    " and resid 50   and name HD2%)
   (( segid "    " and resid 48   and name HE2 ))
      4.100     2.100     1.900 peak  2574 spectrum    1 weight  0.11000E+01 volume  0.10508E-02 ppm1      0.752 ppm2      2.308 CV     1
 ASSI { 2575}
   (  segid "    " and resid 50   and name HD2%)
   (( segid "    " and resid 113  and name HG2 ))
      4.800     4.800     1.200 peak  2575 spectrum    1 weight  0.11000E+01 volume  0.75301E-03 ppm1      0.769 ppm2      2.474 CV     1
 ASSI { 2576}
   (  segid "    " and resid 50   and name HD2%)
   (( segid "    " and resid 48   and name HA  ))
      4.800     2.900     1.200 peak  2576 spectrum    1 weight  0.10000E+01 volume  0.64291E-03 ppm1      0.742 ppm2      4.670 CV     1
 ASSI { 2577}
   (  segid "    " and resid 50   and name HD2%)
   (( segid "    " and resid 112  and name HA  ))
      5.100     3.200     0.900 peak  2577 spectrum    1 weight  0.11000E+01 volume  0.55190E-03 ppm1      0.767 ppm2      5.197 CV     1
 ASSI { 2578}
   (  segid "    " and resid 50   and name HD2%)
   (( segid "    " and resid 113  and name HA  ))
      5.700     4.100     0.300 peak  2578 spectrum    1 weight  0.11000E+01 volume  0.22143E-03 ppm1      0.763 ppm2      5.517 CV     1
 ASSI { 2581}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 48   and name HE2 ))
      5.700     5.700     0.300 peak  2581 spectrum    1 weight  0.11000E+01 volume  0.29900E-03 ppm1      0.863 ppm2      2.310 CV     1
 ASSI { 2582}
   (  segid "    " and resid 111  and name HG2%)
   (( segid "    " and resid 50   and name HB2 ))
      4.100     2.100     1.900 peak  2582 spectrum    1 weight  0.11000E+01 volume  0.14979E-02 ppm1      1.188 ppm2      1.469 CV     1
 ASSI { 2588}
   (( segid "    " and resid 70   and name HA  ))
   (  segid "    " and resid 68   and name HG1%)
      6.000     6.000     0.000 peak  2588 spectrum    1 weight  0.11000E+01 volume  0.11983E-03 ppm1      5.375 ppm2      1.093 CV     1
 ASSI { 2596}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 69   and name HD2 ))
      4.100     2.100     1.900 peak  2596 spectrum    1 weight  0.11000E+01 volume  0.18614E-03 ppm1      5.373 ppm2      6.918 CV     1
 ASSI { 2597}
   (( segid "    " and resid 70   and name HB1 ))
   (  segid "    " and resid 68   and name HG1%)
      5.700     5.700     0.300 peak  2597 spectrum    1 weight  0.11000E+01 volume  0.19661E-03 ppm1      1.895 ppm2      1.115 CV     1
 ASSI { 2598}
   (( segid "    " and resid 70   and name HB1 ))
   (( segid "    " and resid 99   and name HB2 ))
      4.900     3.000     1.100 peak  2598 spectrum    1 weight  0.10000E+01 volume  0.63424E-03 ppm1      1.872 ppm2      1.358 CV     1
 OR { 2598}
   (( segid "    " and resid 70   and name HB1 ))
   (( segid "    " and resid 99   and name HG  ))
 ASSI { 2599}
   (( segid "    " and resid 70   and name HB1 ))
   (( segid "    " and resid 83   and name HG1 ))
      4.400     2.400     1.600 peak  2599 spectrum    1 weight  0.11000E+01 volume  0.46227E-03 ppm1      1.897 ppm2      2.162 CV     1
 OR { 2599}
   (( segid "    " and resid 70   and name HB1 ))
   (( segid "    " and resid 83   and name HG2 ))
 ASSI { 2600}
   (( segid "    " and resid 70   and name HB1 ))
   (( segid "    " and resid 81   and name HG1 ))
      6.000     6.000     0.000 peak  2600 spectrum    1 weight  0.11000E+01 volume  0.16449E-03 ppm1      1.919 ppm2      2.424 CV     1
 ASSI { 2602}
   (( segid "    " and resid 70   and name HB1 ))
   (( segid "    " and resid 71   and name HA  ))
      5.800     4.300     0.200 peak  2602 spectrum    1 weight  0.11000E+01 volume  0.15417E-03 ppm1      1.887 ppm2      5.042 CV     1
 ASSI { 2608}
   (( segid "    " and resid 70   and name HB2 ))
   (  segid "    " and resid 140  and name HD2%)
      6.000     6.000     0.000 peak  2608 spectrum    1 weight  0.11000E+01 volume  0.51811E-04 ppm1      1.250 ppm2      0.667 CV     1
 ASSI { 2612}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 83   and name HB1 ))
      5.700     5.700     0.300 peak  2612 spectrum    1 weight  0.11000E+01 volume  0.18399E-03 ppm1      1.239 ppm2      2.101 CV     1
 ASSI { 2613}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 83   and name HG1 ))
      6.000     4.500     0.000 peak  2613 spectrum    1 weight  0.11000E+01 volume  0.20309E-03 ppm1      1.235 ppm2      2.194 CV     1
 OR { 2613}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 83   and name HG2 ))
 ASSI { 2614}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 72   and name HB  ))
      6.000     5.800     0.000 peak  2614 spectrum    1 weight  0.11000E+01 volume  0.74034E-04 ppm1      1.240 ppm2      4.001 CV     1
 ASSI { 2617}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 71   and name HA  ))
      5.800     4.200     0.200 peak  2617 spectrum    1 weight  0.11000E+01 volume  0.15734E-03 ppm1      1.264 ppm2      5.081 CV     1
 ASSI { 2625}
   (( segid "    " and resid 70   and name HG  ))
   (( segid "    " and resid 83   and name HG1 ))
      5.900     4.300     0.100 peak  2625 spectrum    1 weight  0.11000E+01 volume  0.21600E-03 ppm1      1.475 ppm2      2.188 CV     1
 OR { 2625}
   (( segid "    " and resid 70   and name HG  ))
   (( segid "    " and resid 83   and name HG2 ))
 ASSI { 2626}
   (( segid "    " and resid 70   and name HG  ))
   (( segid "    " and resid 71   and name HA  ))
      4.100     2.100     1.900 peak  2626 spectrum    1 weight  0.11000E+01 volume  0.29528E-03 ppm1      1.491 ppm2      5.057 CV     1
 ASSI { 2627}
   (( segid "    " and resid 70   and name HG  ))
   (( segid "    " and resid 72   and name HA  ))
      4.800     2.800     1.200 peak  2627 spectrum    1 weight  0.10000E+01 volume  0.17100E-03 ppm1      1.499 ppm2      4.905 CV     1
 ASSI { 2632}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 71   and name HA  ))
      4.000     2.000     2.000 peak  2632 spectrum    1 weight  0.11000E+01 volume  0.18722E-02 ppm1      0.941 ppm2      5.070 CV     1
 ASSI { 2634}
   (  segid "    " and resid 70   and name HD2%)
   (  segid "    " and resid 68   and name HG1%)
      3.700     3.700     2.300 peak  2634 spectrum    1 weight  0.11000E+01 volume  0.40221E-02 ppm1      0.781 ppm2      1.097 CV     1
 ASSI { 2637}
   (  segid "    " and resid 70   and name HD2%)
   (( segid "    " and resid 83   and name HB1 ))
      2.900     1.000     1.000 peak  2637 spectrum    1 weight  0.11000E+01 volume  0.22579E-02 ppm1      0.782 ppm2      2.051 CV     1
 ASSI { 2638}
   (  segid "    " and resid 70   and name HD2%)
   (( segid "    " and resid 83   and name HG1 ))
      3.800     1.800     1.800 peak  2638 spectrum    1 weight  0.11000E+01 volume  0.14199E-02 ppm1      0.789 ppm2      2.184 CV     1
 OR { 2638}
   (  segid "    " and resid 70   and name HD2%)
   (( segid "    " and resid 83   and name HG2 ))
 ASSI { 2643}
   (  segid "    " and resid 70   and name HD2%)
   (( segid "    " and resid 69   and name HD2 ))
      4.500     4.500     1.500 peak  2643 spectrum    1 weight  0.11000E+01 volume  0.10821E-02 ppm1      0.781 ppm2      6.961 CV     1
 ASSI { 2645}
   (( segid "    " and resid 70   and name HB1 ))
   (( segid "    " and resid 69   and name HD2 ))
      6.000     6.000     0.000 peak  2645 spectrum    1 weight  0.11000E+01 volume  0.81956E-04 ppm1      1.861 ppm2      6.958 CV     1
 ASSI { 2646}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 69   and name HD2 ))
      6.000     6.000     0.000 peak  2646 spectrum    1 weight  0.11000E+01 volume  0.37970E-03 ppm1      0.943 ppm2      6.935 CV     1
 ASSI { 2647}
   (  segid "    " and resid 70   and name HD2%)
   (( segid "    " and resid 71   and name HA  ))
      4.000     2.000     2.000 peak  2647 spectrum    1 weight  0.11000E+01 volume  0.58576E-03 ppm1      0.805 ppm2      5.054 CV     1
 ASSI { 2651}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 83   and name HG1 ))
      5.100     5.100     0.900 peak  2651 spectrum    1 weight  0.11000E+01 volume  0.44041E-03 ppm1      0.937 ppm2      2.189 CV     1
 OR { 2651}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 83   and name HG2 ))
 ASSI { 2653}
   (( segid "    " and resid 83   and name HG2 ))
   (( segid "    " and resid 70   and name HG  ))
      5.100     3.300     0.900 peak  2653 spectrum    1 weight  0.11000E+01 volume  0.21891E-03 ppm1      2.192 ppm2      1.470 CV     1
 ASSI { 2654}
   (( segid "    " and resid 83   and name HG2 ))
   (( segid "    " and resid 70   and name HA  ))
      4.800     4.800     1.200 peak  2654 spectrum    1 weight  0.11000E+01 volume  0.17363E-03 ppm1      2.218 ppm2      5.399 CV     1
 ASSI { 2655}
   (( segid "    " and resid 71   and name HG2 ))
   (( segid "    " and resid 70   and name HA  ))
      6.000     5.300     0.000 peak  2655 spectrum    1 weight  0.11000E+01 volume  0.21403E-03 ppm1      2.222 ppm2      5.389 CV     1
 ASSI { 2656}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 70   and name HA  ))
      6.000     4.700     0.000 peak  2656 spectrum    1 weight  0.11000E+01 volume  0.17154E-03 ppm1      2.103 ppm2      5.383 CV     1
 ASSI { 2659}
   (  segid "    " and resid 140  and name HD1%)
   (( segid "    " and resid 72   and name HB  ))
      4.500     4.500     1.500 peak  2659 spectrum    1 weight  0.11000E+01 volume  0.11784E-02 ppm1      0.980 ppm2      4.065 CV     1
 ASSI { 2660}
   (( segid "    " and resid 70   and name HB1 ))
   (  segid "    " and resid 140  and name HD2%)
      6.000     6.000     0.000 peak  2660 spectrum    1 weight  0.11000E+01 volume  0.47379E-04 ppm1      1.912 ppm2      0.676 CV     1
 ASSI { 2661}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 81   and name HG1 ))
      6.000     6.000     0.000 peak  2661 spectrum    1 weight  0.11000E+01 volume  0.46630E-04 ppm1      1.241 ppm2      2.422 CV     1
 ASSI { 2662}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 75   and name HG1 ))
      6.000     6.000     0.000 peak  2662 spectrum    1 weight  0.11000E+01 volume  0.43783E-04 ppm1      4.731 ppm2      2.271 CV     1
 OR { 2662}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 75   and name HG2 ))
 ASSI { 2667}
   (( segid "    " and resid 74   and name HB2 ))
   (  segid "    " and resid 80   and name HG2%)
      4.400     4.400     1.600 peak  2667 spectrum    1 weight  0.11000E+01 volume  0.10672E-02 ppm1      1.957 ppm2      0.749 CV     1
 OR { 2667}
   (( segid "    " and resid 74   and name HB1 ))
   (  segid "    " and resid 80   and name HG2%)
 ASSI { 2668}
   (( segid "    " and resid 74   and name HB1 ))
   (  segid "    " and resid 138  and name HD1%)
      5.000     5.000     1.000 peak  2668 spectrum    1 weight  0.11000E+01 volume  0.38038E-03 ppm1      1.971 ppm2      1.062 CV     1
 ASSI { 2669}
   (( segid "    " and resid 74   and name HB2 ))
   (( segid "    " and resid 79   and name HG2 ))
      4.700     4.700     1.300 peak  2669 spectrum    1 weight  0.11000E+01 volume  0.12210E-02 ppm1      1.954 ppm2      1.601 CV     1
 OR { 2669}
   (( segid "    " and resid 74   and name HB1 ))
   (( segid "    " and resid 79   and name HG2 ))
 ASSI { 2671}
   (( segid "    " and resid 74   and name HB1 ))
   (( segid "    " and resid 75   and name HG1 ))
      4.900     4.900     1.100 peak  2671 spectrum    1 weight  0.11000E+01 volume  0.30898E-03 ppm1      1.963 ppm2      2.315 CV     1
 ASSI { 2675}
   (( segid "    " and resid 74   and name HB1 ))
   (( segid "    " and resid 73   and name HB2 ))
      6.000     5.800     0.000 peak  2675 spectrum    1 weight  0.10000E+01 volume  0.92403E-04 ppm1      1.965 ppm2      3.709 CV     1
 OR { 2675}
   (( segid "    " and resid 74   and name HB1 ))
   (( segid "    " and resid 73   and name HB1 ))
 ASSI { 2680}
   (( segid "    " and resid 74   and name HB1 ))
   (( segid "    " and resid 137  and name HN  ))
      6.000     6.000     0.000 peak  2680 spectrum    1 weight  0.11000E+01 volume  0.73092E-04 ppm1      1.964 ppm2      8.367 CV     1
 ASSI { 2685}
   (( segid "    " and resid 74   and name HG  ))
   (( segid "    " and resid 78   and name HB  ))
      3.400     1.400     1.400 peak  2685 spectrum    1 weight  0.11000E+01 volume  0.76880E-03 ppm1      1.740 ppm2      4.062 CV     1
 ASSI { 2688}
   (( segid "    " and resid 79   and name HG2 ))
   (( segid "    " and resid 73   and name HA  ))
      3.500     1.500     1.500 peak  2688 spectrum    1 weight  0.11000E+01 volume  0.34148E-03 ppm1      1.695 ppm2      5.540 CV     1
 ASSI { 2691}
   (  segid "    " and resid 74   and name HD1%)
   (  segid "    " and resid 132  and name HD1%)
      3.700     1.700     1.700 peak  2691 spectrum    1 weight  0.11000E+01 volume  0.16673E-02 ppm1      1.178 ppm2      0.457 CV     1
 ASSI { 2694}
   (  segid "    " and resid 72   and name HG2%)
   (( segid "    " and resid 71   and name HB2 ))
      5.300     5.300     0.700 peak  2694 spectrum    1 weight  0.11000E+01 volume  0.27406E-03 ppm1      1.180 ppm2      2.092 CV     1
 ASSI { 2695}
   (  segid "    " and resid 72   and name HG2%)
   (( segid "    " and resid 71   and name HA  ))
      6.000     6.000     0.000 peak  2695 spectrum    1 weight  0.11000E+01 volume  0.13091E-03 ppm1      1.175 ppm2      5.039 CV     1
 ASSI { 2696}
   (  segid "    " and resid 74   and name HD1%)
   (( segid "    " and resid 138  and name HA  ))
      5.200     5.200     0.800 peak  2696 spectrum    1 weight  0.11000E+01 volume  0.49638E-03 ppm1      1.176 ppm2      5.288 CV     1
 ASSI { 2697}
   (  segid "    " and resid 74   and name HD1%)
   (( segid "    " and resid 73   and name HA  ))
      6.000     6.000     0.000 peak  2697 spectrum    1 weight  0.11000E+01 volume  0.25929E-03 ppm1      1.178 ppm2      5.547 CV     1
 ASSI { 2698}
   (  segid "    " and resid 72   and name HG2%)
   (( segid "    " and resid 71   and name HE22))
      5.700     5.700     0.300 peak  2698 spectrum    1 weight  0.11000E+01 volume  0.41881E-03 ppm1      1.181 ppm2      6.631 CV     1
 ASSI { 2699}
   (  segid "    " and resid 72   and name HG2%)
   (  segid "    " and resid 122  and name HD% )
      6.000     4.600     0.000 peak  2699 spectrum    1 weight  0.10000E+01 volume  0.14090E-03 ppm1      1.171 ppm2      7.114 CV     1
 ASSI { 2702}
   (  segid "    " and resid 74   and name HD2%)
   (( segid "    " and resid 138  and name HB2 ))
      3.700     3.700     2.300 peak  2702 spectrum    1 weight  0.11000E+01 volume  0.25910E-02 ppm1      0.837 ppm2      1.378 CV     1
 ASSI { 2703}
   (  segid "    " and resid 74   and name HD2%)
   (( segid "    " and resid 79   and name HG2 ))
      3.600     3.600     2.400 peak  2703 spectrum    1 weight  0.11000E+01 volume  0.35706E-02 ppm1      0.855 ppm2      1.619 CV     1
 ASSI { 2705}
   (  segid "    " and resid 74   and name HD2%)
   (( segid "    " and resid 75   and name HG1 ))
      5.400     5.400     0.600 peak  2705 spectrum    1 weight  0.11000E+01 volume  0.38440E-03 ppm1      0.831 ppm2      2.284 CV     1
 OR { 2705}
   (  segid "    " and resid 74   and name HD2%)
   (( segid "    " and resid 75   and name HG2 ))
 ASSI { 2706}
   (  segid "    " and resid 74   and name HD2%)
   (( segid "    " and resid 76   and name HB1 ))
      4.600     2.600     1.400 peak  2706 spectrum    1 weight  0.10000E+01 volume  0.14337E-02 ppm1      0.848 ppm2      3.338 CV     1
 ASSI { 2708}
   (  segid "    " and resid 74   and name HD2%)
   (( segid "    " and resid 81   and name HE22))
      5.300     3.500     0.700 peak  2708 spectrum    1 weight  0.10000E+01 volume  0.26672E-03 ppm1      0.829 ppm2      6.701 CV     1
 ASSI { 2709}
   (  segid "    " and resid 74   and name HD2%)
   (( segid "    " and resid 137  and name HN  ))
      6.000     6.000     0.000 peak  2709 spectrum    1 weight  0.11000E+01 volume  0.51683E-04 ppm1      0.841 ppm2      8.363 CV     1
 ASSI { 2710}
   (( segid "    " and resid 78   and name HA  ))
   (( segid "    " and resid 74   and name HB1 ))
      5.600     3.900     0.400 peak  2710 spectrum    1 weight  0.11000E+01 volume  0.51160E-03 ppm1      4.060 ppm2      1.975 CV     1
 ASSI { 2711}
   (  segid "    " and resid 74   and name HD2%)
   (( segid "    " and resid 78   and name HB  ))
      4.900     3.000     1.100 peak  2711 spectrum    1 weight  0.11000E+01 volume  0.48989E-03 ppm1      0.844 ppm2      4.060 CV     1
 ASSI { 2712}
   (( segid "    " and resid 79   and name HG2 ))
   (( segid "    " and resid 73   and name HB1 ))
      4.400     2.400     1.600 peak  2712 spectrum    1 weight  0.11000E+01 volume  0.29909E-03 ppm1      1.706 ppm2      3.735 CV     1
 OR { 2712}
   (( segid "    " and resid 79   and name HG2 ))
   (( segid "    " and resid 73   and name HB2 ))
 OR { 2712}
   (( segid "    " and resid 79   and name HG1 ))
   (( segid "    " and resid 73   and name HB2 ))
 ASSI { 2714}
   (( segid "    " and resid 74   and name HG  ))
   (( segid "    " and resid 75   and name HG1 ))
      6.000     6.000     0.000 peak  2714 spectrum    1 weight  0.11000E+01 volume  0.17474E-03 ppm1      1.751 ppm2      2.286 CV     1
 OR { 2714}
   (( segid "    " and resid 74   and name HG  ))
   (( segid "    " and resid 75   and name HG2 ))
 ASSI { 2717}
   (( segid "    " and resid 73   and name HA  ))
   (  segid "    " and resid 74   and name HD2%)
      3.600     1.600     1.600 peak  2717 spectrum    1 weight  0.11000E+01 volume  0.95843E-03 ppm1      5.545 ppm2      0.830 CV     1
 ASSI { 2719}
   (( segid "    " and resid 74   and name HB1 ))
   (  segid "    " and resid 132  and name HD1%)
      6.000     6.000     0.000 peak  2719 spectrum    1 weight  0.11000E+01 volume  0.74291E-04 ppm1      1.958 ppm2      0.459 CV     1
 ASSI { 2720}
   (  segid "    " and resid 132  and name HD1%)
   (( segid "    " and resid 74   and name HB2 ))
      2.800     2.800     3.200 peak  2720 spectrum    1 weight  0.11000E+01 volume  0.19483E-03 ppm1      0.457 ppm2      1.913 CV     1
 ASSI { 2733}
   (( segid "    " and resid 86   and name HB2 ))
   (  segid "    " and resid 68   and name HG1%)
      5.700     5.700     0.300 peak  2733 spectrum    1 weight  0.11000E+01 volume  0.80619E-03 ppm1      1.287 ppm2      1.094 CV     1
 ASSI { 2734}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 68   and name HB  ))
      5.200     5.200     0.800 peak  2734 spectrum    1 weight  0.11000E+01 volume  0.49449E-03 ppm1      1.299 ppm2      2.181 CV     1
 ASSI { 2738}
   (( segid "    " and resid 86   and name HG  ))
   (  segid "    " and resid 68   and name HG1%)
      5.600     5.600     0.400 peak  2738 spectrum    1 weight  0.11000E+01 volume  0.58088E-03 ppm1      1.606 ppm2      1.085 CV     1
 ASSI { 2740}
   (( segid "    " and resid 128  and name HG2 ))
   (( segid "    " and resid 128  and name HB2 ))
      2.900     1.000     1.000 peak  2740 spectrum    1 weight  0.10000E+01 volume  0.68626E-02 ppm1      1.634 ppm2      1.804 CV     1
 ASSI { 2742}
   (( segid "    " and resid 86   and name HG  ))
   (( segid "    " and resid 85   and name HA  ))
      2.200     2.200     3.800 peak  2742 spectrum    1 weight  0.11000E+01 volume  0.84340E-03 ppm1      1.614 ppm2      4.378 CV     1
 ASSI { 2743}
   (( segid "    " and resid 86   and name HG  ))
   (  segid "    " and resid 88   and name HD% )
      3.600     1.600     1.600 peak  2743 spectrum    1 weight  0.11000E+01 volume  0.11553E-02 ppm1      1.595 ppm2      6.964 CV     1
 ASSI { 2744}
   (( segid "    " and resid 86   and name HG  ))
   (  segid "    " and resid 88   and name HE% )
      5.600     3.900     0.400 peak  2744 spectrum    1 weight  0.11000E+01 volume  0.45830E-03 ppm1      1.597 ppm2      7.176 CV     1
 ASSI { 2748}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 68   and name HB  ))
      5.100     5.100     0.900 peak  2748 spectrum    1 weight  0.11000E+01 volume  0.87051E-03 ppm1      0.946 ppm2      2.187 CV     1
 ASSI { 2749}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 88   and name HB1 ))
      5.700     4.000     0.300 peak  2749 spectrum    1 weight  0.10000E+01 volume  0.22120E-03 ppm1      0.953 ppm2      3.135 CV     1
 OR { 2749}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 88   and name HB2 ))
 ASSI { 2750}
   (  segid "    " and resid 86   and name HD1%)
   (  segid "    " and resid 88   and name HD% )
      5.200     3.400     0.800 peak  2750 spectrum    1 weight  0.11000E+01 volume  0.59493E-03 ppm1      0.948 ppm2      6.958 CV     1
 ASSI { 2751}
   (  segid "    " and resid 86   and name HD1%)
   (  segid "    " and resid 88   and name HE% )
      6.000     5.800     0.000 peak  2751 spectrum    1 weight  0.11000E+01 volume  0.29093E-03 ppm1      0.957 ppm2      7.180 CV     1
 ASSI { 2758}
   (( segid "    " and resid 86   and name HB2 ))
   (  segid "    " and resid 88   and name HD% )
      6.000     6.000     0.000 peak  2758 spectrum    1 weight  0.11000E+01 volume  0.15353E-03 ppm1      1.352 ppm2      6.966 CV     1
 ASSI { 2759}
   (( segid "    " and resid 86   and name HB2 ))
   (  segid "    " and resid 88   and name HE% )
      6.000     6.000     0.000 peak  2759 spectrum    1 weight  0.11000E+01 volume  0.11581E-03 ppm1      1.357 ppm2      7.181 CV     1
 ASSI { 2764}
   (( segid "    " and resid 90   and name HA  ))
   (( segid "    " and resid 104  and name HD2 ))
      6.000     6.000     0.000 peak  2764 spectrum    1 weight  0.11000E+01 volume  0.88699E-04 ppm1      4.359 ppm2      3.107 CV     1
 ASSI { 2767}
   (( segid "    " and resid 90   and name HB1 ))
   (  segid "    " and resid 88   and name HD% )
      5.800     4.200     0.200 peak  2767 spectrum    1 weight  0.11000E+01 volume  0.17914E-03 ppm1      1.963 ppm2      6.939 CV     1
 ASSI { 2770}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 112  and name HA  ))
      5.900     4.300     0.100 peak  2770 spectrum    1 weight  0.10000E+01 volume  0.13433E-03 ppm1      1.441 ppm2      5.192 CV     1
 ASSI { 2775}
   (  segid "    " and resid 90   and name HD1%)
   (  segid "    " and resid 66   and name HG2%)
      3.700     1.700     1.700 peak  2775 spectrum    1 weight  0.11000E+01 volume  0.87764E-03 ppm1      1.052 ppm2      0.023 CV     1
 ASSI { 2778}
   (  segid "    " and resid 90   and name HD1%)
   (( segid "    " and resid 104  and name HG1 ))
      4.100     2.100     1.900 peak  2778 spectrum    1 weight  0.11000E+01 volume  0.66309E-03 ppm1      1.052 ppm2      2.122 CV     1
 ASSI { 2779}
   (  segid "    " and resid 90   and name HD1%)
   (( segid "    " and resid 103  and name HB  ))
      2.900     1.000     1.000 peak  2779 spectrum    1 weight  0.11000E+01 volume  0.99058E-03 ppm1      1.057 ppm2      2.302 CV     1
 ASSI { 2780}
   (  segid "    " and resid 90   and name HD1%)
   (( segid "    " and resid 104  and name HD2 ))
      4.300     2.300     1.700 peak  2780 spectrum    1 weight  0.11000E+01 volume  0.63612E-03 ppm1      1.057 ppm2      3.131 CV     1
 ASSI { 2787}
   (  segid "    " and resid 90   and name HD2%)
   (( segid "    " and resid 104  and name HD2 ))
      6.000     4.600     0.000 peak  2787 spectrum    1 weight  0.11000E+01 volume  0.18832E-03 ppm1      0.750 ppm2      3.135 CV     1
 ASSI { 2792}
   (( segid "    " and resid 90   and name HB2 ))
   (  segid "    " and resid 88   and name HD% )
      6.000     4.900     0.000 peak  2792 spectrum    1 weight  0.11000E+01 volume  0.60718E-04 ppm1      1.485 ppm2      6.963 CV     1
 ASSI { 2793}
   (( segid "    " and resid 90   and name HG  ))
   (  segid "    " and resid 88   and name HD% )
      6.000     5.100     0.000 peak  2793 spectrum    1 weight  0.11000E+01 volume  0.12225E-03 ppm1      1.597 ppm2      6.948 CV     1
 ASSI { 2794}
   (  segid "    " and resid 90   and name HD2%)
   (  segid "    " and resid 88   and name HD% )
      4.600     4.600     1.400 peak  2794 spectrum    1 weight  0.11000E+01 volume  0.97746E-03 ppm1      0.782 ppm2      6.950 CV     1
 ASSI { 2795}
   (( segid "    " and resid 86   and name HB1 ))
   (  segid "    " and resid 88   and name HE% )
      6.000     5.600     0.000 peak  2795 spectrum    1 weight  0.11000E+01 volume  0.14310E-03 ppm1      2.036 ppm2      7.176 CV     1
 ASSI { 2796}
   (( segid "    " and resid 90   and name HG  ))
   (  segid "    " and resid 88   and name HE% )
      6.000     4.800     0.000 peak  2796 spectrum    1 weight  0.11000E+01 volume  0.10090E-03 ppm1      1.579 ppm2      7.178 CV     1
 ASSI { 2799}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 90   and name HG  ))
      3.000     1.100     1.100 peak  2799 spectrum    1 weight  0.11000E+01 volume  0.77879E-03 ppm1      3.610 ppm2      1.593 CV     1
 ASSI { 2802}
   (( segid "    " and resid 90   and name HB2 ))
   (( segid "    " and resid 103  and name HB  ))
      6.000     6.000     0.000 peak  2802 spectrum    1 weight  0.11000E+01 volume  0.27083E-04 ppm1      1.427 ppm2      2.311 CV     1
 ASSI { 2804}
   (  segid "    " and resid 90   and name HD2%)
   (( segid "    " and resid 103  and name HB  ))
      3.900     1.900     1.900 peak  2804 spectrum    1 weight  0.11000E+01 volume  0.55012E-03 ppm1      0.763 ppm2      2.299 CV     1
 ASSI { 2805}
   (( segid "    " and resid 90   and name HB1 ))
   (( segid "    " and resid 104  and name HG1 ))
      5.000     3.200     1.000 peak  2805 spectrum    1 weight  0.11000E+01 volume  0.39882E-03 ppm1      1.972 ppm2      2.119 CV     1
 ASSI { 2807}
   (( segid "    " and resid 90   and name HG  ))
   (( segid "    " and resid 104  and name HG1 ))
      4.200     2.200     1.800 peak  2807 spectrum    1 weight  0.11000E+01 volume  0.22696E-03 ppm1      1.567 ppm2      2.128 CV     1
 ASSI { 2808}
   (  segid "    " and resid 90   and name HD2%)
   (( segid "    " and resid 88   and name HZ  ))
      5.000     3.200     1.000 peak  2808 spectrum    1 weight  0.11000E+01 volume  0.40800E-03 ppm1      0.772 ppm2      6.849 CV     1
 ASSI { 2809}
   (( segid "    " and resid 90   and name HA  ))
   (( segid "    " and resid 88   and name HZ  ))
      6.000     5.500     0.000 peak  2809 spectrum    1 weight  0.11000E+01 volume  0.56029E-04 ppm1      4.366 ppm2      6.834 CV     1
 ASSI { 2812}
   (( segid "    " and resid 99   and name HB1 ))
   (( segid "    " and resid 95   and name HB  ))
      3.600     1.600     1.600 peak  2812 spectrum    1 weight  0.11000E+01 volume  0.33375E-03 ppm1      1.497 ppm2      1.806 CV     1
 ASSI { 2813}
   (( segid "    " and resid 99   and name HB2 ))
   (( segid "    " and resid 95   and name HB  ))
      5.000     3.100     1.000 peak  2813 spectrum    1 weight  0.11000E+01 volume  0.33240E-03 ppm1      1.333 ppm2      1.814 CV     1
 ASSI { 2815}
   (( segid "    " and resid 99   and name HB1 ))
   (( segid "    " and resid 88   and name HZ  ))
      5.800     4.200     0.200 peak  2815 spectrum    1 weight  0.11000E+01 volume  0.17736E-03 ppm1      1.496 ppm2      6.840 CV     1
 ASSI { 2816}
   (( segid "    " and resid 99   and name HB1 ))
   (  segid "    " and resid 88   and name HD% )
      6.000     5.800     0.000 peak  2816 spectrum    1 weight  0.11000E+01 volume  0.83733E-04 ppm1      1.505 ppm2      6.961 CV     1
 ASSI { 2818}
   (( segid "    " and resid 99   and name HB2 ))
   (  segid "    " and resid 88   and name HE% )
      6.000     4.800     0.000 peak  2818 spectrum    1 weight  0.11000E+01 volume  0.22277E-03 ppm1      1.332 ppm2      7.183 CV     1
 ASSI { 2819}
   (( segid "    " and resid 15   and name HG  ))
   (  segid "    " and resid 15   and name HD2%)
      3.800     1.800     1.800 peak  2819 spectrum    1 weight  0.10000E+01 volume  0.65046E-03 ppm1      1.386 ppm2      0.520 CV     1
 ASSI { 2821}
   (( segid "    " and resid 99   and name HG  ))
   (  segid "    " and resid 88   and name HE% )
      4.900     3.000     1.100 peak  2821 spectrum    1 weight  0.11000E+01 volume  0.13865E-03 ppm1      1.375 ppm2      7.184 CV     1
 ASSI { 2822}
   (  segid "    " and resid 99   and name HD1%)
   (  segid "    " and resid 142  and name HG1%)
      2.400     2.400     3.600 peak  2822 spectrum    1 weight  0.11000E+01 volume  0.44679E-02 ppm1      1.306 ppm2      0.941 CV     1
 ASSI { 2826}
   (  segid "    " and resid 99   and name HD2%)
   (  segid "    " and resid 142  and name HG2%)
      3.300     3.300     2.700 peak  2826 spectrum    1 weight  0.10000E+01 volume  0.59119E-02 ppm1      0.735 ppm2      0.852 CV     1
 ASSI { 2827}
   (  segid "    " and resid 99   and name HD2%)
   (  segid "    " and resid 142  and name HG1%)
      2.700     2.700     3.300 peak  2827 spectrum    1 weight  0.11000E+01 volume  0.25891E-02 ppm1      0.735 ppm2      0.953 CV     1
 ASSI { 2828}
   (  segid "    " and resid 99   and name HD2%)
   (  segid "    " and resid 68   and name HG1%)
      3.600     1.600     1.600 peak  2828 spectrum    1 weight  0.10000E+01 volume  0.12130E-02 ppm1      0.742 ppm2      1.080 CV     1
 ASSI { 2837}
   (  segid "    " and resid 68   and name HG2%)
   (( segid "    " and resid 86   and name HB2 ))
      3.600     1.600     1.600 peak  2837 spectrum    1 weight  0.11000E+01 volume  0.21036E-02 ppm1      0.960 ppm2      1.307 CV     1
 ASSI { 2839}
   (( segid "    " and resid 101  and name HB1 ))
   (  segid "    " and resid 39   and name HG2%)
      2.900     2.900     3.100 peak  2839 spectrum    1 weight  0.11000E+01 volume  0.26868E-02 ppm1      1.601 ppm2      0.846 CV     1
 ASSI { 2841}
   (( segid "    " and resid 101  and name HB1 ))
   (( segid "    " and resid 97   and name HG1 ))
      6.000     6.000     0.000 peak  2841 spectrum    1 weight  0.11000E+01 volume  0.70415E-04 ppm1      1.604 ppm2      2.651 CV     1
 ASSI { 2843}
   (( segid "    " and resid 101  and name HB2 ))
   (( segid "    " and resid 98   and name HA  ))
      4.700     2.700     1.300 peak  2843 spectrum    1 weight  0.11000E+01 volume  0.10872E-03 ppm1      1.161 ppm2      3.855 CV     1
 ASSI { 2844}
   (( segid "    " and resid 101  and name HB1 ))
   (( segid "    " and resid 99   and name HA  ))
      4.800     2.900     1.200 peak  2844 spectrum    1 weight  0.11000E+01 volume  0.89738E-03 ppm1      1.594 ppm2      4.170 CV     1
 ASSI { 2851}
   (( segid "    " and resid 101  and name HB2 ))
   (( segid "    " and resid 102  and name HA  ))
      5.600     3.900     0.400 peak  2851 spectrum    1 weight  0.10000E+01 volume  0.87415E-04 ppm1      1.169 ppm2      4.459 CV     1
 ASSI { 2854}
   (( segid "    " and resid 101  and name HG  ))
   (  segid "    " and resid 39   and name HG2%)
      3.900     3.900     2.100 peak  2854 spectrum    1 weight  0.11000E+01 volume  0.22851E-02 ppm1      1.811 ppm2      0.837 CV     1
 ASSI { 2856}
   (( segid "    " and resid 101  and name HG  ))
   (( segid "    " and resid 100  and name HB2 ))
      5.600     3.900     0.400 peak  2856 spectrum    1 weight  0.11000E+01 volume  0.26124E-03 ppm1      1.825 ppm2      2.422 CV     1
 ASSI { 2857}
   (( segid "    " and resid 20   and name HG  ))
   (( segid "    " and resid 19   and name HZ  ))
      3.200     3.200     2.800 peak  2857 spectrum    1 weight  0.10000E+01 volume  0.90348E-04 ppm1      1.797 ppm2      7.548 CV     1
 ASSI { 2861}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 97   and name HB1 ))
      3.300     1.400     1.400 peak  2861 spectrum    1 weight  0.11000E+01 volume  0.11477E-02 ppm1      0.687 ppm2      2.267 CV     1
 ASSI { 2862}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 97   and name HG2 ))
      5.000     3.100     1.000 peak  2862 spectrum    1 weight  0.11000E+01 volume  0.34816E-03 ppm1      0.687 ppm2      2.483 CV     1
 ASSI { 2863}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 97   and name HG1 ))
      4.100     2.100     1.900 peak  2863 spectrum    1 weight  0.11000E+01 volume  0.26011E-03 ppm1      0.683 ppm2      2.651 CV     1
 ASSI { 2865}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 98   and name HA  ))
      4.600     2.600     1.400 peak  2865 spectrum    1 weight  0.11000E+01 volume  0.29815E-03 ppm1      0.685 ppm2      3.844 CV     1
 ASSI { 2867}
   (  segid "    " and resid 101  and name HD1%)
   (  segid "    " and resid 120  and name HE% )
      2.300     2.300     3.700 peak  2867 spectrum    1 weight  0.11000E+01 volume  0.56380E-03 ppm1      0.680 ppm2      6.707 CV     1
 ASSI { 2868}
   (  segid "    " and resid 101  and name HD1%)
   (  segid "    " and resid 120  and name HD% )
      2.300     2.300     3.700 peak  2868 spectrum    1 weight  0.11000E+01 volume  0.67429E-03 ppm1      0.685 ppm2      6.937 CV     1
 ASSI { 2869}
   (  segid "    " and resid 101  and name HD2%)
   (( segid "    " and resid 100  and name HB1 ))
      5.200     3.400     0.800 peak  2869 spectrum    1 weight  0.11000E+01 volume  0.13221E-03 ppm1      0.526 ppm2      2.563 CV     1
 ASSI { 2876}
   (  segid "    " and resid 39   and name HG2%)
   (( segid "    " and resid 101  and name HB2 ))
      3.400     1.500     1.500 peak  2876 spectrum    1 weight  0.11000E+01 volume  0.63982E-03 ppm1      0.791 ppm2      1.182 CV     1
 ASSI { 2878}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 101  and name HB1 ))
      5.600     4.000     0.400 peak  2878 spectrum    1 weight  0.11000E+01 volume  0.23542E-03 ppm1      3.850 ppm2      1.597 CV     1
 ASSI { 2880}
   (  segid "    " and resid 101  and name HD2%)
   (( segid "    " and resid 98   and name HA  ))
      4.400     4.400     1.600 peak  2880 spectrum    1 weight  0.11000E+01 volume  0.92423E-03 ppm1      0.521 ppm2      3.842 CV     1
 ASSI { 2881}
   (  segid "    " and resid 101  and name HD2%)
   (( segid "    " and resid 97   and name HB1 ))
      3.300     3.300     2.700 peak  2881 spectrum    1 weight  0.11000E+01 volume  0.75448E-04 ppm1      0.509 ppm2      2.287 CV     1
 OR { 2881}
   (  segid "    " and resid 101  and name HD2%)
   (( segid "    " and resid 97   and name HB2 ))
 ASSI { 2882}
   (( segid "    " and resid 101  and name HG  ))
   (( segid "    " and resid 97   and name HB1 ))
      4.700     2.800     1.300 peak  2882 spectrum    1 weight  0.11000E+01 volume  0.17284E-03 ppm1      1.793 ppm2      2.284 CV     1
 ASSI { 2883}
   (( segid "    " and resid 97   and name HB1 ))
   (( segid "    " and resid 101  and name HG  ))
      4.600     2.700     1.400 peak  2883 spectrum    1 weight  0.11000E+01 volume  0.43264E-03 ppm1      2.265 ppm2      1.796 CV     1
 OR { 2883}
   (( segid "    " and resid 97   and name HB2 ))
   (( segid "    " and resid 101  and name HG  ))
 ASSI { 2884}
   (( segid "    " and resid 97   and name HB1 ))
   (  segid "    " and resid 101  and name HD1%)
      3.900     1.900     1.900 peak  2884 spectrum    1 weight  0.11000E+01 volume  0.99236E-03 ppm1      2.264 ppm2      0.687 CV     1
 OR { 2884}
   (( segid "    " and resid 97   and name HB2 ))
   (  segid "    " and resid 101  and name HD1%)
 ASSI { 2887}
   (( segid "    " and resid 100  and name HB1 ))
   (( segid "    " and resid 101  and name HG  ))
      3.400     1.400     1.400 peak  2887 spectrum    1 weight  0.11000E+01 volume  0.74293E-03 ppm1      2.585 ppm2      1.798 CV     1
 ASSI { 2888}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 100  and name HB1 ))
      5.600     3.900     0.400 peak  2888 spectrum    1 weight  0.11000E+01 volume  0.13364E-03 ppm1      0.672 ppm2      2.570 CV     1
 ASSI { 2890}
   (( segid "    " and resid 97   and name HA  ))
   (  segid "    " and resid 101  and name HD1%)
      5.800     4.200     0.200 peak  2890 spectrum    1 weight  0.11000E+01 volume  0.13871E-03 ppm1      4.024 ppm2      0.683 CV     1
 ASSI { 2894}
   (( segid "    " and resid 59   and name HD2 ))
   (( segid "    " and resid 105  and name HA  ))
      4.100     2.100     1.900 peak  2894 spectrum    1 weight  0.11000E+01 volume  0.36306E-03 ppm1      3.072 ppm2      4.374 CV     1
 ASSI { 2896}
   (( segid "    " and resid 105  and name HB1 ))
   (( segid "    " and resid 47   and name HE1 ))
      4.700     2.700     1.300 peak  2896 spectrum    1 weight  0.11000E+01 volume  0.18856E-03 ppm1      1.797 ppm2      2.586 CV     1
 OR { 2896}
   (( segid "    " and resid 105  and name HB1 ))
   (( segid "    " and resid 47   and name HE2 ))
 ASSI { 2897}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 47   and name HE1 ))
      5.500     3.800     0.500 peak  2897 spectrum    1 weight  0.11000E+01 volume  0.15408E-03 ppm1      1.702 ppm2      2.580 CV     1
 OR { 2897}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 47   and name HE2 ))
 ASSI { 2901}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 47   and name HD2 ))
      4.400     4.400     1.600 peak  2901 spectrum    1 weight  0.11000E+01 volume  0.69165E-03 ppm1      1.694 ppm2      1.423 CV     1
 ASSI { 2902}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 102  and name HA  ))
      4.000     2.000     2.000 peak  2902 spectrum    1 weight  0.11000E+01 volume  0.15663E-03 ppm1      1.707 ppm2      4.480 CV     1
 ASSI { 2907}
   (  segid "    " and resid 105  and name HD1%)
   (  segid "    " and resid 39   and name HG2%)
      2.300     0.700     0.700 peak  2907 spectrum    1 weight  0.10000E+01 volume  0.94231E-02 ppm1      0.968 ppm2      0.782 CV     1
 OR { 2907}
   (  segid "    " and resid 105  and name HD1%)
   (  segid "    " and resid 39   and name HD1%)
 ASSI { 2909}
   (  segid "    " and resid 105  and name HD1%)
   (( segid "    " and resid 47   and name HE2 ))
      3.400     1.500     1.500 peak  2909 spectrum    1 weight  0.11000E+01 volume  0.93285E-03 ppm1      0.968 ppm2      2.583 CV     1
 ASSI { 2911}
   (  segid "    " and resid 105  and name HD1%)
   (( segid "    " and resid 47   and name HA  ))
      2.700     2.700     3.300 peak  2911 spectrum    1 weight  0.11000E+01 volume  0.23548E-03 ppm1      0.958 ppm2      5.940 CV     1
 ASSI { 2918}
   (  segid "    " and resid 105  and name HD2%)
   (( segid "    " and resid 104  and name HD2 ))
      2.600     2.600     3.400 peak  2918 spectrum    1 weight  0.11000E+01 volume  0.31337E-03 ppm1      0.876 ppm2      3.094 CV     1
 ASSI { 2923}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 47   and name HE1 ))
      6.000     6.000     0.000 peak  2923 spectrum    1 weight  0.11000E+01 volume  0.41299E-04 ppm1      4.381 ppm2      2.576 CV     1
 OR { 2923}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 47   and name HE2 ))
 ASSI { 2926}
   (( segid "    " and resid 47   and name HE1 ))
   (( segid "    " and resid 105  and name HG  ))
      6.000     5.200     0.000 peak  2926 spectrum    1 weight  0.11000E+01 volume  0.13028E-03 ppm1      2.583 ppm2      1.629 CV     1
 OR { 2926}
   (( segid "    " and resid 47   and name HE2 ))
   (( segid "    " and resid 105  and name HG  ))
 ASSI { 2927}
   (( segid "    " and resid 105  and name HB1 ))
   (( segid "    " and resid 47   and name HD2 ))
      5.600     3.900     0.400 peak  2927 spectrum    1 weight  0.11000E+01 volume  0.22041E-03 ppm1      1.806 ppm2      1.440 CV     1
 ASSI { 2933}
   (( segid "    " and resid 138  and name HA  ))
   (( segid "    " and resid 132  and name HG11))
      5.200     3.400     0.800 peak  2933 spectrum    1 weight  0.10000E+01 volume  0.33069E-03 ppm1      5.244 ppm2      1.028 CV     1
 ASSI { 2934}
   (( segid "    " and resid 138  and name HB1 ))
   (  segid "    " and resid 140  and name HD2%)
      3.900     1.900     1.900 peak  2934 spectrum    1 weight  0.11000E+01 volume  0.26847E-03 ppm1      1.888 ppm2      0.702 CV     1
 ASSI { 2935}
   (( segid "    " and resid 138  and name HB2 ))
   (  segid "    " and resid 140  and name HD2%)
      5.400     3.600     0.600 peak  2935 spectrum    1 weight  0.11000E+01 volume  0.27627E-03 ppm1      1.404 ppm2      0.715 CV     1
 ASSI { 2936}
   (( segid "    " and resid 138  and name HB1 ))
   (( segid "    " and resid 132  and name HG11))
      4.400     2.400     1.600 peak  2936 spectrum    1 weight  0.10000E+01 volume  0.10224E-02 ppm1      1.883 ppm2      1.023 CV     1
 ASSI { 2937}
   (( segid "    " and resid 138  and name HB2 ))
   (( segid "    " and resid 132  and name HG11))
      4.100     2.100     1.900 peak  2937 spectrum    1 weight  0.10000E+01 volume  0.10244E-02 ppm1      1.417 ppm2      1.027 CV     1
 ASSI { 2938}
   (( segid "    " and resid 138  and name HB1 ))
   (  segid "    " and resid 72   and name HG2%)
      4.900     3.100     1.100 peak  2938 spectrum    1 weight  0.11000E+01 volume  0.20489E-03 ppm1      1.867 ppm2      1.168 CV     1
 ASSI { 2939}
   (( segid "    " and resid 138  and name HB2 ))
   (  segid "    " and resid 72   and name HG2%)
      5.200     3.400     0.800 peak  2939 spectrum    1 weight  0.11000E+01 volume  0.37758E-03 ppm1      1.433 ppm2      1.183 CV     1
 ASSI { 2940}
   (( segid "    " and resid 138  and name HB1 ))
   (( segid "    " and resid 139  and name HB2 ))
      6.000     6.000     0.000 peak  2940 spectrum    1 weight  0.11000E+01 volume  0.95806E-04 ppm1      1.855 ppm2      2.654 CV     1
 ASSI { 2943}
   (( segid "    " and resid 138  and name HB1 ))
   (  segid "    " and resid 122  and name HD% )
      6.000     5.300     0.000 peak  2943 spectrum    1 weight  0.10000E+01 volume  0.10998E-03 ppm1      1.878 ppm2      7.096 CV     1
 ASSI { 2945}
   (( segid "    " and resid 138  and name HB2 ))
   (  segid "    " and resid 137  and name HB% )
      2.400     2.400     3.600 peak  2945 spectrum    1 weight  0.11000E+01 volume  0.44906E-03 ppm1      1.416 ppm2      1.454 CV     1
 ASSI { 2946}
   (( segid "    " and resid 138  and name HB2 ))
   (( segid "    " and resid 116  and name HA  ))
      3.400     3.400     2.600 peak  2946 spectrum    1 weight  0.11000E+01 volume  0.64614E-04 ppm1      1.407 ppm2      5.371 CV     1
 ASSI { 2947}
   (( segid "    " and resid 138  and name HB1 ))
   (( segid "    " and resid 116  and name HA  ))
      3.200     3.200     2.800 peak  2947 spectrum    1 weight  0.11000E+01 volume  0.89171E-04 ppm1      1.924 ppm2      5.385 CV     1
 ASSI { 2949}
   (( segid "    " and resid 138  and name HG  ))
   (( segid "    " and resid 132  and name HG11))
      3.700     1.700     1.700 peak  2949 spectrum    1 weight  0.10000E+01 volume  0.15586E-02 ppm1      1.926 ppm2      1.035 CV     1
 ASSI { 2951}
   (( segid "    " and resid 138  and name HG  ))
   (( segid "    " and resid 139  and name HB2 ))
      6.000     5.100     0.000 peak  2951 spectrum    1 weight  0.11000E+01 volume  0.11180E-03 ppm1      1.911 ppm2      2.667 CV     1
 ASSI { 2952}
   (( segid "    " and resid 138  and name HG  ))
   (  segid "    " and resid 122  and name HE% )
      5.400     3.700     0.600 peak  2952 spectrum    1 weight  0.10000E+01 volume  0.15370E-03 ppm1      1.894 ppm2      6.638 CV     1
 ASSI { 2953}
   (( segid "    " and resid 138  and name HG  ))
   (  segid "    " and resid 122  and name HD% )
      6.000     5.000     0.000 peak  2953 spectrum    1 weight  0.10000E+01 volume  0.89856E-04 ppm1      1.909 ppm2      7.126 CV     1
 ASSI { 2958}
   (  segid "    " and resid 116  and name HB% )
   (( segid "    " and resid 115  and name HA  ))
      5.400     3.700     0.600 peak  2958 spectrum    1 weight  0.11000E+01 volume  0.27796E-03 ppm1      1.110 ppm2      5.131 CV     1
 ASSI { 2972}
   (( segid "    " and resid 138  and name HA  ))
   (( segid "    " and resid 117  and name HA  ))
      5.700     4.000     0.300 peak  2972 spectrum    1 weight  0.10000E+01 volume  0.17624E-03 ppm1      5.288 ppm2      4.406 CV     1
 ASSI { 2979}
   (( segid "    " and resid 140  and name HB2 ))
   (( segid "    " and resid 72   and name HA  ))
      4.800     2.900     1.200 peak  2979 spectrum    1 weight  0.11000E+01 volume  0.19932E-03 ppm1      1.320 ppm2      4.904 CV     1
 ASSI { 2980}
   (( segid "    " and resid 140  and name HG  ))
   (( segid "    " and resid 139  and name HA  ))
      5.300     3.400     0.700 peak  2980 spectrum    1 weight  0.11000E+01 volume  0.45810E-03 ppm1      1.656 ppm2      5.089 CV     1
 ASSI { 2987}
   (  segid "    " and resid 140  and name HD2%)
   (( segid "    " and resid 72   and name HA  ))
      5.000     3.100     1.000 peak  2987 spectrum    1 weight  0.11000E+01 volume  0.58276E-03 ppm1      0.710 ppm2      4.903 CV     1
 ASSI { 2988}
   (  segid "    " and resid 140  and name HD2%)
   (( segid "    " and resid 139  and name HA  ))
      2.300     2.300     3.700 peak  2988 spectrum    1 weight  0.11000E+01 volume  0.60035E-03 ppm1      0.714 ppm2      5.093 CV     1
 ASSI { 2999}
   (( segid "    " and resid 150  and name HB1 ))
   (  segid "    " and resid 65   and name HG2%)
      2.700     2.700     3.300 peak  2999 spectrum    1 weight  0.10000E+01 volume  0.25910E-03 ppm1      1.586 ppm2      0.461 CV     1
 OR { 2999}
   (( segid "    " and resid 150  and name HB2 ))
   (  segid "    " and resid 65   and name HG2%)
 ASSI { 3001}
   (( segid "    " and resid 20   and name HB1 ))
   (( segid "    " and resid 19   and name HB2 ))
      2.800     2.800     3.200 peak  3001 spectrum    1 weight  0.10000E+01 volume  0.19140E-03 ppm1      1.590 ppm2      3.047 CV     1
 OR { 3001}
   (( segid "    " and resid 20   and name HB2 ))
   (( segid "    " and resid 19   and name HB2 ))
 ASSI { 3002}
   (( segid "    " and resid 20   and name HB2 ))
   (( segid "    " and resid 20   and name HA  ))
      3.700     1.700     1.700 peak  3002 spectrum    1 weight  0.10000E+01 volume  0.10424E-02 ppm1      1.576 ppm2      4.303 CV     1
 ASSI { 3003}
   (( segid "    " and resid 50   and name HB1 ))
   (( segid "    " and resid 112  and name HA  ))
      5.900     4.400     0.100 peak  3003 spectrum    1 weight  0.10000E+01 volume  0.37145E-03 ppm1      1.569 ppm2      5.192 CV     1
 ASSI { 3005}
   (( segid "    " and resid 150  and name HG  ))
   (  segid "    " and resid 150  and name HD1%)
      2.700     0.900     0.900 peak  3005 spectrum    1 weight  0.11000E+01 volume  0.54540E-02 ppm1      1.553 ppm2      0.859 CV     1
 OR { 3005}
   (( segid "    " and resid 150  and name HG  ))
   (  segid "    " and resid 150  and name HD2%)
 ASSI { 3010}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 47   and name HE2 ))
      5.500     3.700     0.500 peak  3010 spectrum    1 weight  0.11000E+01 volume  0.18751E-03 ppm1      3.988 ppm2      2.575 CV     1
 OR { 3010}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 47   and name HE1 ))
 ASSI { 3011}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 110  and name HG2 ))
      5.400     3.700     0.600 peak  3011 spectrum    1 weight  0.11000E+01 volume  0.10219E-03 ppm1      3.976 ppm2      2.726 CV     1
 OR { 3011}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 110  and name HG1 ))
 ASSI { 3014}
   (( segid "    " and resid 49   and name HB  ))
   (( segid "    " and resid 50   and name HG  ))
      6.000     6.000     0.000 peak  3014 spectrum    1 weight  0.11000E+01 volume  0.13338E-03 ppm1      3.835 ppm2      1.543 CV     1
 ASSI { 3015}
   (( segid "    " and resid 49   and name HB  ))
   (( segid "    " and resid 52   and name HB2 ))
      6.000     6.000     0.000 peak  3015 spectrum    1 weight  0.11000E+01 volume  0.72771E-04 ppm1      3.817 ppm2      1.943 CV     1
 ASSI { 3017}
   (( segid "    " and resid 49   and name HB  ))
   (( segid "    " and resid 48   and name HA  ))
      5.700     4.100     0.300 peak  3017 spectrum    1 weight  0.11000E+01 volume  0.38083E-03 ppm1      3.825 ppm2      4.656 CV     1
 ASSI { 3019}
   (( segid "    " and resid 49   and name HB  ))
   (( segid "    " and resid 112  and name HA  ))
      6.000     4.800     0.000 peak  3019 spectrum    1 weight  0.11000E+01 volume  0.16160E-03 ppm1      3.825 ppm2      5.197 CV     1
 ASSI { 3022}
   (  segid "    " and resid 49   and name HG2%)
   (( segid "    " and resid 110  and name HG2 ))
      3.500     1.600     1.600 peak  3022 spectrum    1 weight  0.11000E+01 volume  0.13487E-02 ppm1      1.049 ppm2      2.721 CV     1
 OR { 3022}
   (  segid "    " and resid 49   and name HG2%)
   (( segid "    " and resid 110  and name HG1 ))
 ASSI { 3024}
   (  segid "    " and resid 49   and name HG2%)
   (( segid "    " and resid 52   and name HD2 ))
      5.700     5.700     0.300 peak  3024 spectrum    1 weight  0.11000E+01 volume  0.42924E-03 ppm1      1.045 ppm2      3.635 CV     1
 ASSI { 3025}
   (  segid "    " and resid 49   and name HG2%)
   (( segid "    " and resid 50   and name HG  ))
      5.800     5.800     0.200 peak  3025 spectrum    1 weight  0.11000E+01 volume  0.61510E-03 ppm1      1.036 ppm2      1.564 CV     1
 ASSI { 3027}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 52   and name HB2 ))
      6.000     6.000     0.000 peak  3027 spectrum    1 weight  0.11000E+01 volume  0.18384E-03 ppm1      3.968 ppm2      1.971 CV     1
 ASSI { 3028}
   (( segid "    " and resid 52   and name HG1 ))
   (( segid "    " and resid 49   and name HA  ))
      4.800     4.800     1.200 peak  3028 spectrum    1 weight  0.11000E+01 volume  0.63800E-03 ppm1      1.991 ppm2      3.967 CV     1
 ASSI { 3029}
   (  segid "    " and resid 49   and name HG2%)
   (( segid "    " and resid 51   and name HB  ))
      3.800     3.800     2.200 peak  3029 spectrum    1 weight  0.11000E+01 volume  0.21609E-02 ppm1      1.053 ppm2      2.027 CV     1
 ASSI { 3030}
   (( segid "    " and resid 49   and name HB  ))
   (( segid "    " and resid 51   and name HB  ))
      5.900     5.900     0.100 peak  3030 spectrum    1 weight  0.11000E+01 volume  0.10345E-03 ppm1      3.814 ppm2      2.024 CV     1
 ASSI { 3032}
   (  segid "    " and resid 49   and name HG2%)
   (( segid "    " and resid 52   and name HB2 ))
      4.400     4.400     1.600 peak  3032 spectrum    1 weight  0.11000E+01 volume  0.12453E-02 ppm1      1.047 ppm2      1.972 CV     1
 ASSI { 3033}
   (( segid "    " and resid 47   and name HE2 ))
   (( segid "    " and resid 49   and name HA  ))
      5.200     3.400     0.800 peak  3033 spectrum    1 weight  0.11000E+01 volume  0.42119E-03 ppm1      2.575 ppm2      3.985 CV     1
 ASSI { 3034}
   (( segid "    " and resid 47   and name HE1 ))
   (( segid "    " and resid 49   and name HA  ))
      4.600     4.600     1.400 peak  3034 spectrum    1 weight  0.11000E+01 volume  0.44863E-03 ppm1      2.577 ppm2      4.024 CV     1
 ASSI { 3035}
   (( segid "    " and resid 49   and name HB  ))
   (( segid "    " and resid 47   and name HE2 ))
      6.000     6.000     0.000 peak  3035 spectrum    1 weight  0.11000E+01 volume  0.27254E-04 ppm1      3.821 ppm2      2.582 CV     1
 OR { 3035}
   (( segid "    " and resid 49   and name HB  ))
   (( segid "    " and resid 47   and name HE1 ))
 ASSI { 3038}
   (( segid "    " and resid 49   and name HB  ))
   (( segid "    " and resid 110  and name HG2 ))
      6.000     6.000     0.000 peak  3038 spectrum    1 weight  0.11000E+01 volume  0.36888E-04 ppm1      3.820 ppm2      2.706 CV     1
 OR { 3038}
   (( segid "    " and resid 49   and name HB  ))
   (( segid "    " and resid 110  and name HG1 ))
 ASSI { 3042}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 48   and name HA  ))
      4.800     2.800     1.200 peak  3042 spectrum    1 weight  0.11000E+01 volume  0.49994E-03 ppm1      3.985 ppm2      4.649 CV     1
 ASSI { 3043}
   (( segid "    " and resid 49   and name HB  ))
   (( segid "    " and resid 52   and name HA  ))
      5.100     3.300     0.900 peak  3043 spectrum    1 weight  0.11000E+01 volume  0.21007E-03 ppm1      3.851 ppm2      4.395 CV     1
 ASSI { 3044}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 52   and name HA  ))
      4.900     4.900     1.100 peak  3044 spectrum    1 weight  0.11000E+01 volume  0.25115E-03 ppm1      3.997 ppm2      4.377 CV     1
 ASSI { 3045}
   (( segid "    " and resid 52   and name HB1 ))
   (  segid "    " and resid 49   and name HG2%)
      3.600     1.600     1.600 peak  3045 spectrum    1 weight  0.11000E+01 volume  0.48670E-03 ppm1      2.325 ppm2      1.052 CV     1
 ASSI { 3046}
   (( segid "    " and resid 49   and name HB  ))
   (( segid "    " and resid 52   and name HB1 ))
      5.000     3.100     1.000 peak  3046 spectrum    1 weight  0.11000E+01 volume  0.66905E-04 ppm1      3.814 ppm2      2.320 CV     1
 ASSI { 3047}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 52   and name HB1 ))
      6.000     5.000     0.000 peak  3047 spectrum    1 weight  0.11000E+01 volume  0.90733E-04 ppm1      3.988 ppm2      2.335 CV     1
 ASSI { 3048}
   (  segid "    " and resid 49   and name HG2%)
   (( segid "    " and resid 48   and name HA  ))
      5.200     3.300     0.800 peak  3048 spectrum    1 weight  0.11000E+01 volume  0.50149E-03 ppm1      1.047 ppm2      4.668 CV     1
 ASSI { 3051}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 68   and name HA  ))
      5.200     3.300     0.800 peak  3051 spectrum    1 weight  0.11000E+01 volume  0.19468E-03 ppm1      5.322 ppm2      5.616 CV     1
 ASSI { 3054}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 66   and name HB  ))
      5.400     3.700     0.600 peak  3054 spectrum    1 weight  0.11000E+01 volume  0.10225E-03 ppm1      5.332 ppm2      1.701 CV     1
 ASSI { 3060}
   (( segid "    " and resid 67   and name HB  ))
   (( segid "    " and resid 145  and name HG1 ))
      5.000     3.100     1.000 peak  3060 spectrum    1 weight  0.11000E+01 volume  0.10309E-03 ppm1      3.969 ppm2      1.572 CV     1
 ASSI { 3062}
   (( segid "    " and resid 67   and name HB  ))
   (( segid "    " and resid 68   and name HA  ))
      5.200     3.400     0.800 peak  3062 spectrum    1 weight  0.11000E+01 volume  0.11671E-03 ppm1      4.011 ppm2      5.612 CV     1
 ASSI { 3065}
   (  segid "    " and resid 67   and name HG2%)
   (( segid "    " and resid 85   and name HB1 ))
      3.500     1.500     1.500 peak  3065 spectrum    1 weight  0.11000E+01 volume  0.18459E-02 ppm1      1.062 ppm2      1.967 CV     1
 ASSI { 3071}
   (  segid "    " and resid 67   and name HG2%)
   (( segid "    " and resid 68   and name HA  ))
      3.400     3.400     2.600 peak  3071 spectrum    1 weight  0.11000E+01 volume  0.39098E-02 ppm1      1.049 ppm2      5.617 CV     1
 ASSI { 3074}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 79   and name HA  ))
      5.000     3.100     1.000 peak  3074 spectrum    1 weight  0.10000E+01 volume  0.31097E-03 ppm1      4.922 ppm2      4.544 CV     1
 ASSI { 3077}
   (( segid "    " and resid 78   and name HB  ))
   (  segid "    " and resid 80   and name HG1%)
      4.400     4.400     1.600 peak  3077 spectrum    1 weight  0.11000E+01 volume  0.47981E-03 ppm1      4.034 ppm2      0.915 CV     1
 ASSI { 3078}
   (( segid "    " and resid 72   and name HB  ))
   (( segid "    " and resid 71   and name HB2 ))
      4.900     3.000     1.100 peak  3078 spectrum    1 weight  0.11000E+01 volume  0.50946E-03 ppm1      4.017 ppm2      2.077 CV     1
 ASSI { 3079}
   (( segid "    " and resid 72   and name HB  ))
   (( segid "    " and resid 71   and name HB1 ))
      5.700     5.700     0.300 peak  3079 spectrum    1 weight  0.11000E+01 volume  0.25925E-03 ppm1      4.029 ppm2      2.175 CV     1
 ASSI { 3082}
   (( segid "    " and resid 72   and name HB  ))
   (( segid "    " and resid 71   and name HA  ))
      5.700     4.000     0.300 peak  3082 spectrum    1 weight  0.11000E+01 volume  0.21426E-03 ppm1      4.014 ppm2      5.047 CV     1
 ASSI { 3087}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 72   and name HB  ))
      4.200     2.200     1.800 peak  3087 spectrum    1 weight  0.11000E+01 volume  0.13196E-02 ppm1      2.116 ppm2      3.990 CV     1
 OR { 3087}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 72   and name HB  ))
 ASSI { 3088}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 70   and name HB2 ))
      6.000     6.000     0.000 peak  3088 spectrum    1 weight  0.11000E+01 volume  0.28428E-03 ppm1      2.105 ppm2      1.202 CV     1
 ASSI { 3090}
   (( segid "    " and resid 78   and name HA  ))
   (  segid "    " and resid 80   and name HG1%)
      4.600     2.600     1.400 peak  3090 spectrum    1 weight  0.11000E+01 volume  0.66916E-03 ppm1      4.063 ppm2      0.985 CV     1
 ASSI { 3093}
   (( segid "    " and resid 78   and name HA  ))
   (( segid "    " and resid 73   and name HA  ))
      6.000     5.200     0.000 peak  3093 spectrum    1 weight  0.11000E+01 volume  0.96790E-04 ppm1      4.058 ppm2      5.542 CV     1
 ASSI { 3099}
   (( segid "    " and resid 78   and name HB  ))
   (( segid "    " and resid 74   and name HB2 ))
      3.500     1.500     1.500 peak  3099 spectrum    1 weight  0.11000E+01 volume  0.47559E-03 ppm1      4.065 ppm2      1.920 CV     1
 ASSI { 3104}
   (  segid "    " and resid 78   and name HG2%)
   (  segid "    " and resid 74   and name HD2%)
      3.500     3.500     2.500 peak  3104 spectrum    1 weight  0.11000E+01 volume  0.40594E-02 ppm1      1.253 ppm2      0.856 CV     1
 ASSI { 3105}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 74   and name HG  ))
      4.500     2.500     1.500 peak  3105 spectrum    1 weight  0.11000E+01 volume  0.49404E-03 ppm1      1.239 ppm2      1.731 CV     1
 ASSI { 3106}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 74   and name HB2 ))
      4.700     2.800     1.300 peak  3106 spectrum    1 weight  0.11000E+01 volume  0.67725E-03 ppm1      1.235 ppm2      1.924 CV     1
 ASSI { 3107}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 74   and name HB1 ))
      5.100     5.100     0.900 peak  3107 spectrum    1 weight  0.11000E+01 volume  0.96030E-03 ppm1      1.253 ppm2      2.022 CV     1
 ASSI { 3108}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 74   and name HA  ))
      4.700     4.700     1.300 peak  3108 spectrum    1 weight  0.11000E+01 volume  0.13251E-02 ppm1      1.238 ppm2      4.760 CV     1
 ASSI { 3110}
   (( segid "    " and resid 78   and name HA  ))
   (  segid "    " and resid 74   and name HD2%)
      5.800     4.200     0.200 peak  3110 spectrum    1 weight  0.11000E+01 volume  0.20874E-03 ppm1      4.060 ppm2      0.845 CV     1
 ASSI { 3113}
   (( segid "    " and resid 78   and name HA  ))
   (( segid "    " and resid 74   and name HB2 ))
      4.800     2.900     1.200 peak  3113 spectrum    1 weight  0.11000E+01 volume  0.39800E-03 ppm1      4.054 ppm2      1.901 CV     1
 ASSI { 3114}
   (( segid "    " and resid 78   and name HB  ))
   (( segid "    " and resid 74   and name HB1 ))
      4.300     2.300     1.700 peak  3114 spectrum    1 weight  0.11000E+01 volume  0.84938E-03 ppm1      4.059 ppm2      2.008 CV     1
 ASSI { 3116}
   (( segid "    " and resid 78   and name HB  ))
   (( segid "    " and resid 73   and name HA  ))
      5.900     5.900     0.100 peak  3116 spectrum    1 weight  0.11000E+01 volume  0.13498E-03 ppm1      4.086 ppm2      5.514 CV     1
 ASSI { 3118}
   (( segid "    " and resid 78   and name HB  ))
   (( segid "    " and resid 74   and name HA  ))
      4.500     2.500     1.500 peak  3118 spectrum    1 weight  0.11000E+01 volume  0.13089E-02 ppm1      4.083 ppm2      4.746 CV     1
 ASSI { 3121}
   (( segid "    " and resid 89   and name HA  ))
   (( segid "    " and resid 63   and name HA1 ))
      4.200     2.200     1.800 peak  3121 spectrum    1 weight  0.10000E+01 volume  0.18399E-02 ppm1      4.590 ppm2      4.432 CV     1
 ASSI { 3125}
   (( segid "    " and resid 89   and name HB  ))
   (( segid "    " and resid 94   and name HA  ))
      5.800     4.200     0.200 peak  3125 spectrum    1 weight  0.10000E+01 volume  0.28698E-03 ppm1      4.139 ppm2      4.671 CV     1
 ASSI { 3127}
   (( segid "    " and resid 89   and name HB  ))
   (( segid "    " and resid 88   and name HA  ))
      6.000     4.800     0.000 peak  3127 spectrum    1 weight  0.10000E+01 volume  0.21545E-03 ppm1      4.141 ppm2      4.954 CV     1
 ASSI { 3132}
   (( segid "    " and resid 111  and name HA  ))
   (  segid "    " and resid 143  and name HG2%)
      3.600     1.600     1.600 peak  3132 spectrum    1 weight  0.11000E+01 volume  0.16548E-02 ppm1      5.618 ppm2      1.044 CV     1
 ASSI { 3139}
   (( segid "    " and resid 111  and name HB  ))
   (  segid "    " and resid 143  and name HG2%)
      4.100     2.100     1.900 peak  3139 spectrum    1 weight  0.11000E+01 volume  0.68048E-03 ppm1      3.786 ppm2      1.063 CV     1
 ASSI { 3141}
   (( segid "    " and resid 111  and name HB  ))
   (  segid "    " and resid 112  and name HB% )
      5.400     5.400     0.600 peak  3141 spectrum    1 weight  0.11000E+01 volume  0.26192E-03 ppm1      3.777 ppm2      1.553 CV     1
 ASSI { 3142}
   (( segid "    " and resid 111  and name HB  ))
   (  segid "    " and resid 106  and name HE% )
      6.000     6.000     0.000 peak  3142 spectrum    1 weight  0.11000E+01 volume  0.13758E-03 ppm1      3.778 ppm2      1.982 CV     1
 ASSI { 3143}
   (( segid "    " and resid 111  and name HB  ))
   (( segid "    " and resid 51   and name HB  ))
      3.300     1.300     1.300 peak  3143 spectrum    1 weight  0.11000E+01 volume  0.15535E-02 ppm1      3.777 ppm2      2.073 CV     1
 ASSI { 3146}
   (( segid "    " and resid 111  and name HB  ))
   (( segid "    " and resid 110  and name HA  ))
      5.700     4.000     0.300 peak  3146 spectrum    1 weight  0.10000E+01 volume  0.16125E-03 ppm1      3.788 ppm2      4.663 CV     1
 ASSI { 3150}
   (  segid "    " and resid 111  and name HG2%)
   (( segid "    " and resid 141  and name HG1 ))
      2.900     1.000     1.000 peak  3150 spectrum    1 weight  0.11000E+01 volume  0.18957E-02 ppm1      1.193 ppm2      2.046 CV     1
 ASSI { 3152}
   (( segid "    " and resid 111  and name HB  ))
   (  segid "    " and resid 50   and name HD1%)
      4.400     2.400     1.600 peak  3152 spectrum    1 weight  0.11000E+01 volume  0.18094E-03 ppm1      3.775 ppm2      0.843 CV     1
 ASSI { 3153}
   (( segid "    " and resid 143  and name HA  ))
   (  segid "    " and resid 142  and name HG1%)
      2.600     2.600     3.400 peak  3153 spectrum    1 weight  0.11000E+01 volume  0.31262E-03 ppm1      5.618 ppm2      0.856 CV     1
 ASSI { 3154}
   (  segid "    " and resid 112  and name HB% )
   (( segid "    " and resid 111  and name HA  ))
      5.100     3.200     0.900 peak  3154 spectrum    1 weight  0.11000E+01 volume  0.40931E-03 ppm1      1.536 ppm2      5.620 CV     1
 ASSI { 3156}
   (  segid "    " and resid 106  and name HE% )
   (( segid "    " and resid 111  and name HA  ))
      3.600     1.600     1.600 peak  3156 spectrum    1 weight  0.11000E+01 volume  0.15491E-02 ppm1      1.971 ppm2      5.619 CV     1
 ASSI { 3157}
   (  segid "    " and resid 106  and name HE% )
   (  segid "    " and resid 111  and name HG2%)
      6.000     6.000     0.000 peak  3157 spectrum    1 weight  0.11000E+01 volume  0.77224E-04 ppm1      1.978 ppm2      1.185 CV     1
 ASSI { 3159}
   (( segid "    " and resid 115  and name HA  ))
   (  segid "    " and resid 140  and name HD2%)
      5.700     4.000     0.300 peak  3159 spectrum    1 weight  0.10000E+01 volume  0.13026E-03 ppm1      5.140 ppm2      0.705 CV     1
 ASSI { 3160}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 139  and name HB2 ))
      6.000     5.400     0.000 peak  3160 spectrum    1 weight  0.11000E+01 volume  0.92703E-04 ppm1      5.142 ppm2      2.680 CV     1
 ASSI { 3162}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 36   and name HZ3 ))
      6.000     5.000     0.000 peak  3162 spectrum    1 weight  0.11000E+01 volume  0.68575E-04 ppm1      5.136 ppm2      7.021 CV     1
 OR { 3162}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 36   and name HH2 ))
 ASSI { 3163}
   (( segid "    " and resid 115  and name HB  ))
   (( segid "    " and resid 46   and name HB2 ))
      4.900     3.000     1.100 peak  3163 spectrum    1 weight  0.10000E+01 volume  0.12446E-03 ppm1      4.111 ppm2      1.805 CV     1
 OR { 3163}
   (( segid "    " and resid 115  and name HB  ))
   (( segid "    " and resid 46   and name HB1 ))
 ASSI { 3164}
   (( segid "    " and resid 115  and name HB  ))
   (( segid "    " and resid 36   and name HZ3 ))
      5.700     4.100     0.300 peak  3164 spectrum    1 weight  0.10000E+01 volume  0.76710E-04 ppm1      4.113 ppm2      6.939 CV     1
 ASSI { 3165}
   (( segid "    " and resid 115  and name HB  ))
   (( segid "    " and resid 36   and name HZ3 ))
      5.200     3.400     0.800 peak  3165 spectrum    1 weight  0.11000E+01 volume  0.12957E-03 ppm1      4.121 ppm2      7.009 CV     1
 OR { 3165}
   (( segid "    " and resid 115  and name HB  ))
   (( segid "    " and resid 36   and name HH2 ))
 ASSI { 3171}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 140  and name HG  ))
      4.100     4.100     1.900 peak  3171 spectrum    1 weight  0.11000E+01 volume  0.24032E-02 ppm1      1.121 ppm2      1.686 CV     1
 ASSI { 3173}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 113  and name HG2 ))
      5.700     5.700     0.300 peak  3173 spectrum    1 weight  0.11000E+01 volume  0.35006E-03 ppm1      1.119 ppm2      2.529 CV     1
 ASSI { 3176}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 137  and name HA  ))
      3.800     1.800     1.800 peak  3176 spectrum    1 weight  0.10000E+01 volume  0.10008E-02 ppm1      1.119 ppm2      4.665 CV     1
 ASSI { 3181}
   (( segid "    " and resid 115  and name HB  ))
   (( segid "    " and resid 139  and name HB2 ))
      6.000     6.000     0.000 peak  3181 spectrum    1 weight  0.11000E+01 volume  0.66391E-04 ppm1      4.153 ppm2      2.688 CV     1
 ASSI { 3186}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 139  and name HB1 ))
      6.000     6.000     0.000 peak  3186 spectrum    1 weight  0.11000E+01 volume  0.72514E-04 ppm1      5.159 ppm2      2.893 CV     1
 ASSI { 3191}
   (( segid "    " and resid 115  and name HB  ))
   (( segid "    " and resid 113  and name HG2 ))
      6.000     6.000     0.000 peak  3191 spectrum    1 weight  0.11000E+01 volume  0.32992E-04 ppm1      4.138 ppm2      2.524 CV     1
 ASSI { 3198}
   (( segid "    " and resid 143  and name HB  ))
   (( segid "    " and resid 145  and name HG1 ))
      6.000     5.500     0.000 peak  3198 spectrum    1 weight  0.11000E+01 volume  0.89428E-04 ppm1      4.093 ppm2      1.576 CV     1
 ASSI { 3199}
   (( segid "    " and resid 143  and name HB  ))
   (( segid "    " and resid 145  and name HD2 ))
      5.700     4.100     0.300 peak  3199 spectrum    1 weight  0.10000E+01 volume  0.87094E-04 ppm1      4.090 ppm2      1.681 CV     1
 ASSI { 3200}
   (( segid "    " and resid 143  and name HB  ))
   (( segid "    " and resid 142  and name HB  ))
      6.000     4.600     0.000 peak  3200 spectrum    1 weight  0.11000E+01 volume  0.12764E-03 ppm1      4.086 ppm2      1.966 CV     1
 ASSI { 3204}
   (( segid "    " and resid 143  and name HB  ))
   (( segid "    " and resid 145  and name HA  ))
      5.200     3.300     0.800 peak  3204 spectrum    1 weight  0.10000E+01 volume  0.34514E-03 ppm1      4.093 ppm2      4.327 CV     1
 ASSI { 3210}
   (  segid "    " and resid 143  and name HG2%)
   (( segid "    " and resid 69   and name HB1 ))
      4.600     2.700     1.400 peak  3210 spectrum    1 weight  0.11000E+01 volume  0.42459E-03 ppm1      1.042 ppm2      3.191 CV     1
 ASSI { 3213}
   (( segid "    " and resid 143  and name HB  ))
   (( segid "    " and resid 142  and name HA  ))
      6.000     6.000     0.000 peak  3213 spectrum    1 weight  0.11000E+01 volume  0.45217E-04 ppm1      4.063 ppm2      5.062 CV     1
 ASSI { 3215}
   (( segid "    " and resid 69   and name HB2 ))
   (  segid "    " and resid 143  and name HG2%)
      6.000     4.800     0.000 peak  3215 spectrum    1 weight  0.11000E+01 volume  0.26456E-03 ppm1      3.092 ppm2      1.044 CV     1
 ASSI { 3217}
   (( segid "    " and resid 143  and name HA  ))
   (( segid "    " and resid 69   and name HB2 ))
      6.000     6.000     0.000 peak  3217 spectrum    1 weight  0.11000E+01 volume  0.34234E-04 ppm1      5.616 ppm2      3.098 CV     1
 ASSI { 3220}
   (( segid "    " and resid 143  and name HA  ))
   (( segid "    " and resid 69   and name HB1 ))
      6.000     6.000     0.000 peak  3220 spectrum    1 weight  0.11000E+01 volume  0.32135E-04 ppm1      5.635 ppm2      3.204 CV     1
 ASSI { 3223}
   (( segid "    " and resid 143  and name HA  ))
   (( segid "    " and resid 142  and name HB  ))
      3.700     1.700     1.700 peak  3223 spectrum    1 weight  0.11000E+01 volume  0.80883E-03 ppm1      5.623 ppm2      1.972 CV     1
 ASSI { 3227}
   (( segid "    " and resid 143  and name HA  ))
   (( segid "    " and resid 145  and name HG1 ))
      6.000     5.300     0.000 peak  3227 spectrum    1 weight  0.11000E+01 volume  0.15032E-03 ppm1      5.614 ppm2      1.547 CV     1
 ASSI { 3228}
   (( segid "    " and resid 145  and name HG1 ))
   (( segid "    " and resid 68   and name HA  ))
      4.300     2.300     1.700 peak  3228 spectrum    1 weight  0.11000E+01 volume  0.38593E-03 ppm1      1.588 ppm2      5.610 CV     1
 ASSI { 3229}
   (( segid "    " and resid 145  and name HD2 ))
   (( segid "    " and resid 67   and name HB  ))
      5.200     3.400     0.800 peak  3229 spectrum    1 weight  0.11000E+01 volume  0.46754E-03 ppm1      1.700 ppm2      4.019 CV     1
 ASSI { 3230}
   (( segid "    " and resid 143  and name HA  ))
   (( segid "    " and resid 144  and name HA  ))
      4.800     2.900     1.200 peak  3230 spectrum    1 weight  0.11000E+01 volume  0.41164E-03 ppm1      5.617 ppm2      4.646 CV     1
 ASSI { 3231}
   (( segid "    " and resid 143  and name HB  ))
   (( segid "    " and resid 144  and name HA  ))
      4.900     3.000     1.100 peak  3231 spectrum    1 weight  0.11000E+01 volume  0.29235E-03 ppm1      4.088 ppm2      4.666 CV     1
 ASSI { 3232}
   (  segid "    " and resid 143  and name HG2%)
   (( segid "    " and resid 144  and name HA  ))
      3.800     3.800     2.200 peak  3232 spectrum    1 weight  0.11000E+01 volume  0.11612E-02 ppm1      1.056 ppm2      4.692 CV     1
 ASSI { 3233}
   (( segid "    " and resid 146  and name HA  ))
   (  segid "    " and resid 108  and name HG1%)
      4.700     2.800     1.300 peak  3233 spectrum    1 weight  0.11000E+01 volume  0.17862E-03 ppm1      4.513 ppm2      0.928 CV     1
 ASSI { 3236}
   (( segid "    " and resid 146  and name HA  ))
   (( segid "    " and resid 147  and name HA  ))
      5.300     3.600     0.700 peak  3236 spectrum    1 weight  0.11000E+01 volume  0.20735E-03 ppm1      4.521 ppm2      5.007 CV     1
 ASSI { 3247}
   (( segid "    " and resid 146  and name HB  ))
   (  segid "    " and resid 108  and name HG2%)
      4.300     4.300     1.700 peak  3247 spectrum    1 weight  0.11000E+01 volume  0.65845E-03 ppm1      4.060 ppm2      0.854 CV     1
 ASSI { 3248}
   (( segid "    " and resid 146  and name HB  ))
   (( segid "    " and resid 66   and name HB  ))
      6.000     5.600     0.000 peak  3248 spectrum    1 weight  0.11000E+01 volume  0.61445E-04 ppm1      4.057 ppm2      1.708 CV     1
 ASSI { 3251}
   (( segid "    " and resid 146  and name HB  ))
   (( segid "    " and resid 147  and name HA  ))
      4.600     2.600     1.400 peak  3251 spectrum    1 weight  0.11000E+01 volume  0.29269E-03 ppm1      4.057 ppm2      5.009 CV     1
 ASSI { 3253}
   (( segid "    " and resid 146  and name HB  ))
   (( segid "    " and resid 67   and name HA  ))
      5.800     4.200     0.200 peak  3253 spectrum    1 weight  0.10000E+01 volume  0.12473E-03 ppm1      4.068 ppm2      5.296 CV     1
 ASSI { 3259}
   (  segid "    " and resid 146  and name HG2%)
   (  segid "    " and resid 108  and name HG2%)
      3.300     3.300     2.700 peak  3259 spectrum    1 weight  0.11000E+01 volume  0.49930E-02 ppm1      1.119 ppm2      0.846 CV     1
 ASSI { 3261}
   (  segid "    " and resid 146  and name HG2%)
   (( segid "    " and resid 145  and name HB1 ))
      2.000     2.000     4.000 peak  3261 spectrum    1 weight  0.11000E+01 volume  0.12763E-02 ppm1      1.111 ppm2      1.886 CV     1
 ASSI { 3266}
   (( segid "    " and resid 146  and name HB  ))
   (( segid "    " and resid 145  and name HG2 ))
      3.300     3.300     2.700 peak  3266 spectrum    1 weight  0.11000E+01 volume  0.72150E-04 ppm1      4.068 ppm2      1.434 CV     1
 ASSI { 3268}
   (( segid "    " and resid 146  and name HA  ))
   (( segid "    " and resid 144  and name HA  ))
      2.700     2.700     3.300 peak  3268 spectrum    1 weight  0.11000E+01 volume  0.21575E-03 ppm1      4.500 ppm2      4.684 CV     1
 ASSI { 3270}
   (  segid "    " and resid 146  and name HG2%)
   (( segid "    " and resid 66   and name HA  ))
      3.700     3.700     2.300 peak  3270 spectrum    1 weight  0.11000E+01 volume  0.21366E-02 ppm1      1.121 ppm2      5.131 CV     1
 ASSI { 3274}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 117  and name HB2 ))
      6.000     5.900     0.000 peak  3274 spectrum    1 weight  0.10000E+01 volume  0.76988E-04 ppm1      5.337 ppm2      2.479 CV     1
 ASSI { 3276}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 117  and name HA  ))
      5.300     3.500     0.700 peak  3276 spectrum    1 weight  0.11000E+01 volume  0.18496E-03 ppm1      5.352 ppm2      4.471 CV     1
 ASSI { 3277}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 137  and name HA  ))
      4.600     2.600     1.400 peak  3277 spectrum    1 weight  0.10000E+01 volume  0.56654E-03 ppm1      5.354 ppm2      4.639 CV     1
 ASSI { 3281}
   (  segid "    " and resid 116  and name HB% )
   (( segid "    " and resid 98   and name HA  ))
      5.100     3.300     0.900 peak  3281 spectrum    1 weight  0.11000E+01 volume  0.31845E-03 ppm1      1.121 ppm2      3.844 CV     1
 ASSI { 3282}
   (  segid "    " and resid 116  and name HB% )
   (( segid "    " and resid 137  and name HA  ))
      4.500     2.600     1.500 peak  3282 spectrum    1 weight  0.10000E+01 volume  0.23617E-03 ppm1      1.123 ppm2      4.666 CV     1
 ASSI { 3283}
   (  segid "    " and resid 138  and name HD1%)
   (( segid "    " and resid 74   and name HA  ))
      3.400     1.500     1.500 peak  3283 spectrum    1 weight  0.10000E+01 volume  0.75175E-03 ppm1      1.110 ppm2      4.763 CV     1
 ASSI { 3284}
   (  segid "    " and resid 116  and name HB% )
   (( segid "    " and resid 117  and name HA  ))
      5.600     5.600     0.400 peak  3284 spectrum    1 weight  0.11000E+01 volume  0.12826E-03 ppm1      1.138 ppm2      4.471 CV     1
 ASSI { 3288}
   (( segid "    " and resid 112  and name HA  ))
   (  segid "    " and resid 50   and name HD1%)
      4.800     2.900     1.200 peak  3288 spectrum    1 weight  0.11000E+01 volume  0.21560E-03 ppm1      5.190 ppm2      0.835 CV     1
 ASSI { 3290}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 50   and name HA  ))
      6.000     4.900     0.000 peak  3290 spectrum    1 weight  0.10000E+01 volume  0.17310E-03 ppm1      5.201 ppm2      4.453 CV     1
 ASSI { 3291}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 48   and name HA  ))
      4.700     2.700     1.300 peak  3291 spectrum    1 weight  0.10000E+01 volume  0.38013E-03 ppm1      5.188 ppm2      4.638 CV     1
 ASSI { 3294}
   (  segid "    " and resid 112  and name HB% )
   (  segid "    " and resid 50   and name HD2%)
      5.800     5.800     0.200 peak  3294 spectrum    1 weight  0.11000E+01 volume  0.43969E-03 ppm1      1.543 ppm2      0.759 CV     1
 ASSI { 3295}
   (  segid "    " and resid 112  and name HB% )
   (  segid "    " and resid 142  and name HG2%)
      2.900     2.900     3.100 peak  3295 spectrum    1 weight  0.11000E+01 volume  0.27304E-02 ppm1      1.535 ppm2      0.884 CV     1
 ASSI { 3296}
   (  segid "    " and resid 112  and name HB% )
   (  segid "    " and resid 49   and name HG2%)
      3.800     1.800     1.800 peak  3296 spectrum    1 weight  0.11000E+01 volume  0.96105E-03 ppm1      1.538 ppm2      1.044 CV     1
 ASSI { 3297}
   (  segid "    " and resid 112  and name HB% )
   (( segid "    " and resid 47   and name HD1 ))
      5.100     3.200     0.900 peak  3297 spectrum    1 weight  0.11000E+01 volume  0.43928E-03 ppm1      1.528 ppm2      1.783 CV     1
 ASSI { 3299}
   (  segid "    " and resid 112  and name HB% )
   (( segid "    " and resid 106  and name HG1 ))
      5.200     3.400     0.800 peak  3299 spectrum    1 weight  0.10000E+01 volume  0.13918E-03 ppm1      1.530 ppm2      2.273 CV     1
 ASSI { 3306}
   (  segid "    " and resid 112  and name HB% )
   (( segid "    " and resid 113  and name HA  ))
      5.000     3.100     1.000 peak  3306 spectrum    1 weight  0.11000E+01 volume  0.19112E-03 ppm1      1.538 ppm2      5.534 CV     1
 ASSI { 3311}
   (  segid "    " and resid 112  and name HB% )
   (  segid "    " and resid 111  and name HG2%)
      5.300     5.300     0.700 peak  3311 spectrum    1 weight  0.11000E+01 volume  0.39062E-03 ppm1      1.544 ppm2      1.195 CV     1
 ASSI { 3312}
   (  segid "    " and resid 106  and name HE% )
   (  segid "    " and resid 112  and name HB% )
      2.900     2.900     3.100 peak  3312 spectrum    1 weight  0.11000E+01 volume  0.25413E-02 ppm1      1.972 ppm2      1.539 CV     1
 ASSI { 3313}
   (  segid "    " and resid 106  and name HE% )
   (( segid "    " and resid 112  and name HA  ))
      5.300     3.500     0.700 peak  3313 spectrum    1 weight  0.11000E+01 volume  0.27299E-03 ppm1      1.972 ppm2      5.196 CV     1
 ASSI { 3314}
   (( segid "    " and resid 100  and name HB1 ))
   (( segid "    " and resid 99   and name HB1 ))
      4.200     2.300     1.800 peak  3314 spectrum    1 weight  0.10000E+01 volume  0.77777E-03 ppm1      2.584 ppm2      1.533 CV     1
 ASSI { 3315}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 47   and name HE2 ))
      6.000     6.000     0.000 peak  3315 spectrum    1 weight  0.11000E+01 volume  0.49584E-04 ppm1      5.178 ppm2      2.575 CV     1
 OR { 3315}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 47   and name HE1 ))
 ASSI { 3317}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 110  and name HG2 ))
      6.000     4.600     0.000 peak  3317 spectrum    1 weight  0.11000E+01 volume  0.55258E-04 ppm1      5.213 ppm2      2.729 CV     1
 OR { 3317}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 110  and name HG1 ))
 ASSI { 3324}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 120  and name HA  ))
      5.100     3.200     0.900 peak  3324 spectrum    1 weight  0.10000E+01 volume  0.41841E-03 ppm1      3.853 ppm2      4.739 CV     1
 ASSI { 3327}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 45   and name HA  ))
      6.000     6.000     0.000 peak  3327 spectrum    1 weight  0.10000E+01 volume  0.72599E-04 ppm1      3.830 ppm2      5.248 CV     1
 ASSI { 3328}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 116  and name HA  ))
      6.000     5.800     0.000 peak  3328 spectrum    1 weight  0.10000E+01 volume  0.11792E-03 ppm1      3.838 ppm2      5.370 CV     1
 ASSI { 3329}
   (( segid "    " and resid 98   and name HA  ))
   (  segid "    " and resid 120  and name HD% )
      5.000     3.100     1.000 peak  3329 spectrum    1 weight  0.11000E+01 volume  0.18181E-03 ppm1      3.840 ppm2      6.940 CV     1
 ASSI { 3332}
   (  segid "    " and resid 98   and name HB% )
   (  segid "    " and resid 101  and name HD1%)
      3.500     3.500     2.500 peak  3332 spectrum    1 weight  0.11000E+01 volume  0.33701E-02 ppm1      1.137 ppm2      0.710 CV     1
 ASSI { 3333}
   (  segid "    " and resid 98   and name HB% )
   (  segid "    " and resid 45   and name HD1%)
      2.600     2.600     3.400 peak  3333 spectrum    1 weight  0.11000E+01 volume  0.44593E-02 ppm1      1.131 ppm2      0.776 CV     1
 ASSI { 3334}
   (  segid "    " and resid 98   and name HB% )
   (( segid "    " and resid 45   and name HG  ))
      3.900     1.900     1.900 peak  3334 spectrum    1 weight  0.11000E+01 volume  0.21635E-02 ppm1      1.131 ppm2      1.273 CV     1
 ASSI { 3337}
   (  segid "    " and resid 98   and name HB% )
   (( segid "    " and resid 45   and name HA  ))
      5.500     3.800     0.500 peak  3337 spectrum    1 weight  0.10000E+01 volume  0.24105E-03 ppm1      1.128 ppm2      5.221 CV     1
 ASSI { 3338}
   (  segid "    " and resid 98   and name HB% )
   (  segid "    " and resid 120  and name HD% )
      5.100     3.200     0.900 peak  3338 spectrum    1 weight  0.11000E+01 volume  0.41588E-03 ppm1      1.129 ppm2      6.938 CV     1
 ASSI { 3341}
   (  segid "    " and resid 99   and name HD2%)
   (  segid "    " and resid 98   and name HB% )
      4.000     4.000     2.000 peak  3341 spectrum    1 weight  0.11000E+01 volume  0.23333E-02 ppm1      0.779 ppm2      1.119 CV     1
 ASSI { 3344}
   (( segid "    " and resid 97   and name HB1 ))
   (( segid "    " and resid 98   and name HA  ))
      4.800     2.900     1.200 peak  3344 spectrum    1 weight  0.11000E+01 volume  0.18324E-03 ppm1      2.267 ppm2      3.844 CV     1
 OR { 3344}
   (( segid "    " and resid 97   and name HB2 ))
   (( segid "    " and resid 98   and name HA  ))
 ASSI { 3345}
   (  segid "    " and resid 98   and name HB% )
   (( segid "    " and resid 97   and name HB1 ))
      4.800     4.800     1.200 peak  3345 spectrum    1 weight  0.11000E+01 volume  0.57127E-03 ppm1      1.099 ppm2      2.235 CV     1
 OR { 3345}
   (  segid "    " and resid 98   and name HB% )
   (( segid "    " and resid 97   and name HB2 ))
 ASSI { 3346}
   (( segid "    " and resid 136  and name HA  ))
   (( segid "    " and resid 75   and name HB1 ))
      6.000     4.600     0.000 peak  3346 spectrum    1 weight  0.10000E+01 volume  0.14218E-03 ppm1      4.414 ppm2      2.027 CV     1
 OR { 3346}
   (( segid "    " and resid 136  and name HA  ))
   (( segid "    " and resid 75   and name HB2 ))
 ASSI { 3351}
   (  segid "    " and resid 136  and name HB% )
   (  segid "    " and resid 132  and name HG2%)
      2.600     2.600     3.400 peak  3351 spectrum    1 weight  0.11000E+01 volume  0.44844E-02 ppm1      1.271 ppm2      0.935 CV     1
 ASSI { 3352}
   (  segid "    " and resid 136  and name HB% )
   (( segid "    " and resid 138  and name HB1 ))
      3.800     1.800     1.800 peak  3352 spectrum    1 weight  0.10000E+01 volume  0.10295E-02 ppm1      1.269 ppm2      1.894 CV     1
 OR { 3352}
   (  segid "    " and resid 136  and name HB% )
   (( segid "    " and resid 138  and name HG  ))
 ASSI { 3353}
   (  segid "    " and resid 136  and name HB% )
   (( segid "    " and resid 75   and name HB1 ))
      3.500     1.500     1.500 peak  3353 spectrum    1 weight  0.10000E+01 volume  0.17524E-02 ppm1      1.269 ppm2      2.021 CV     1
 OR { 3353}
   (  segid "    " and resid 136  and name HB% )
   (( segid "    " and resid 75   and name HB2 ))
 ASSI { 3356}
   (  segid "    " and resid 136  and name HB% )
   (( segid "    " and resid 118  and name HB1 ))
      6.000     5.100     0.000 peak  3356 spectrum    1 weight  0.10000E+01 volume  0.84953E-04 ppm1      1.270 ppm2      3.601 CV     1
 ASSI { 3360}
   (( segid "    " and resid 137  and name HA  ))
   (( segid "    " and resid 117  and name HB1 ))
      6.000     5.800     0.000 peak  3360 spectrum    1 weight  0.10000E+01 volume  0.62088E-04 ppm1      4.636 ppm2      2.974 CV     1
 ASSI { 3361}
   (( segid "    " and resid 137  and name HA  ))
   (( segid "    " and resid 118  and name HB2 ))
      6.000     4.700     0.000 peak  3361 spectrum    1 weight  0.10000E+01 volume  0.63500E-04 ppm1      4.626 ppm2      3.506 CV     1
 ASSI { 3362}
   (( segid "    " and resid 147  and name HA  ))
   (  segid "    " and resid 66   and name HG1%)
      3.200     1.300     1.300 peak  3362 spectrum    1 weight  0.11000E+01 volume  0.74484E-03 ppm1      5.016 ppm2      0.679 CV     1
 ASSI { 3364}
   (( segid "    " and resid 147  and name HA  ))
   (( segid "    " and resid 66   and name HB  ))
      5.000     3.100     1.000 peak  3364 spectrum    1 weight  0.11000E+01 volume  0.19876E-03 ppm1      5.035 ppm2      1.698 CV     1
 ASSI { 3366}
   (( segid "    " and resid 147  and name HA  ))
   (( segid "    " and resid 65   and name HA  ))
      5.900     4.400     0.100 peak  3366 spectrum    1 weight  0.10000E+01 volume  0.14698E-03 ppm1      5.014 ppm2      4.239 CV     1
 ASSI { 3367}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 69   and name HE1 ))
      6.000     4.600     0.000 peak  3367 spectrum    1 weight  0.10000E+01 volume  0.61959E-04 ppm1      5.033 ppm2      7.783 CV     1
 ASSI { 3370}
   (( segid "    " and resid 147  and name HA  ))
   (  segid "    " and resid 66   and name HG2%)
      3.200     3.200     2.800 peak  3370 spectrum    1 weight  0.11000E+01 volume  0.94222E-04 ppm1      5.018 ppm2      0.022 CV     1
 ASSI { 3371}
   (  segid "    " and resid 147  and name HB% )
   (  segid "    " and resid 66   and name HG2%)
      2.400     2.400     3.600 peak  3371 spectrum    1 weight  0.11000E+01 volume  0.45660E-03 ppm1      1.127 ppm2      0.026 CV     1
 ASSI { 3372}
   (  segid "    " and resid 147  and name HB% )
   (  segid "    " and resid 144  and name HD2%)
      3.500     3.500     2.500 peak  3372 spectrum    1 weight  0.11000E+01 volume  0.19206E-02 ppm1      1.132 ppm2      0.780 CV     1
 ASSI { 3379}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 33   and name HG2 ))
      5.200     3.400     0.800 peak  3379 spectrum    1 weight  0.10000E+01 volume  0.37927E-03 ppm1      4.590 ppm2      2.028 CV     1
 OR { 3379}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 33   and name HB2 ))
 ASSI { 3382}
   (( segid "    " and resid 28   and name HA  ))
   (( segid "    " and resid 29   and name HD1 ))
      3.000     3.000     3.000 peak  3382 spectrum    1 weight  0.11000E+01 volume  0.13540E-02 ppm1      4.591 ppm2      3.641 CV     1
 ASSI { 3383}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 31   and name HD1 ))
      1.900     1.900     4.100 peak  3383 spectrum    1 weight  0.11000E+01 volume  0.19155E-02 ppm1      4.600 ppm2      3.812 CV     1
 ASSI { 3386}
   (  segid "    " and resid 28   and name HB% )
   (( segid "    " and resid 29   and name HD1 ))
      4.000     4.000     2.000 peak  3386 spectrum    1 weight  0.11000E+01 volume  0.26549E-02 ppm1      1.366 ppm2      3.641 CV     1
 ASSI { 3400}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 46   and name HA  ))
      6.000     5.500     0.000 peak  3400 spectrum    1 weight  0.11000E+01 volume  0.13280E-03 ppm1      3.474 ppm2      5.941 CV     1
 ASSI { 3402}
   (( segid "    " and resid 39   and name HB  ))
   (  segid "    " and resid 40   and name HD2%)
      5.000     3.200     1.000 peak  3402 spectrum    1 weight  0.11000E+01 volume  0.20855E-03 ppm1      1.647 ppm2      0.585 CV     1
 ASSI { 3403}
   (( segid "    " and resid 39   and name HB  ))
   (( segid "    " and resid 45   and name HG  ))
      3.200     3.200     2.800 peak  3403 spectrum    1 weight  0.11000E+01 volume  0.51188E-03 ppm1      1.636 ppm2      1.282 CV     1
 ASSI { 3407}
   (( segid "    " and resid 39   and name HB  ))
   (( segid "    " and resid 102  and name HB1 ))
      6.000     6.000     0.000 peak  3407 spectrum    1 weight  0.11000E+01 volume  0.77588E-04 ppm1      1.643 ppm2      3.631 CV     1
 ASSI { 3409}
   (( segid "    " and resid 39   and name HB  ))
   (( segid "    " and resid 46   and name HA  ))
      5.200     3.400     0.800 peak  3409 spectrum    1 weight  0.11000E+01 volume  0.14645E-03 ppm1      1.625 ppm2      5.936 CV     1
 ASSI { 3416}
   (( segid "    " and resid 39   and name HG12))
   (( segid "    " and resid 46   and name HG1 ))
      5.600     5.600     0.400 peak  3416 spectrum    1 weight  0.11000E+01 volume  0.97539E-03 ppm1      0.985 ppm2      1.419 CV     1
 ASSI { 3417}
   (( segid "    " and resid 39   and name HG12))
   (( segid "    " and resid 37   and name HG  ))
      4.500     2.500     1.500 peak  3417 spectrum    1 weight  0.11000E+01 volume  0.25037E-03 ppm1      0.998 ppm2      1.500 CV     1
 ASSI { 3418}
   (( segid "    " and resid 39   and name HG12))
   (( segid "    " and resid 37   and name HB1 ))
      4.100     2.200     1.900 peak  3418 spectrum    1 weight  0.11000E+01 volume  0.24139E-03 ppm1      0.990 ppm2      1.947 CV     1
 ASSI { 3419}
   (( segid "    " and resid 39   and name HG12))
   (( segid "    " and resid 102  and name HB1 ))
      6.000     6.000     0.000 peak  3419 spectrum    1 weight  0.11000E+01 volume  0.74356E-04 ppm1      0.986 ppm2      3.609 CV     1
 ASSI { 3420}
   (( segid "    " and resid 39   and name HG12))
   (( segid "    " and resid 46   and name HA  ))
      6.000     5.000     0.000 peak  3420 spectrum    1 weight  0.11000E+01 volume  0.15167E-03 ppm1      0.985 ppm2      5.940 CV     1
 ASSI { 3422}
   (  segid "    " and resid 39   and name HG2%)
   (  segid "    " and resid 40   and name HD2%)
      3.600     1.700     1.700 peak  3422 spectrum    1 weight  0.11000E+01 volume  0.82396E-03 ppm1      0.781 ppm2      0.590 CV     1
 ASSI { 3423}
   (  segid "    " and resid 39   and name HG2%)
   (( segid "    " and resid 45   and name HG  ))
      4.400     2.400     1.600 peak  3423 spectrum    1 weight  0.11000E+01 volume  0.51353E-03 ppm1      0.784 ppm2      1.304 CV     1
 ASSI { 3425}
   (  segid "    " and resid 39   and name HG2%)
   (( segid "    " and resid 37   and name HG  ))
      2.500     2.500     3.500 peak  3425 spectrum    1 weight  0.11000E+01 volume  0.34859E-03 ppm1      0.785 ppm2      1.496 CV     1
 ASSI { 3426}
   (  segid "    " and resid 39   and name HG2%)
   (( segid "    " and resid 102  and name HB1 ))
      6.000     6.000     0.000 peak  3426 spectrum    1 weight  0.11000E+01 volume  0.15143E-03 ppm1      0.788 ppm2      3.634 CV     1
 ASSI { 3427}
   (  segid "    " and resid 39   and name HG2%)
   (( segid "    " and resid 98   and name HA  ))
      6.000     5.100     0.000 peak  3427 spectrum    1 weight  0.10000E+01 volume  0.62559E-04 ppm1      0.795 ppm2      3.819 CV     1
 ASSI { 3428}
   (  segid "    " and resid 39   and name HG2%)
   (( segid "    " and resid 101  and name HA  ))
      5.600     4.000     0.400 peak  3428 spectrum    1 weight  0.10000E+01 volume  0.27811E-03 ppm1      0.803 ppm2      4.268 CV     1
 ASSI { 3429}
   (  segid "    " and resid 39   and name HG2%)
   (( segid "    " and resid 102  and name HA  ))
      5.500     3.800     0.500 peak  3429 spectrum    1 weight  0.11000E+01 volume  0.24995E-03 ppm1      0.804 ppm2      4.476 CV     1
 ASSI { 3431}
   (  segid "    " and resid 39   and name HG2%)
   (( segid "    " and resid 38   and name HA  ))
      5.200     5.200     0.800 peak  3431 spectrum    1 weight  0.11000E+01 volume  0.67661E-03 ppm1      0.789 ppm2      4.770 CV     1
 ASSI { 3433}
   (  segid "    " and resid 39   and name HG2%)
   (( segid "    " and resid 45   and name HA  ))
      6.000     6.000     0.000 peak  3433 spectrum    1 weight  0.11000E+01 volume  0.23505E-03 ppm1      0.789 ppm2      5.216 CV     1
 ASSI { 3434}
   (  segid "    " and resid 39   and name HG2%)
   (( segid "    " and resid 46   and name HA  ))
      6.000     6.000     0.000 peak  3434 spectrum    1 weight  0.11000E+01 volume  0.12401E-03 ppm1      0.792 ppm2      5.942 CV     1
 ASSI { 3435}
   (  segid "    " and resid 39   and name HD1%)
   (  segid "    " and resid 45   and name HD2%)
      3.500     1.600     1.600 peak  3435 spectrum    1 weight  0.11000E+01 volume  0.14399E-02 ppm1      0.761 ppm2      0.518 CV     1
 ASSI { 3436}
   (  segid "    " and resid 39   and name HD1%)
   (( segid "    " and resid 37   and name HG  ))
      2.200     2.200     3.800 peak  3436 spectrum    1 weight  0.11000E+01 volume  0.77710E-03 ppm1      0.765 ppm2      1.492 CV     1
 ASSI { 3437}
   (  segid "    " and resid 39   and name HD1%)
   (( segid "    " and resid 47   and name HE1 ))
      5.700     4.100     0.300 peak  3437 spectrum    1 weight  0.10000E+01 volume  0.21170E-03 ppm1      0.751 ppm2      2.620 CV     1
 OR { 3437}
   (  segid "    " and resid 39   and name HD1%)
   (( segid "    " and resid 47   and name HE2 ))
 ASSI { 3438}
   (  segid "    " and resid 39   and name HD1%)
   (( segid "    " and resid 102  and name HB2 ))
      3.500     1.500     1.500 peak  3438 spectrum    1 weight  0.11000E+01 volume  0.67025E-03 ppm1      0.761 ppm2      3.546 CV     1
 ASSI { 3439}
   (  segid "    " and resid 39   and name HD1%)
   (( segid "    " and resid 102  and name HB1 ))
      3.900     1.900     1.900 peak  3439 spectrum    1 weight  0.11000E+01 volume  0.69296E-03 ppm1      0.764 ppm2      3.622 CV     1
 ASSI { 3442}
   (  segid "    " and resid 39   and name HD1%)
   (( segid "    " and resid 38   and name HA  ))
      5.000     5.000     1.000 peak  3442 spectrum    1 weight  0.11000E+01 volume  0.11356E-02 ppm1      0.759 ppm2      4.770 CV     1
 ASSI { 3443}
   (  segid "    " and resid 39   and name HD1%)
   (( segid "    " and resid 45   and name HA  ))
      5.800     5.800     0.200 peak  3443 spectrum    1 weight  0.11000E+01 volume  0.25886E-03 ppm1      0.775 ppm2      5.220 CV     1
 ASSI { 3444}
   (  segid "    " and resid 39   and name HD1%)
   (( segid "    " and resid 46   and name HA  ))
      4.500     2.600     1.500 peak  3444 spectrum    1 weight  0.11000E+01 volume  0.51741E-03 ppm1      0.758 ppm2      5.940 CV     1
 ASSI { 3447}
   (  segid "    " and resid 39   and name HD1%)
   (  segid "    " and resid 40   and name HD2%)
      6.000     6.000     0.000 peak  3447 spectrum    1 weight  0.11000E+01 volume  0.18545E-03 ppm1      0.741 ppm2      0.584 CV     1
 ASSI { 3448}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 45   and name HG  ))
      6.000     6.000     0.000 peak  3448 spectrum    1 weight  0.11000E+01 volume  0.30402E-04 ppm1      3.451 ppm2      1.282 CV     1
 ASSI { 3451}
   (( segid "    " and resid 39   and name HB  ))
   (( segid "    " and resid 45   and name HA  ))
      6.000     4.800     0.000 peak  3451 spectrum    1 weight  0.11000E+01 volume  0.11538E-03 ppm1      1.612 ppm2      5.221 CV     1
 ASSI { 3453}
   (( segid "    " and resid 39   and name HB  ))
   (( segid "    " and resid 38   and name HA  ))
      6.000     4.800     0.000 peak  3453 spectrum    1 weight  0.11000E+01 volume  0.10247E-03 ppm1      1.632 ppm2      4.773 CV     1
 ASSI { 3455}
   (  segid "    " and resid 96   and name HD1%)
   (( segid "    " and resid 121  and name HA  ))
      3.000     1.100     1.100 peak  3455 spectrum    1 weight  0.11000E+01 volume  0.22217E-02 ppm1      0.752 ppm2      4.466 CV     1
 ASSI { 3456}
   (( segid "    " and resid 39   and name HB  ))
   (( segid "    " and resid 102  and name HA  ))
      6.000     6.000     0.000 peak  3456 spectrum    1 weight  0.10000E+01 volume  0.32029E-04 ppm1      1.659 ppm2      4.463 CV     1
 ASSI { 3460}
   (( segid "    " and resid 96   and name HA  ))
   (( segid "    " and resid 121  and name HA  ))
      5.300     3.500     0.700 peak  3460 spectrum    1 weight  0.11000E+01 volume  0.50554E-03 ppm1      4.015 ppm2      4.454 CV     1
 ASSI { 3462}
   (( segid "    " and resid 96   and name HA  ))
   (( segid "    " and resid 120  and name HA  ))
      4.700     2.700     1.300 peak  3462 spectrum    1 weight  0.10000E+01 volume  0.44863E-03 ppm1      4.018 ppm2      4.746 CV     1
 ASSI { 3463}
   (( segid "    " and resid 96   and name HA  ))
   (  segid "    " and resid 122  and name HD% )
      5.900     4.400     0.100 peak  3463 spectrum    1 weight  0.11000E+01 volume  0.11000E-03 ppm1      4.010 ppm2      7.123 CV     1
 ASSI { 3464}
   (( segid "    " and resid 96   and name HB  ))
   (( segid "    " and resid 121  and name HB2 ))
      5.800     4.300     0.200 peak  3464 spectrum    1 weight  0.11000E+01 volume  0.16813E-03 ppm1      2.086 ppm2      2.650 CV     1
 ASSI { 3472}
   (( segid "    " and resid 96   and name HG12))
   (( segid "    " and resid 100  and name HN  ))
      6.000     5.000     0.000 peak  3472 spectrum    1 weight  0.10000E+01 volume  0.11777E-03 ppm1      1.160 ppm2      7.179 CV     1
 ASSI { 3477}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 95   and name HB  ))
      4.500     2.500     1.500 peak  3477 spectrum    1 weight  0.11000E+01 volume  0.22368E-03 ppm1      0.284 ppm2      1.809 CV     1
 ASSI { 3478}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 121  and name HB2 ))
      5.700     4.100     0.300 peak  3478 spectrum    1 weight  0.11000E+01 volume  0.29673E-03 ppm1      0.287 ppm2      2.649 CV     1
 ASSI { 3479}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 121  and name HA  ))
      3.000     1.100     1.100 peak  3479 spectrum    1 weight  0.11000E+01 volume  0.14498E-02 ppm1      0.278 ppm2      4.462 CV     1
 ASSI { 3486}
   (  segid "    " and resid 96   and name HD1%)
   (( segid "    " and resid 121  and name HB2 ))
      4.800     2.900     1.200 peak  3486 spectrum    1 weight  0.11000E+01 volume  0.29295E-03 ppm1      0.750 ppm2      2.645 CV     1
 ASSI { 3487}
   (  segid "    " and resid 96   and name HD1%)
   (( segid "    " and resid 121  and name HB1 ))
      5.000     3.100     1.000 peak  3487 spectrum    1 weight  0.11000E+01 volume  0.20799E-03 ppm1      0.734 ppm2      3.259 CV     1
 ASSI { 3491}
   (  segid "    " and resid 96   and name HD1%)
   (  segid "    " and resid 122  and name HE% )
      4.100     2.100     1.900 peak  3491 spectrum    1 weight  0.11000E+01 volume  0.70360E-03 ppm1      0.753 ppm2      6.636 CV     1
 ASSI { 3495}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 121  and name HB1 ))
      6.000     4.700     0.000 peak  3495 spectrum    1 weight  0.11000E+01 volume  0.96705E-04 ppm1      0.288 ppm2      3.263 CV     1
 ASSI { 3498}
   (( segid "    " and resid 96   and name HB  ))
   (( segid "    " and resid 121  and name HB1 ))
      6.000     6.000     0.000 peak  3498 spectrum    1 weight  0.11000E+01 volume  0.32714E-04 ppm1      2.095 ppm2      3.272 CV     1
 ASSI { 3502}
   (( segid "    " and resid 96   and name HA  ))
   (  segid "    " and resid 122  and name HE% )
      6.000     4.900     0.000 peak  3502 spectrum    1 weight  0.11000E+01 volume  0.98889E-04 ppm1      4.000 ppm2      6.647 CV     1
 ASSI { 3503}
   (  segid "    " and resid 96   and name HD1%)
   (( segid "    " and resid 95   and name HB  ))
      3.700     1.700     1.700 peak  3503 spectrum    1 weight  0.11000E+01 volume  0.27147E-02 ppm1      0.761 ppm2      1.807 CV     1
 ASSI { 3504}
   (( segid "    " and resid 132  and name HA  ))
   (( segid "    " and resid 80   and name HB  ))
      4.900     3.000     1.100 peak  3504 spectrum    1 weight  0.11000E+01 volume  0.42922E-03 ppm1      4.106 ppm2      2.021 CV     1
 ASSI { 3506}
   (( segid "    " and resid 132  and name HA  ))
   (( segid "    " and resid 130  and name HD2 ))
      3.800     1.800     1.800 peak  3506 spectrum    1 weight  0.11000E+01 volume  0.12439E-02 ppm1      4.108 ppm2      3.391 CV     1
 ASSI { 3508}
   (( segid "    " and resid 132  and name HA  ))
   (  segid "    " and resid 131  and name HE% )
      5.900     4.300     0.100 peak  3508 spectrum    1 weight  0.11000E+01 volume  0.77460E-04 ppm1      4.100 ppm2      6.785 CV     1
 ASSI { 3509}
   (( segid "    " and resid 132  and name HB  ))
   (  segid "    " and resid 136  and name HB% )
      5.900     4.300     0.100 peak  3509 spectrum    1 weight  0.11000E+01 volume  0.13015E-03 ppm1      1.146 ppm2      1.279 CV     1
 ASSI { 3512}
   (( segid "    " and resid 132  and name HB  ))
   (( segid "    " and resid 122  and name HA  ))
      5.700     4.100     0.300 peak  3512 spectrum    1 weight  0.11000E+01 volume  0.12244E-03 ppm1      1.151 ppm2      4.508 CV     1
 ASSI { 3517}
   (( segid "    " and resid 132  and name HG12))
   (( segid "    " and resid 127  and name HB1 ))
      4.500     2.500     1.500 peak  3517 spectrum    1 weight  0.11000E+01 volume  0.27226E-03 ppm1      0.726 ppm2      3.002 CV     1
 ASSI { 3519}
   (( segid "    " and resid 132  and name HG12))
   (  segid "    " and resid 122  and name HE% )
      6.000     4.600     0.000 peak  3519 spectrum    1 weight  0.11000E+01 volume  0.12105E-03 ppm1      0.728 ppm2      6.637 CV     1
 ASSI { 3521}
   (( segid "    " and resid 132  and name HG12))
   (  segid "    " and resid 122  and name HD% )
      5.600     3.900     0.400 peak  3521 spectrum    1 weight  0.11000E+01 volume  0.97352E-04 ppm1      0.725 ppm2      7.108 CV     1
 ASSI { 3522}
   (  segid "    " and resid 132  and name HG2%)
   (( segid "    " and resid 80   and name HB  ))
      5.000     5.000     1.000 peak  3522 spectrum    1 weight  0.11000E+01 volume  0.58891E-03 ppm1      0.936 ppm2      2.020 CV     1
 ASSI { 3526}
   (  segid "    " and resid 132  and name HG2%)
   (( segid "    " and resid 130  and name HD2 ))
      4.900     4.900     1.100 peak  3526 spectrum    1 weight  0.11000E+01 volume  0.86022E-03 ppm1      0.934 ppm2      3.388 CV     1
 ASSI { 3527}
   (  segid "    " and resid 132  and name HG2%)
   (( segid "    " and resid 126  and name HA2 ))
      4.600     2.700     1.400 peak  3527 spectrum    1 weight  0.11000E+01 volume  0.32177E-03 ppm1      0.932 ppm2      3.508 CV     1
 ASSI { 3528}
   (  segid "    " and resid 132  and name HG2%)
   (( segid "    " and resid 126  and name HA1 ))
      2.800     2.800     3.200 peak  3528 spectrum    1 weight  0.11000E+01 volume  0.19361E-03 ppm1      0.936 ppm2      3.825 CV     1
 ASSI { 3530}
   (  segid "    " and resid 132  and name HG2%)
   (( segid "    " and resid 74   and name HA  ))
      4.300     2.300     1.700 peak  3530 spectrum    1 weight  0.10000E+01 volume  0.52033E-03 ppm1      0.926 ppm2      4.763 CV     1
 ASSI { 3531}
   (  segid "    " and resid 132  and name HG2%)
   (( segid "    " and resid 138  and name HA  ))
      6.000     4.500     0.000 peak  3531 spectrum    1 weight  0.11000E+01 volume  0.99301E-04 ppm1      0.928 ppm2      5.253 CV     1
 ASSI { 3532}
   (  segid "    " and resid 132  and name HG2%)
   (  segid "    " and resid 122  and name HE% )
      5.500     3.800     0.500 peak  3532 spectrum    1 weight  0.11000E+01 volume  0.28168E-03 ppm1      0.936 ppm2      6.635 CV     1
 ASSI { 3535}
   (  segid "    " and resid 132  and name HD1%)
   (( segid "    " and resid 130  and name HG2 ))
      3.400     1.400     1.400 peak  3535 spectrum    1 weight  0.11000E+01 volume  0.56410E-03 ppm1      0.456 ppm2      1.453 CV     1
 ASSI { 3536}
   (  segid "    " and resid 132  and name HD1%)
   (( segid "    " and resid 130  and name HG1 ))
      4.900     3.000     1.100 peak  3536 spectrum    1 weight  0.11000E+01 volume  0.53220E-03 ppm1      0.456 ppm2      1.766 CV     1
 ASSI { 3539}
   (  segid "    " and resid 132  and name HD1%)
   (( segid "    " and resid 130  and name HD2 ))
      4.200     2.200     1.800 peak  3539 spectrum    1 weight  0.11000E+01 volume  0.26736E-03 ppm1      0.459 ppm2      3.389 CV     1
 ASSI { 3540}
   (  segid "    " and resid 132  and name HD1%)
   (( segid "    " and resid 130  and name HD1 ))
      5.400     3.700     0.600 peak  3540 spectrum    1 weight  0.11000E+01 volume  0.16153E-03 ppm1      0.457 ppm2      3.505 CV     1
 ASSI { 3542}
   (  segid "    " and resid 132  and name HD1%)
   (( segid "    " and resid 127  and name HA  ))
      2.900     2.900     3.100 peak  3542 spectrum    1 weight  0.11000E+01 volume  0.15445E-03 ppm1      0.453 ppm2      4.505 CV     1
 ASSI { 3543}
   (  segid "    " and resid 132  and name HD1%)
   (( segid "    " and resid 74   and name HA  ))
      4.100     2.100     1.900 peak  3543 spectrum    1 weight  0.10000E+01 volume  0.10261E-02 ppm1      0.458 ppm2      4.744 CV     1
 ASSI { 3544}
   (  segid "    " and resid 132  and name HD1%)
   (( segid "    " and resid 138  and name HA  ))
      6.000     6.000     0.000 peak  3544 spectrum    1 weight  0.11000E+01 volume  0.15128E-03 ppm1      0.458 ppm2      5.256 CV     1
 ASSI { 3556}
   (( segid "    " and resid 132  and name HA  ))
   (( segid "    " and resid 127  and name HB1 ))
      6.000     5.700     0.000 peak  3556 spectrum    1 weight  0.11000E+01 volume  0.45303E-04 ppm1      4.121 ppm2      3.023 CV     1
 ASSI { 3562}
   (( segid "    " and resid 132  and name HB  ))
   (( segid "    " and resid 126  and name HA1 ))
      3.400     3.400     2.600 peak  3562 spectrum    1 weight  0.11000E+01 volume  0.56521E-04 ppm1      1.151 ppm2      3.827 CV     1
 ASSI { 3564}
   (( segid "    " and resid 132  and name HG11))
   (( segid "    " and resid 130  and name HD1 ))
      5.400     5.400     0.600 peak  3564 spectrum    1 weight  0.11000E+01 volume  0.18297E-03 ppm1      0.963 ppm2      3.470 CV     1
 ASSI { 3565}
   (( segid "    " and resid 126  and name HA2 ))
   (( segid "    " and resid 132  and name HB  ))
      6.000     4.500     0.000 peak  3565 spectrum    1 weight  0.11000E+01 volume  0.55900E-04 ppm1      3.511 ppm2      1.151 CV     1
 ASSI { 3569}
   (( segid "    " and resid 132  and name HB  ))
   (( segid "    " and resid 130  and name HD2 ))
      6.000     6.000     0.000 peak  3569 spectrum    1 weight  0.11000E+01 volume  0.63629E-04 ppm1      1.157 ppm2      3.387 CV     1
 ASSI { 3570}
   (  segid "    " and resid 132  and name HG2%)
   (( segid "    " and resid 74   and name HB2 ))
      2.500     2.500     3.500 peak  3570 spectrum    1 weight  0.11000E+01 volume  0.38843E-03 ppm1      0.911 ppm2      1.896 CV     1
 ASSI { 3574}
   (( segid "    " and resid 132  and name HB  ))
   (  segid "    " and resid 131  and name HE% )
      6.000     5.600     0.000 peak  3574 spectrum    1 weight  0.11000E+01 volume  0.44146E-04 ppm1      1.124 ppm2      6.784 CV     1
 ASSI { 3581}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 46   and name HH12))
      6.000     5.700     0.000 peak  3581 spectrum    1 weight  0.10000E+01 volume  0.92553E-04 ppm1      4.689 ppm2      7.018 CV     1
 OR { 3581}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 46   and name HH11))
 OR { 3581}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 46   and name HH21))
 ASSI { 3583}
   (( segid "    " and resid 36   and name HB1 ))
   (( segid "    " and resid 46   and name HB1 ))
      6.000     4.900     0.000 peak  3583 spectrum    1 weight  0.11000E+01 volume  0.15153E-03 ppm1      3.069 ppm2      1.830 CV     1
 ASSI { 3584}
   (( segid "    " and resid 36   and name HB2 ))
   (( segid "    " and resid 46   and name HB1 ))
      3.700     1.700     1.700 peak  3584 spectrum    1 weight  0.11000E+01 volume  0.29776E-03 ppm1      2.879 ppm2      1.770 CV     1
 OR { 3584}
   (( segid "    " and resid 36   and name HB2 ))
   (( segid "    " and resid 46   and name HB2 ))
 ASSI { 3586}
   (( segid "    " and resid 46   and name HB1 ))
   (( segid "    " and resid 36   and name HB1 ))
      6.000     4.900     0.000 peak  3586 spectrum    1 weight  0.11000E+01 volume  0.20821E-03 ppm1      1.799 ppm2      3.059 CV     1
 OR { 3586}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 36   and name HB1 ))
 ASSI { 3587}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 46   and name HB1 ))
      6.000     6.000     0.000 peak  3587 spectrum    1 weight  0.11000E+01 volume  0.51918E-04 ppm1      4.720 ppm2      1.810 CV     1
 ASSI { 3589}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 36   and name HD1 ))
      5.800     5.800     0.200 peak  3589 spectrum    1 weight  0.11000E+01 volume  0.10283E-03 ppm1      4.298 ppm2      7.278 CV     1
 ASSI { 3597}
   (( segid "    " and resid 88   and name HB2 ))
   (( segid "    " and resid 90   and name HA  ))
      6.000     4.800     0.000 peak  3597 spectrum    1 weight  0.11000E+01 volume  0.10484E-03 ppm1      3.145 ppm2      4.357 CV     1
 OR { 3597}
   (( segid "    " and resid 88   and name HB1 ))
   (( segid "    " and resid 90   and name HA  ))
 ASSI { 3598}
   (( segid "    " and resid 88   and name HB2 ))
   (( segid "    " and resid 89   and name HA  ))
      4.900     3.000     1.100 peak  3598 spectrum    1 weight  0.11000E+01 volume  0.27636E-03 ppm1      3.149 ppm2      4.628 CV     1
 ASSI { 3600}
   (( segid "    " and resid 88   and name HB1 ))
   (( segid "    " and resid 87   and name HN  ))
      3.200     3.200     2.800 peak  3600 spectrum    1 weight  0.10000E+01 volume  0.90434E-04 ppm1      3.131 ppm2      8.370 CV     1
 ASSI { 3606}
   (( segid "    " and resid 120  and name HA  ))
   (( segid "    " and resid 97   and name HB2 ))
      5.400     3.600     0.600 peak  3606 spectrum    1 weight  0.11000E+01 volume  0.11030E-03 ppm1      4.724 ppm2      2.293 CV     1
 OR { 3606}
   (( segid "    " and resid 120  and name HA  ))
   (( segid "    " and resid 97   and name HB1 ))
 ASSI { 3618}
   (( segid "    " and resid 119  and name HE1 ))
   (  segid "    " and resid 120  and name HE% )
      4.900     3.000     1.100 peak  3618 spectrum    1 weight  0.11000E+01 volume  0.76886E-03 ppm1      2.769 ppm2      6.705 CV     1
 OR { 3618}
   (( segid "    " and resid 119  and name HE2 ))
   (  segid "    " and resid 120  and name HE% )
 ASSI { 3622}
   (( segid "    " and resid 122  and name HA  ))
   (( segid "    " and resid 121  and name HB1 ))
      6.000     5.500     0.000 peak  3622 spectrum    1 weight  0.11000E+01 volume  0.65920E-04 ppm1      4.494 ppm2      3.231 CV     1
 ASSI { 3623}
   (( segid "    " and resid 122  and name HA  ))
   (( segid "    " and resid 124  and name HD2 ))
      6.000     4.900     0.000 peak  3623 spectrum    1 weight  0.11000E+01 volume  0.78722E-04 ppm1      4.498 ppm2      3.559 CV     1
 ASSI { 3624}
   (( segid "    " and resid 122  and name HA  ))
   (( segid "    " and resid 124  and name HD1 ))
      6.000     6.000     0.000 peak  3624 spectrum    1 weight  0.11000E+01 volume  0.42883E-04 ppm1      4.505 ppm2      3.876 CV     1
 ASSI { 3631}
   (( segid "    " and resid 122  and name HB1 ))
   (  segid "    " and resid 138  and name HD2%)
      6.000     6.000     0.000 peak  3631 spectrum    1 weight  0.10000E+01 volume  0.15498E-03 ppm1      3.070 ppm2      0.856 CV     1
 ASSI { 3632}
   (( segid "    " and resid 122  and name HB1 ))
   (  segid "    " and resid 132  and name HG2%)
      6.000     6.000     0.000 peak  3632 spectrum    1 weight  0.11000E+01 volume  0.12017E-03 ppm1      3.085 ppm2      0.938 CV     1
 ASSI { 3633}
   (( segid "    " and resid 122  and name HB1 ))
   (( segid "    " and resid 132  and name HB  ))
      6.000     6.000     0.000 peak  3633 spectrum    1 weight  0.11000E+01 volume  0.62259E-04 ppm1      3.080 ppm2      1.188 CV     1
 ASSI { 3635}
   (( segid "    " and resid 122  and name HB1 ))
   (( segid "    " and resid 121  and name HB1 ))
      5.600     3.900     0.400 peak  3635 spectrum    1 weight  0.10000E+01 volume  0.32862E-03 ppm1      3.071 ppm2      3.267 CV     1
 ASSI { 3640}
   (( segid "    " and resid 122  and name HB2 ))
   (  segid "    " and resid 132  and name HG2%)
      6.000     4.400     0.000 peak  3640 spectrum    1 weight  0.11000E+01 volume  0.10621E-03 ppm1      2.730 ppm2      0.930 CV     1
 ASSI { 3641}
   (( segid "    " and resid 122  and name HB2 ))
   (( segid "    " and resid 132  and name HG11))
      4.400     4.400     1.600 peak  3641 spectrum    1 weight  0.11000E+01 volume  0.41171E-03 ppm1      2.716 ppm2      1.050 CV     1
 ASSI { 3642}
   (( segid "    " and resid 122  and name HB2 ))
   (( segid "    " and resid 125  and name HG2 ))
      5.400     3.700     0.600 peak  3642 spectrum    1 weight  0.10000E+01 volume  0.61540E-03 ppm1      2.717 ppm2      2.423 CV     1
 ASSI { 3659}
   (( segid "    " and resid 131  and name HB1 ))
   (  segid "    " and resid 131  and name HE% )
      6.000     6.000     0.000 peak  3659 spectrum    1 weight  0.11000E+01 volume  0.48599E-04 ppm1      2.983 ppm2      6.805 CV     1
 ASSI { 3663}
   (( segid "    " and resid 76   and name HB2 ))
   (  segid "    " and resid 74   and name HD1%)
      6.000     5.600     0.000 peak  3663 spectrum    1 weight  0.10000E+01 volume  0.46737E-04 ppm1      2.857 ppm2      1.164 CV     1
 ASSI { 3667}
   (( segid "    " and resid 131  and name HB2 ))
   (  segid "    " and resid 131  and name HE% )
      6.000     5.600     0.000 peak  3667 spectrum    1 weight  0.11000E+01 volume  0.10287E-03 ppm1      2.860 ppm2      6.799 CV     1
 ASSI { 3673}
   (( segid "    " and resid 131  and name HB2 ))
   (( segid "    " and resid 127  and name HN  ))
      6.000     6.000     0.000 peak  3673 spectrum    1 weight  0.10000E+01 volume  0.81164E-04 ppm1      2.880 ppm2      8.470 CV     1
 ASSI { 3675}
   (  segid "    " and resid 132  and name HG2%)
   (( segid "    " and resid 131  and name HA  ))
      2.800     2.800     3.200 peak  3675 spectrum    1 weight  0.11000E+01 volume  0.20123E-03 ppm1      0.915 ppm2      4.400 CV     1
 ASSI { 3679}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 67   and name HB  ))
      4.900     3.000     1.100 peak  3679 spectrum    1 weight  0.10000E+01 volume  0.83300E-03 ppm1      5.384 ppm2      3.986 CV     1
 ASSI { 3687}
   (( segid "    " and resid 69   and name HB1 ))
   (( segid "    " and resid 145  and name HE2 ))
      4.000     2.000     2.000 peak  3687 spectrum    1 weight  0.10000E+01 volume  0.45930E-03 ppm1      3.172 ppm2      2.995 CV     1
 OR { 3687}
   (( segid "    " and resid 69   and name HB1 ))
   (( segid "    " and resid 145  and name HE1 ))
 ASSI { 3690}
   (( segid "    " and resid 69   and name HB1 ))
   (( segid "    " and resid 84   and name HA  ))
      6.000     4.700     0.000 peak  3690 spectrum    1 weight  0.11000E+01 volume  0.77545E-04 ppm1      3.192 ppm2      4.417 CV     1
 ASSI { 3691}
   (( segid "    " and resid 69   and name HB1 ))
   (( segid "    " and resid 144  and name HA  ))
      6.000     4.500     0.000 peak  3691 spectrum    1 weight  0.10000E+01 volume  0.16695E-03 ppm1      3.194 ppm2      4.646 CV     1
 ASSI { 3694}
   (( segid "    " and resid 69   and name HB1 ))
   (( segid "    " and resid 68   and name HA  ))
      6.000     6.000     0.000 peak  3694 spectrum    1 weight  0.11000E+01 volume  0.10437E-03 ppm1      3.188 ppm2      5.535 CV     1
 ASSI { 3699}
   (( segid "    " and resid 69   and name HB2 ))
   (( segid "    " and resid 145  and name HD1 ))
      5.300     3.500     0.700 peak  3699 spectrum    1 weight  0.11000E+01 volume  0.13719E-03 ppm1      3.090 ppm2      1.781 CV     1
 ASSI { 3702}
   (( segid "    " and resid 69   and name HB2 ))
   (( segid "    " and resid 67   and name HB  ))
      6.000     5.400     0.000 peak  3702 spectrum    1 weight  0.10000E+01 volume  0.13899E-03 ppm1      3.102 ppm2      3.981 CV     1
 ASSI { 3711}
   (( segid "    " and resid 69   and name HB2 ))
   (( segid "    " and resid 84   and name HA  ))
      6.000     5.100     0.000 peak  3711 spectrum    1 weight  0.11000E+01 volume  0.17149E-04 ppm1      3.088 ppm2      4.425 CV     1
 ASSI { 3713}
   (( segid "    " and resid 84   and name HB1 ))
   (( segid "    " and resid 69   and name HD2 ))
      3.500     3.500     2.500 peak  3713 spectrum    1 weight  0.11000E+01 volume  0.46652E-04 ppm1      2.324 ppm2      6.906 CV     1
 ASSI { 3715}
   (( segid "    " and resid 82   and name HG1 ))
   (( segid "    " and resid 69   and name HD2 ))
      5.600     3.900     0.400 peak  3715 spectrum    1 weight  0.11000E+01 volume  0.27366E-03 ppm1      2.214 ppm2      6.924 CV     1
 ASSI { 3716}
   (( segid "    " and resid 83   and name HG2 ))
   (( segid "    " and resid 69   and name HD2 ))
      6.000     4.700     0.000 peak  3716 spectrum    1 weight  0.11000E+01 volume  0.14933E-03 ppm1      2.205 ppm2      6.919 CV     1
 ASSI { 3721}
   (( segid "    " and resid 84   and name HG1 ))
   (( segid "    " and resid 69   and name HE1 ))
      2.500     2.500     3.500 peak  3721 spectrum    1 weight  0.11000E+01 volume  0.42896E-03 ppm1      1.989 ppm2      7.746 CV     1
 OR { 3721}
   (( segid "    " and resid 84   and name HG2 ))
   (( segid "    " and resid 69   and name HE1 ))
 ASSI { 3722}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 69   and name HE1 ))
      6.000     6.000     0.000 peak  3722 spectrum    1 weight  0.11000E+01 volume  0.22711E-03 ppm1      2.125 ppm2      7.782 CV     1
 ASSI { 3728}
   (( segid "    " and resid 64   and name HB2 ))
   (  segid "    " and resid 66   and name HG2%)
      6.000     6.000     0.000 peak  3728 spectrum    1 weight  0.11000E+01 volume  0.56928E-04 ppm1      1.634 ppm2      0.008 CV     1
 ASSI { 3729}
   (( segid "    " and resid 64   and name HB2 ))
   (  segid "    " and resid 66   and name HG1%)
      4.200     2.200     1.800 peak  3729 spectrum    1 weight  0.11000E+01 volume  0.20054E-03 ppm1      1.651 ppm2      0.667 CV     1
 ASSI { 3737}
   (( segid "    " and resid 64   and name HG2 ))
   (( segid "    " and resid 64   and name HB2 ))
      3.800     1.800     1.800 peak  3737 spectrum    1 weight  0.11000E+01 volume  0.32922E-03 ppm1      2.150 ppm2      1.606 CV     1
 ASSI { 3738}
   (( segid "    " and resid 64   and name HB1 ))
   (  segid "    " and resid 147  and name HB% )
      5.100     3.200     0.900 peak  3738 spectrum    1 weight  0.11000E+01 volume  0.16702E-03 ppm1      2.235 ppm2      1.139 CV     1
 ASSI { 3739}
   (( segid "    " and resid 64   and name HG2 ))
   (  segid "    " and resid 66   and name HG2%)
      6.000     6.000     0.000 peak  3739 spectrum    1 weight  0.11000E+01 volume  0.70502E-04 ppm1      2.141 ppm2      0.012 CV     1
 ASSI { 3742}
   (( segid "    " and resid 64   and name HG1 ))
   (  segid "    " and resid 147  and name HB% )
      6.000     4.500     0.000 peak  3742 spectrum    1 weight  0.11000E+01 volume  0.80286E-04 ppm1      2.473 ppm2      1.150 CV     1
 ASSI { 3743}
   (( segid "    " and resid 64   and name HB1 ))
   (( segid "    " and resid 149  and name HA  ))
      4.000     2.000     2.000 peak  3743 spectrum    1 weight  0.11000E+01 volume  0.12623E-03 ppm1      2.185 ppm2      4.859 CV     1
 ASSI { 3744}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 149  and name HA  ))
      6.000     5.500     0.000 peak  3744 spectrum    1 weight  0.11000E+01 volume  0.13358E-03 ppm1      1.639 ppm2      4.843 CV     1
 ASSI { 3746}
   (( segid "    " and resid 149  and name HA  ))
   (( segid "    " and resid 64   and name HG2 ))
      5.800     4.200     0.200 peak  3746 spectrum    1 weight  0.11000E+01 volume  0.18228E-03 ppm1      4.823 ppm2      2.154 CV     1
 ASSI { 3749}
   (( segid "    " and resid 97   and name HA  ))
   (  segid "    " and resid 120  and name HD% )
      6.000     5.200     0.000 peak  3749 spectrum    1 weight  0.11000E+01 volume  0.10645E-03 ppm1      4.031 ppm2      6.939 CV     1
 ASSI { 3758}
   (( segid "    " and resid 97   and name HG1 ))
   (  segid "    " and resid 120  and name HE% )
      6.000     5.000     0.000 peak  3758 spectrum    1 weight  0.11000E+01 volume  0.89128E-04 ppm1      2.656 ppm2      6.708 CV     1
 ASSI { 3764}
   (( segid "    " and resid 97   and name HG2 ))
   (  segid "    " and resid 120  and name HE% )
      5.300     3.500     0.700 peak  3764 spectrum    1 weight  0.11000E+01 volume  0.96602E-04 ppm1      2.471 ppm2      6.715 CV     1
 ASSI { 3768}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 101  and name HG  ))
      5.000     3.200     1.000 peak  3768 spectrum    1 weight  0.11000E+01 volume  0.13831E-03 ppm1      4.030 ppm2      1.807 CV     1
 ASSI { 3773}
   (( segid "    " and resid 125  and name HB1 ))
   (( segid "    " and resid 122  and name HB1 ))
      6.000     5.100     0.000 peak  3773 spectrum    1 weight  0.11000E+01 volume  0.11028E-03 ppm1      2.261 ppm2      3.106 CV     1
 ASSI { 3778}
   (( segid "    " and resid 125  and name HB2 ))
   (  segid "    " and resid 122  and name HD% )
      5.200     5.200     0.800 peak  3778 spectrum    1 weight  0.11000E+01 volume  0.10849E-03 ppm1      2.133 ppm2      7.154 CV     1
 ASSI { 3783}
   (( segid "    " and resid 125  and name HG1 ))
   (( segid "    " and resid 122  and name HA  ))
      4.700     2.800     1.300 peak  3783 spectrum    1 weight  0.11000E+01 volume  0.14605E-03 ppm1      2.565 ppm2      4.529 CV     1
 ASSI { 3786}
   (( segid "    " and resid 125  and name HG2 ))
   (  segid "    " and resid 122  and name HD% )
      6.000     6.000     0.000 peak  3786 spectrum    1 weight  0.11000E+01 volume  0.96237E-04 ppm1      2.425 ppm2      7.151 CV     1
 ASSI { 3788}
   (( segid "    " and resid 130  and name HB1 ))
   (( segid "    " and resid 129  and name HA  ))
      4.500     2.600     1.500 peak  3788 spectrum    1 weight  0.11000E+01 volume  0.49909E-03 ppm1      2.365 ppm2      4.507 CV     1
 ASSI { 3788}
   (( segid "    " and resid 125  and name HG2 ))
   (( segid "    " and resid 122  and name HA  ))
      4.800     4.800     1.200 peak  3788 spectrum    1 weight  0.11000E+01 volume  0.49909E-03 ppm1      2.365 ppm2      4.507 CV     1
 ASSI { 3789}
   (( segid "    " and resid 125  and name HB1 ))
   (( segid "    " and resid 122  and name HA  ))
      6.000     6.000     0.000 peak  3789 spectrum    1 weight  0.11000E+01 volume  0.42134E-04 ppm1      2.278 ppm2      4.523 CV     1
 ASSI { 3790}
   (( segid "    " and resid 125  and name HG1 ))
   (( segid "    " and resid 122  and name HB1 ))
      6.000     5.100     0.000 peak  3790 spectrum    1 weight  0.11000E+01 volume  0.60418E-04 ppm1      2.538 ppm2      3.104 CV     1
 ASSI { 3797}
   (( segid "    " and resid 71   and name HB1 ))
   (  segid "    " and resid 70   and name HD2%)
      4.800     4.800     1.200 peak  3797 spectrum    1 weight  0.11000E+01 volume  0.63897E-03 ppm1      2.112 ppm2      0.806 CV     1
 OR { 3797}
   (( segid "    " and resid 71   and name HB2 ))
   (  segid "    " and resid 70   and name HD2%)
 ASSI { 3801}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 79   and name HD1 ))
      4.200     2.200     1.800 peak  3801 spectrum    1 weight  0.11000E+01 volume  0.22463E-03 ppm1      2.147 ppm2      3.245 CV     1
 ASSI { 3802}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 79   and name HD1 ))
      4.200     2.200     1.800 peak  3802 spectrum    1 weight  0.11000E+01 volume  0.29586E-03 ppm1      2.045 ppm2      3.244 CV     1
 ASSI { 3803}
   (( segid "    " and resid 83   and name HB1 ))
   (( segid "    " and resid 84   and name HD2 ))
      5.100     5.100     0.900 peak  3803 spectrum    1 weight  0.11000E+01 volume  0.44663E-03 ppm1      2.033 ppm2      3.631 CV     1
 ASSI { 3804}
   (( segid "    " and resid 83   and name HB1 ))
   (( segid "    " and resid 84   and name HD1 ))
      5.300     3.600     0.700 peak  3804 spectrum    1 weight  0.11000E+01 volume  0.58516E-03 ppm1      2.032 ppm2      3.793 CV     1
 ASSI { 3806}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 71   and name HE22))
      5.700     5.700     0.300 peak  3806 spectrum    1 weight  0.11000E+01 volume  0.87929E-04 ppm1      2.046 ppm2      6.615 CV     1
 ASSI { 3808}
   (( segid "    " and resid 71   and name HG1 ))
   (( segid "    " and resid 79   and name HD1 ))
      6.000     5.200     0.000 peak  3808 spectrum    1 weight  0.11000E+01 volume  0.15644E-03 ppm1      2.336 ppm2      3.235 CV     1
 ASSI { 3810}
   (( segid "    " and resid 71   and name HG1 ))
   (( segid "    " and resid 70   and name HA  ))
      6.000     4.600     0.000 peak  3810 spectrum    1 weight  0.11000E+01 volume  0.57934E-04 ppm1      2.337 ppm2      5.403 CV     1
 ASSI { 3813}
   (( segid "    " and resid 71   and name HG1 ))
   (( segid "    " and resid 69   and name HE1 ))
      6.000     6.000     0.000 peak  3813 spectrum    1 weight  0.11000E+01 volume  0.10298E-03 ppm1      2.347 ppm2      7.787 CV     1
 ASSI { 3816}
   (( segid "    " and resid 79   and name HD1 ))
   (( segid "    " and resid 71   and name HG2 ))
      4.800     2.900     1.200 peak  3816 spectrum    1 weight  0.11000E+01 volume  0.73229E-03 ppm1      3.241 ppm2      2.198 CV     1
 ASSI { 3820}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 137  and name HA  ))
      4.300     2.300     1.700 peak  3820 spectrum    1 weight  0.10000E+01 volume  0.11975E-02 ppm1      3.983 ppm2      4.664 CV     1
 ASSI { 3822}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 138  and name HA  ))
      4.900     3.000     1.100 peak  3822 spectrum    1 weight  0.10000E+01 volume  0.14957E-03 ppm1      3.987 ppm2      5.247 CV     1
 ASSI { 3823}
   (( segid "    " and resid 75   and name HB2 ))
   (  segid "    " and resid 137  and name HB% )
      3.500     1.500     1.500 peak  3823 spectrum    1 weight  0.11000E+01 volume  0.13677E-02 ppm1      2.042 ppm2      1.460 CV     1
 OR { 3823}
   (( segid "    " and resid 75   and name HB1 ))
   (  segid "    " and resid 137  and name HB% )
 ASSI { 3825}
   (( segid "    " and resid 24   and name HB1 ))
   (( segid "    " and resid 25   and name HD1 ))
      5.500     3.800     0.500 peak  3825 spectrum    1 weight  0.10000E+01 volume  0.30265E-03 ppm1      2.044 ppm2      3.815 CV     1
 ASSI { 3826}
   (( segid "    " and resid 75   and name HB2 ))
   (( segid "    " and resid 76   and name HA  ))
      4.700     2.800     1.300 peak  3826 spectrum    1 weight  0.10000E+01 volume  0.48084E-03 ppm1      2.033 ppm2      4.536 CV     1
 OR { 3826}
   (( segid "    " and resid 75   and name HB1 ))
   (( segid "    " and resid 76   and name HA  ))
 ASSI { 3833}
   (( segid "    " and resid 75   and name HG1 ))
   (( segid "    " and resid 75   and name HB1 ))
      2.000     0.500     0.500 peak  3833 spectrum    1 weight  0.11000E+01 volume  0.28046E-01 ppm1      2.255 ppm2      2.063 CV     1
 OR { 3833}
   (( segid "    " and resid 75   and name HG2 ))
   (( segid "    " and resid 75   and name HB2 ))
 OR { 3833}
   (( segid "    " and resid 75   and name HG2 ))
   (( segid "    " and resid 75   and name HB1 ))
 OR { 3833}
   (( segid "    " and resid 75   and name HG1 ))
   (( segid "    " and resid 75   and name HB2 ))
 ASSI { 3834}
   (( segid "    " and resid 151  and name HG1 ))
   (( segid "    " and resid 64   and name HE22))
      2.700     2.700     3.300 peak  3834 spectrum    1 weight  0.11000E+01 volume  0.23215E-03 ppm1      2.247 ppm2      7.281 CV     1
 ASSI { 3835}
   (( segid "    " and resid 10   and name HG1 ))
   (( segid "    " and resid 11   and name HE21))
      6.000     4.500     0.000 peak  3835 spectrum    1 weight  0.10000E+01 volume  0.69431E-04 ppm1      2.245 ppm2      7.517 CV     1
 OR { 3835}
   (( segid "    " and resid 10   and name HG2 ))
   (( segid "    " and resid 11   and name HE21))
 ASSI { 3837}
   (( segid "    " and resid 75   and name HG2 ))
   (( segid "    " and resid 78   and name HN  ))
      6.000     6.000     0.000 peak  3837 spectrum    1 weight  0.10000E+01 volume  0.70887E-04 ppm1      2.251 ppm2      7.760 CV     1
 OR { 3837}
   (( segid "    " and resid 75   and name HG1 ))
   (( segid "    " and resid 78   and name HN  ))
 ASSI { 3849}
   (( segid "    " and resid 151  and name HG2 ))
   (( segid "    " and resid 92   and name HB1 ))
      3.100     3.100     2.900 peak  3849 spectrum    1 weight  0.10000E+01 volume  0.10968E-03 ppm1      2.067 ppm2      2.873 CV     1
 ASSI { 3851}
   (( segid "    " and resid 82   and name HG2 ))
   (( segid "    " and resid 69   and name HD2 ))
      5.400     3.700     0.600 peak  3851 spectrum    1 weight  0.11000E+01 volume  0.24814E-03 ppm1      2.060 ppm2      6.914 CV     1
 ASSI { 3852}
   (( segid "    " and resid 151  and name HG2 ))
   (( segid "    " and resid 64   and name HE22))
      2.700     2.700     3.300 peak  3852 spectrum    1 weight  0.11000E+01 volume  0.23368E-03 ppm1      2.049 ppm2      7.287 CV     1
 ASSI { 3854}
   (( segid "    " and resid 83   and name HB1 ))
   (( segid "    " and resid 70   and name HG  ))
      5.000     5.000     1.000 peak  3854 spectrum    1 weight  0.11000E+01 volume  0.24582E-03 ppm1      2.112 ppm2      1.496 CV     1
 ASSI { 3858}
   (( segid "    " and resid 147  and name HA  ))
   (( segid "    " and resid 60   and name HD1 ))
      4.300     2.300     1.700 peak  3858 spectrum    1 weight  0.10000E+01 volume  0.12480E-02 ppm1      5.033 ppm2      3.577 CV     1
 ASSI { 3862}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 69   and name HD2 ))
      5.800     4.200     0.200 peak  3862 spectrum    1 weight  0.10000E+01 volume  0.86815E-04 ppm1      5.020 ppm2      6.945 CV     1
 ASSI { 3866}
   (( segid "    " and resid 83   and name HB2 ))
   (  segid "    " and resid 70   and name HD1%)
      5.500     5.500     0.500 peak  3866 spectrum    1 weight  0.11000E+01 volume  0.47274E-03 ppm1      1.918 ppm2      0.941 CV     1
 ASSI { 3870}
   (( segid "    " and resid 106  and name HB1 ))
   (( segid "    " and resid 47   and name HG2 ))
      4.400     2.400     1.600 peak  3870 spectrum    1 weight  0.10000E+01 volume  0.71970E-03 ppm1      2.182 ppm2      1.374 CV     1
 OR { 3870}
   (( segid "    " and resid 106  and name HB1 ))
   (( segid "    " and resid 47   and name HG1 ))
 ASSI { 3873}
   (( segid "    " and resid 84   and name HG1 ))
   (( segid "    " and resid 83   and name HA  ))
      6.000     4.500     0.000 peak  3873 spectrum    1 weight  0.11000E+01 volume  0.41455E-03 ppm1      2.010 ppm2      5.039 CV     1
 OR { 3873}
   (( segid "    " and resid 84   and name HG2 ))
   (( segid "    " and resid 83   and name HA  ))
 ASSI { 3875}
   (( segid "    " and resid 83   and name HB2 ))
   (( segid "    " and resid 70   and name HG  ))
      2.800     2.800     3.200 peak  3875 spectrum    1 weight  0.11000E+01 volume  0.17830E-03 ppm1      1.942 ppm2      1.489 CV     1
 ASSI { 3887}
   (( segid "    " and resid 85   and name HB2 ))
   (  segid "    " and resid 67   and name HG2%)
      5.600     3.900     0.400 peak  3887 spectrum    1 weight  0.11000E+01 volume  0.46930E-03 ppm1      1.746 ppm2      1.069 CV     1
 ASSI { 3891}
   (( segid "    " and resid 85   and name HG1 ))
   (( segid "    " and resid 67   and name HB  ))
      5.500     3.800     0.500 peak  3891 spectrum    1 weight  0.11000E+01 volume  0.40603E-03 ppm1      2.051 ppm2      3.988 CV     1
 ASSI { 3894}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 69   and name HD2 ))
      6.000     5.800     0.000 peak  3894 spectrum    1 weight  0.11000E+01 volume  0.75897E-04 ppm1      4.405 ppm2      6.915 CV     1
 ASSI { 3895}
   (( segid "    " and resid 145  and name HE2 ))
   (( segid "    " and resid 85   and name HG1 ))
      5.200     3.400     0.800 peak  3895 spectrum    1 weight  0.11000E+01 volume  0.19814E-03 ppm1      3.006 ppm2      2.051 CV     1
 OR { 3895}
   (( segid "    " and resid 145  and name HE1 ))
   (( segid "    " and resid 85   and name HG1 ))
 ASSI { 3898}
   (( segid "    " and resid 141  and name HA  ))
   (  segid "    " and resid 142  and name HG1%)
      5.700     4.000     0.300 peak  3898 spectrum    1 weight  0.11000E+01 volume  0.12946E-03 ppm1      5.241 ppm2      0.936 CV     1
 ASSI { 3899}
   (( segid "    " and resid 141  and name HA  ))
   (  segid "    " and resid 113  and name HE% )
      5.500     3.700     0.500 peak  3899 spectrum    1 weight  0.11000E+01 volume  0.26537E-03 ppm1      5.225 ppm2      2.133 CV     1
 ASSI { 3902}
   (( segid "    " and resid 141  and name HA  ))
   (( segid "    " and resid 113  and name HA  ))
      2.400     0.700     0.700 peak  3902 spectrum    1 weight  0.11000E+01 volume  0.13559E-02 ppm1      5.231 ppm2      5.531 CV     1
 ASSI { 3905}
   (( segid "    " and resid 141  and name HB1 ))
   (  segid "    " and resid 111  and name HG2%)
      5.100     3.200     0.900 peak  3905 spectrum    1 weight  0.11000E+01 volume  0.57287E-03 ppm1      2.015 ppm2      1.192 CV     1
 ASSI { 3907}
   (( segid "    " and resid 141  and name HB1 ))
   (( segid "    " and resid 79   and name HH12))
      4.900     3.000     1.100 peak  3907 spectrum    1 weight  0.10000E+01 volume  0.76390E-04 ppm1      2.032 ppm2      6.802 CV     1
 ASSI { 3912}
   (( segid "    " and resid 141  and name HB2 ))
   (( segid "    " and resid 113  and name HA  ))
      4.900     2.900     1.100 peak  3912 spectrum    1 weight  0.11000E+01 volume  0.21168E-03 ppm1      1.963 ppm2      5.520 CV     1
 ASSI { 3920}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 67   and name HA  ))
      6.000     4.600     0.000 peak  3920 spectrum    1 weight  0.10000E+01 volume  0.17417E-03 ppm1      2.062 ppm2      5.333 CV     1
 OR { 3920}
   (( segid "    " and resid 85   and name HG1 ))
   (( segid "    " and resid 67   and name HA  ))
 ASSI { 3921}
   (( segid "    " and resid 141  and name HG1 ))
   (( segid "    " and resid 71   and name HE21))
      6.000     6.000     0.000 peak  3921 spectrum    1 weight  0.11000E+01 volume  0.82106E-04 ppm1      2.044 ppm2      7.412 CV     1
 ASSI { 3922}
   (( segid "    " and resid 141  and name HG2 ))
   (  segid "    " and resid 142  and name HG2%)
      4.500     2.500     1.500 peak  3922 spectrum    1 weight  0.11000E+01 volume  0.98477E-03 ppm1      2.016 ppm2      0.833 CV     1
 OR { 3922}
   (( segid "    " and resid 141  and name HG1 ))
   (  segid "    " and resid 142  and name HG2%)
 ASSI { 3925}
   (( segid "    " and resid 141  and name HG2 ))
   (( segid "    " and resid 113  and name HA  ))
      6.000     5.300     0.000 peak  3925 spectrum    1 weight  0.11000E+01 volume  0.18052E-03 ppm1      1.947 ppm2      5.531 CV     1
 ASSI { 3926}
   (( segid "    " and resid 141  and name HG1 ))
   (( segid "    " and resid 113  and name HA  ))
      5.500     3.800     0.500 peak  3926 spectrum    1 weight  0.11000E+01 volume  0.19254E-03 ppm1      2.009 ppm2      5.530 CV     1
 ASSI { 3928}
   (( segid "    " and resid 141  and name HG2 ))
   (( segid "    " and resid 71   and name HE22))
      4.600     4.600     1.400 peak  3928 spectrum    1 weight  0.11000E+01 volume  0.75426E-04 ppm1      1.959 ppm2      6.708 CV     1
 ASSI { 3930}
   (( segid "    " and resid 141  and name HB1 ))
   (  segid "    " and resid 142  and name HG2%)
      4.500     4.500     1.500 peak  3930 spectrum    1 weight  0.11000E+01 volume  0.18805E-02 ppm1      2.044 ppm2      0.835 CV     1
 ASSI { 3931}
   (( segid "    " and resid 141  and name HB1 ))
   (  segid "    " and resid 142  and name HG1%)
      4.200     4.200     1.800 peak  3931 spectrum    1 weight  0.11000E+01 volume  0.10623E-02 ppm1      2.048 ppm2      0.946 CV     1
 ASSI { 3932}
   (( segid "    " and resid 141  and name HA  ))
   (  segid "    " and resid 111  and name HG2%)
      5.800     4.200     0.200 peak  3932 spectrum    1 weight  0.11000E+01 volume  0.16064E-03 ppm1      5.233 ppm2      1.199 CV     1
 ASSI { 3942}
   (( segid "    " and resid 59   and name HB1 ))
   (( segid "    " and resid 59   and name HA  ))
      3.100     1.200     1.200 peak  3942 spectrum    1 weight  0.10000E+01 volume  0.83514E-03 ppm1      1.940 ppm2      5.213 CV     1
 ASSI { 3945}
   (( segid "    " and resid 75   and name HG2 ))
   (( segid "    " and resid 76   and name HB2 ))
      5.600     3.900     0.400 peak  3945 spectrum    1 weight  0.10000E+01 volume  0.17647E-03 ppm1      2.264 ppm2      2.880 CV     1
 OR { 3945}
   (( segid "    " and resid 75   and name HG1 ))
   (( segid "    " and resid 76   and name HB2 ))
 ASSI { 3947}
   (( segid "    " and resid 75   and name HG2 ))
   (( segid "    " and resid 76   and name HB1 ))
      5.600     4.000     0.400 peak  3947 spectrum    1 weight  0.10000E+01 volume  0.22150E-03 ppm1      2.265 ppm2      3.286 CV     1
 OR { 3947}
   (( segid "    " and resid 75   and name HG1 ))
   (( segid "    " and resid 76   and name HB1 ))
 ASSI { 3955}
   (( segid "    " and resid 42   and name HB1 ))
   (( segid "    " and resid 40   and name HA  ))
      5.500     3.800     0.500 peak  3955 spectrum    1 weight  0.11000E+01 volume  0.18226E-03 ppm1      3.302 ppm2      4.607 CV     1
 ASSI { 3956}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 44   and name HG  ))
      6.000     5.800     0.000 peak  3956 spectrum    1 weight  0.10000E+01 volume  0.69045E-04 ppm1      2.762 ppm2      1.568 CV     1
 ASSI { 3957}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 38   and name HB1 ))
      6.000     6.000     0.000 peak  3957 spectrum    1 weight  0.10000E+01 volume  0.68403E-04 ppm1      2.771 ppm2      2.590 CV     1
 OR { 3957}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 38   and name HB2 ))
 ASSI { 3964}
   (( segid "    " and resid 76   and name HA  ))
   (( segid "    " and resid 75   and name HG1 ))
      5.500     5.500     0.500 peak  3964 spectrum    1 weight  0.11000E+01 volume  0.73092E-04 ppm1      4.565 ppm2      2.207 CV     1
 ASSI { 3971}
   (( segid "    " and resid 75   and name HB2 ))
   (( segid "    " and resid 76   and name HB1 ))
      6.000     4.400     0.000 peak  3971 spectrum    1 weight  0.11000E+01 volume  0.29491E-03 ppm1      2.055 ppm2      3.326 CV     1
 OR { 3971}
   (( segid "    " and resid 75   and name HB1 ))
   (( segid "    " and resid 76   and name HB1 ))
 ASSI { 3974}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 144  and name HB1 ))
      6.000     4.900     0.000 peak  3974 spectrum    1 weight  0.10000E+01 volume  0.62772E-04 ppm1      4.765 ppm2      2.364 CV     1
 ASSI { 3975}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 58   and name HB2 ))
      6.000     6.000     0.000 peak  3975 spectrum    1 weight  0.11000E+01 volume  0.10431E-03 ppm1      4.757 ppm2      3.858 CV     1
 ASSI { 3980}
   (( segid "    " and resid 38   and name HB1 ))
   (( segid "    " and resid 43   and name HA1 ))
      6.000     5.800     0.000 peak  3980 spectrum    1 weight  0.10000E+01 volume  0.80093E-04 ppm1      2.586 ppm2      4.088 CV     1
 OR { 3980}
   (( segid "    " and resid 38   and name HB2 ))
   (( segid "    " and resid 43   and name HA1 ))
 ASSI { 3983}
   (( segid "    " and resid 92   and name HA  ))
   (( segid "    " and resid 89   and name HB  ))
      6.000     6.000     0.000 peak  3983 spectrum    1 weight  0.11000E+01 volume  0.11837E-03 ppm1      4.854 ppm2      4.181 CV     1
 ASSI { 3987}
   (( segid "    " and resid 92   and name HA  ))
   (( segid "    " and resid 94   and name HA  ))
      6.000     4.800     0.000 peak  3987 spectrum    1 weight  0.10000E+01 volume  0.12808E-03 ppm1      4.849 ppm2      4.698 CV     1
 ASSI { 4001}
   (  segid "    " and resid 50   and name HD2%)
   (( segid "    " and resid 113  and name HG1 ))
      6.000     6.000     0.000 peak  4001 spectrum    1 weight  0.11000E+01 volume  0.94222E-04 ppm1      0.758 ppm2      2.672 CV     1
 ASSI { 4003}
   (( segid "    " and resid 110  and name HA  ))
   (( segid "    " and resid 52   and name HA  ))
      5.100     5.100     0.900 peak  4003 spectrum    1 weight  0.11000E+01 volume  0.39674E-03 ppm1      4.668 ppm2      4.451 CV     1
 ASSI { 4010}
   (( segid "    " and resid 94   and name HB1 ))
   (  segid "    " and resid 88   and name HE% )
      6.000     5.400     0.000 peak  4010 spectrum    1 weight  0.11000E+01 volume  0.91483E-04 ppm1      2.818 ppm2      7.177 CV     1
 ASSI { 4012}
   (( segid "    " and resid 94   and name HB1 ))
   (( segid "    " and resid 92   and name HN  ))
      6.000     6.000     0.000 peak  4012 spectrum    1 weight  0.11000E+01 volume  0.79407E-04 ppm1      2.802 ppm2      7.891 CV     1
 ASSI { 4014}
   (( segid "    " and resid 94   and name HB2 ))
   (( segid "    " and resid 93   and name HB2 ))
      5.300     5.300     0.700 peak  4014 spectrum    1 weight  0.11000E+01 volume  0.30896E-03 ppm1      2.698 ppm2      3.266 CV     1
 OR { 4014}
   (( segid "    " and resid 94   and name HB2 ))
   (( segid "    " and resid 93   and name HB1 ))
 ASSI { 4016}
   (( segid "    " and resid 94   and name HB2 ))
   (( segid "    " and resid 92   and name HN  ))
      6.000     6.000     0.000 peak  4016 spectrum    1 weight  0.11000E+01 volume  0.60482E-04 ppm1      2.712 ppm2      7.891 CV     1
 ASSI { 4020}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 99   and name HG  ))
      5.400     5.400     0.600 peak  4020 spectrum    1 weight  0.11000E+01 volume  0.64529E-04 ppm1      4.611 ppm2      1.329 CV     1
 ASSI { 4023}
   (( segid "    " and resid 107  and name HB1 ))
   (( segid "    " and resid 59   and name HG2 ))
      4.300     4.300     1.700 peak  4023 spectrum    1 weight  0.11000E+01 volume  0.19981E-03 ppm1      2.586 ppm2      1.634 CV     1
 ASSI { 4024}
   (( segid "    " and resid 107  and name HB1 ))
   (( segid "    " and resid 53   and name HA2 ))
      6.000     6.000     0.000 peak  4024 spectrum    1 weight  0.11000E+01 volume  0.71122E-04 ppm1      2.576 ppm2      3.426 CV     1
 ASSI { 4025}
   (( segid "    " and resid 100  and name HB1 ))
   (( segid "    " and resid 93   and name HA  ))
      5.400     3.600     0.600 peak  4025 spectrum    1 weight  0.11000E+01 volume  0.19958E-03 ppm1      2.579 ppm2      4.267 CV     1
 ASSI { 4026}
   (( segid "    " and resid 100  and name HB1 ))
   (( segid "    " and resid 95   and name HN  ))
      6.000     6.000     0.000 peak  4026 spectrum    1 weight  0.11000E+01 volume  0.56564E-04 ppm1      2.576 ppm2      6.829 CV     1
 ASSI { 4028}
   (( segid "    " and resid 100  and name HB1 ))
   (( segid "    " and resid 97   and name HE21))
      4.300     4.300     1.700 peak  4028 spectrum    1 weight  0.11000E+01 volume  0.94334E-04 ppm1      2.555 ppm2      7.783 CV     1
 ASSI { 4033}
   (( segid "    " and resid 100  and name HB2 ))
   (( segid "    " and resid 62   and name HE2 ))
      5.900     4.300     0.100 peak  4033 spectrum    1 weight  0.10000E+01 volume  0.10461E-03 ppm1      2.410 ppm2      3.051 CV     1
 OR { 4033}
   (( segid "    " and resid 100  and name HB2 ))
   (( segid "    " and resid 62   and name HE1 ))
 ASSI { 4040}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 101  and name HG  ))
      6.000     4.500     0.000 peak  4040 spectrum    1 weight  0.11000E+01 volume  0.10159E-03 ppm1      4.632 ppm2      1.808 CV     1
 ASSI { 4041}
   (( segid "    " and resid 100  and name HB2 ))
   (( segid "    " and resid 99   and name HG  ))
      5.500     5.500     0.500 peak  4041 spectrum    1 weight  0.11000E+01 volume  0.17650E-03 ppm1      2.377 ppm2      1.313 CV     1
 ASSI { 4043}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 59   and name HG2 ))
      4.200     2.200     1.800 peak  4043 spectrum    1 weight  0.11000E+01 volume  0.14753E-03 ppm1      4.743 ppm2      1.571 CV     1
 ASSI { 4045}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 104  and name HA  ))
      2.600     2.600     3.400 peak  4045 spectrum    1 weight  0.11000E+01 volume  0.27329E-03 ppm1      4.735 ppm2      4.317 CV     1
 ASSI { 4051}
   (( segid "    " and resid 107  and name HB2 ))
   (( segid "    " and resid 53   and name HA2 ))
      6.000     4.500     0.000 peak  4051 spectrum    1 weight  0.11000E+01 volume  0.16481E-03 ppm1      2.292 ppm2      3.437 CV     1
 ASSI { 4059}
   (( segid "    " and resid 57   and name HB2 ))
   (( segid "    " and resid 107  and name HB2 ))
      6.000     4.900     0.000 peak  4059 spectrum    1 weight  0.11000E+01 volume  0.14143E-03 ppm1      3.956 ppm2      2.294 CV     1
 ASSI { 4060}
   (( segid "    " and resid 53   and name HA1 ))
   (( segid "    " and resid 107  and name HB2 ))
      4.600     2.600     1.400 peak  4060 spectrum    1 weight  0.11000E+01 volume  0.11743E-03 ppm1      4.012 ppm2      2.311 CV     1
 ASSI { 4061}
   (( segid "    " and resid 57   and name HB1 ))
   (( segid "    " and resid 107  and name HB1 ))
      4.700     2.800     1.300 peak  4061 spectrum    1 weight  0.11000E+01 volume  0.35495E-03 ppm1      4.042 ppm2      2.567 CV     1
 ASSI { 4064}
   (( segid "    " and resid 53   and name HA1 ))
   (( segid "    " and resid 107  and name HB1 ))
      5.500     3.800     0.500 peak  4064 spectrum    1 weight  0.11000E+01 volume  0.53866E-04 ppm1      4.037 ppm2      2.575 CV     1
 ASSI { 4065}
   (( segid "    " and resid 57   and name HB1 ))
   (( segid "    " and resid 107  and name HA  ))
      4.500     2.600     1.500 peak  4065 spectrum    1 weight  0.11000E+01 volume  0.17732E-02 ppm1      4.053 ppm2      4.750 CV     1
 ASSI { 4068}
   (( segid "    " and resid 53   and name HA1 ))
   (( segid "    " and resid 107  and name HA  ))
      6.000     4.700     0.000 peak  4068 spectrum    1 weight  0.11000E+01 volume  0.12473E-03 ppm1      4.011 ppm2      4.742 CV     1
 ASSI { 4070}
   (( segid "    " and resid 107  and name HB1 ))
   (( segid "    " and resid 59   and name HA  ))
      6.000     5.300     0.000 peak  4070 spectrum    1 weight  0.11000E+01 volume  0.60225E-04 ppm1      2.588 ppm2      5.207 CV     1
 ASSI { 4071}
   (( segid "    " and resid 48   and name HE2 ))
   (( segid "    " and resid 36   and name HH2 ))
      5.600     3.900     0.400 peak  4071 spectrum    1 weight  0.10000E+01 volume  0.93856E-04 ppm1      2.306 ppm2      7.019 CV     1
 ASSI { 4073}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 48   and name HE2 ))
      6.000     5.700     0.000 peak  4073 spectrum    1 weight  0.11000E+01 volume  0.94540E-04 ppm1      4.451 ppm2      2.286 CV     1
 ASSI { 4075}
   (( segid "    " and resid 117  and name HB1 ))
   (( segid "    " and resid 44   and name HG  ))
      6.000     5.500     0.000 peak  4075 spectrum    1 weight  0.11000E+01 volume  0.55579E-04 ppm1      2.981 ppm2      1.574 CV     1
 ASSI { 4076}
   (( segid "    " and resid 117  and name HB1 ))
   (( segid "    " and resid 120  and name HB1 ))
      6.000     6.000     0.000 peak  4076 spectrum    1 weight  0.11000E+01 volume  0.16704E-03 ppm1      2.993 ppm2      3.267 CV     1
 ASSI { 4078}
   (( segid "    " and resid 117  and name HB1 ))
   (( segid "    " and resid 120  and name HA  ))
      6.000     6.000     0.000 peak  4078 spectrum    1 weight  0.11000E+01 volume  0.73521E-04 ppm1      2.968 ppm2      4.771 CV     1
 ASSI { 4082}
   (( segid "    " and resid 117  and name HB2 ))
   (( segid "    " and resid 119  and name HE1 ))
      6.000     5.600     0.000 peak  4082 spectrum    1 weight  0.11000E+01 volume  0.44746E-04 ppm1      2.488 ppm2      2.752 CV     1
 OR { 4082}
   (( segid "    " and resid 117  and name HB2 ))
   (( segid "    " and resid 119  and name HE2 ))
 ASSI { 4086}
   (( segid "    " and resid 117  and name HB2 ))
   (  segid "    " and resid 120  and name HE% )
      5.100     3.300     0.900 peak  4086 spectrum    1 weight  0.11000E+01 volume  0.18551E-03 ppm1      2.475 ppm2      6.703 CV     1
 ASSI { 4087}
   (( segid "    " and resid 117  and name HB2 ))
   (  segid "    " and resid 120  and name HD% )
      3.400     1.400     1.400 peak  4087 spectrum    1 weight  0.11000E+01 volume  0.35698E-03 ppm1      2.477 ppm2      6.936 CV     1
 ASSI { 4091}
   (( segid "    " and resid 117  and name HB2 ))
   (( segid "    " and resid 119  and name HG2 ))
      5.300     3.500     0.700 peak  4091 spectrum    1 weight  0.10000E+01 volume  0.83176E-04 ppm1      2.475 ppm2      0.622 CV     1
 ASSI { 4093}
   (( segid "    " and resid 117  and name HB1 ))
   (( segid "    " and resid 119  and name HE1 ))
      4.200     2.200     1.800 peak  4093 spectrum    1 weight  0.11000E+01 volume  0.12778E-03 ppm1      3.008 ppm2      2.758 CV     1
 OR { 4093}
   (( segid "    " and resid 117  and name HB1 ))
   (( segid "    " and resid 119  and name HE2 ))
 ASSI { 4096}
   (( segid "    " and resid 149  and name HA  ))
   (  segid "    " and resid 150  and name HD2%)
      6.000     6.000     0.000 peak  4096 spectrum    1 weight  0.11000E+01 volume  0.79515E-04 ppm1      4.848 ppm2      0.857 CV     1
 ASSI { 4107}
   (( segid "    " and resid 149  and name HB2 ))
   (( segid "    " and resid 64   and name HA  ))
      6.000     4.600     0.000 peak  4107 spectrum    1 weight  0.11000E+01 volume  0.20391E-03 ppm1      2.495 ppm2      4.470 CV     1
 ASSI { 4109}
   (( segid "    " and resid 149  and name HB2 ))
   (( segid "    " and resid 148  and name HA  ))
      6.000     4.800     0.000 peak  4109 spectrum    1 weight  0.11000E+01 volume  0.27385E-03 ppm1      2.501 ppm2      4.606 CV     1
 ASSI { 4120}
   (( segid "    " and resid 47   and name HB2 ))
   (( segid "    " and resid 102  and name HB1 ))
      5.500     3.800     0.500 peak  4120 spectrum    1 weight  0.10000E+01 volume  0.16646E-03 ppm1      1.784 ppm2      3.608 CV     1
 OR { 4120}
   (( segid "    " and resid 47   and name HB1 ))
   (( segid "    " and resid 102  and name HB1 ))
 ASSI { 4125}
   (( segid "    " and resid 47   and name HD2 ))
   (  segid "    " and resid 39   and name HD1%)
      4.800     2.900     1.200 peak  4125 spectrum    1 weight  0.10000E+01 volume  0.10973E-02 ppm1      1.460 ppm2      0.773 CV     1
 OR { 4125}
   (( segid "    " and resid 47   and name HD2 ))
   (  segid "    " and resid 39   and name HG2%)
 ASSI { 4128}
   (( segid "    " and resid 47   and name HD2 ))
   (( segid "    " and resid 112  and name HA  ))
      5.800     4.200     0.200 peak  4128 spectrum    1 weight  0.10000E+01 volume  0.15742E-03 ppm1      1.454 ppm2      5.196 CV     1
 ASSI { 4130}
   (( segid "    " and resid 47   and name HD2 ))
   (( segid "    " and resid 105  and name HN  ))
      6.000     6.000     0.000 peak  4130 spectrum    1 weight  0.10000E+01 volume  0.45410E-04 ppm1      1.455 ppm2      7.413 CV     1
 ASSI { 4131}
   (( segid "    " and resid 47   and name HD2 ))
   (( segid "    " and resid 107  and name HN  ))
      6.000     6.000     0.000 peak  4131 spectrum    1 weight  0.10000E+01 volume  0.52988E-04 ppm1      1.462 ppm2      7.694 CV     1
 ASSI { 4136}
   (( segid "    " and resid 47   and name HE2 ))
   (( segid "    " and resid 106  and name HB1 ))
      4.300     2.300     1.700 peak  4136 spectrum    1 weight  0.10000E+01 volume  0.78252E-03 ppm1      2.588 ppm2      2.180 CV     1
 OR { 4136}
   (( segid "    " and resid 47   and name HE1 ))
   (( segid "    " and resid 106  and name HB1 ))
 ASSI { 4137}
   (( segid "    " and resid 47   and name HE1 ))
   (( segid "    " and resid 106  and name HN  ))
      6.000     5.400     0.000 peak  4137 spectrum    1 weight  0.10000E+01 volume  0.65856E-04 ppm1      2.580 ppm2      7.861 CV     1
 OR { 4137}
   (( segid "    " and resid 47   and name HE2 ))
   (( segid "    " and resid 106  and name HN  ))
 ASSI { 4143}
   (( segid "    " and resid 57   and name HA  ))
   (  segid "    " and resid 108  and name HG2%)
      6.000     6.000     0.000 peak  4143 spectrum    1 weight  0.11000E+01 volume  0.11539E-03 ppm1      4.345 ppm2      0.853 CV     1
 ASSI { 4148}
   (( segid "    " and resid 57   and name HB1 ))
   (( segid "    " and resid 56   and name HA2 ))
      6.000     4.400     0.000 peak  4148 spectrum    1 weight  0.11000E+01 volume  0.19391E-03 ppm1      4.064 ppm2      3.756 CV     1
 ASSI { 4150}
   (( segid "    " and resid 57   and name HB2 ))
   (  segid "    " and resid 108  and name HG2%)
      6.000     6.000     0.000 peak  4150 spectrum    1 weight  0.11000E+01 volume  0.10109E-03 ppm1      3.970 ppm2      0.832 CV     1
 ASSI { 4161}
   (( segid "    " and resid 56   and name HA2 ))
   (( segid "    " and resid 57   and name HB2 ))
      4.700     2.700     1.300 peak  4161 spectrum    1 weight  0.11000E+01 volume  0.65329E-03 ppm1      3.739 ppm2      3.951 CV     1
 ASSI { 4162}
   (( segid "    " and resid 41   and name HA1 ))
   (( segid "    " and resid 38   and name HB2 ))
      6.000     6.000     0.000 peak  4162 spectrum    1 weight  0.10000E+01 volume  0.82469E-04 ppm1      4.145 ppm2      2.594 CV     1
 OR { 4162}
   (( segid "    " and resid 41   and name HA1 ))
   (( segid "    " and resid 38   and name HB1 ))
 ASSI { 4171}
   (( segid "    " and resid 53   and name HA1 ))
   (( segid "    " and resid 109  and name HA2 ))
      5.700     4.000     0.300 peak  4171 spectrum    1 weight  0.11000E+01 volume  0.38225E-03 ppm1      4.030 ppm2      3.735 CV     1
 ASSI { 4176}
   (( segid "    " and resid 53   and name HA2 ))
   (( segid "    " and resid 109  and name HA2 ))
      5.000     3.100     1.000 peak  4176 spectrum    1 weight  0.11000E+01 volume  0.39832E-03 ppm1      3.428 ppm2      3.745 CV     1
 ASSI { 4178}
   (( segid "    " and resid 53   and name HA2 ))
   (( segid "    " and resid 110  and name HB2 ))
      6.000     4.600     0.000 peak  4178 spectrum    1 weight  0.10000E+01 volume  0.14088E-03 ppm1      3.413 ppm2      1.975 CV     1
 ASSI { 4182}
   (( segid "    " and resid 63   and name HA1 ))
   (  segid "    " and resid 89   and name HG2%)
      6.000     5.000     0.000 peak  4182 spectrum    1 weight  0.11000E+01 volume  0.18686E-03 ppm1      4.439 ppm2      0.981 CV     1
 ASSI { 4183}
   (( segid "    " and resid 63   and name HA2 ))
   (( segid "    " and resid 90   and name HB2 ))
      6.000     6.000     0.000 peak  4183 spectrum    1 weight  0.10000E+01 volume  0.81506E-04 ppm1      3.505 ppm2      1.436 CV     1
 ASSI { 4188}
   (( segid "    " and resid 109  and name HA1 ))
   (( segid "    " and resid 110  and name HA  ))
      4.800     4.800     1.200 peak  4188 spectrum    1 weight  0.11000E+01 volume  0.23073E-03 ppm1      4.408 ppm2      4.671 CV     1
 ASSI { 4190}
   (( segid "    " and resid 63   and name HA1 ))
   (( segid "    " and resid 149  and name HA  ))
      6.000     4.500     0.000 peak  4190 spectrum    1 weight  0.10000E+01 volume  0.17511E-03 ppm1      4.407 ppm2      4.864 CV     1
 ASSI { 4191}
   (( segid "    " and resid 77   and name HA2 ))
   (( segid "    " and resid 76   and name HB2 ))
      6.000     6.000     0.000 peak  4191 spectrum    1 weight  0.11000E+01 volume  0.72279E-04 ppm1      3.758 ppm2      2.899 CV     1
 ASSI { 4192}
   (( segid "    " and resid 77   and name HA2 ))
   (( segid "    " and resid 76   and name HB1 ))
      6.000     6.000     0.000 peak  4192 spectrum    1 weight  0.11000E+01 volume  0.91418E-04 ppm1      3.765 ppm2      3.265 CV     1
 ASSI { 4193}
   (( segid "    " and resid 109  and name HA2 ))
   (( segid "    " and resid 110  and name HA  ))
      4.400     4.400     1.600 peak  4193 spectrum    1 weight  0.11000E+01 volume  0.42664E-03 ppm1      3.760 ppm2      4.663 CV     1
 ASSI { 4199}
   (( segid "    " and resid 91   and name HA1 ))
   (( segid "    " and resid 92   and name HA  ))
      5.300     3.600     0.700 peak  4199 spectrum    1 weight  0.10000E+01 volume  0.11077E-03 ppm1      4.264 ppm2      4.851 CV     1
 ASSI { 4203}
   (( segid "    " and resid 91   and name HA1 ))
   (( segid "    " and resid 97   and name HE21))
      6.000     5.500     0.000 peak  4203 spectrum    1 weight  0.10000E+01 volume  0.67953E-04 ppm1      4.273 ppm2      7.708 CV     1
 ASSI { 4206}
   (( segid "    " and resid 91   and name HA2 ))
   (( segid "    " and resid 62   and name HB2 ))
      6.000     6.000     0.000 peak  4206 spectrum    1 weight  0.10000E+01 volume  0.62109E-04 ppm1      3.934 ppm2      1.725 CV     1
 OR { 4206}
   (( segid "    " and resid 91   and name HA2 ))
   (( segid "    " and resid 62   and name HD1 ))
 ASSI { 4219}
   (( segid "    " and resid 93   and name HA  ))
   (  segid "    " and resid 88   and name HD% )
      6.000     4.700     0.000 peak  4219 spectrum    1 weight  0.10000E+01 volume  0.86259E-04 ppm1      4.274 ppm2      6.960 CV     1
 ASSI { 4220}
   (( segid "    " and resid 93   and name HB1 ))
   (  segid "    " and resid 95   and name HG2%)
      6.000     5.400     0.000 peak  4220 spectrum    1 weight  0.10000E+01 volume  0.10322E-03 ppm1      3.232 ppm2      0.088 CV     1
 OR { 4220}
   (( segid "    " and resid 93   and name HB2 ))
   (  segid "    " and resid 95   and name HG2%)
 ASSI { 4222}
   (( segid "    " and resid 93   and name HB2 ))
   (  segid "    " and resid 95   and name HG1%)
      6.000     6.000     0.000 peak  4222 spectrum    1 weight  0.11000E+01 volume  0.10836E-03 ppm1      3.188 ppm2      0.329 CV     1
 OR { 4222}
   (( segid "    " and resid 93   and name HB1 ))
   (  segid "    " and resid 95   and name HG1%)
 ASSI { 4224}
   (( segid "    " and resid 93   and name HB2 ))
   (( segid "    " and resid 94   and name HA  ))
      4.600     2.700     1.400 peak  4224 spectrum    1 weight  0.11000E+01 volume  0.35878E-03 ppm1      3.201 ppm2      4.637 CV     1
 OR { 4224}
   (( segid "    " and resid 93   and name HB1 ))
   (( segid "    " and resid 94   and name HA  ))
 ASSI { 4225}
   (( segid "    " and resid 121  and name HB1 ))
   (( segid "    " and resid 132  and name HG11))
      5.000     3.200     1.000 peak  4225 spectrum    1 weight  0.10000E+01 volume  0.26679E-03 ppm1      3.250 ppm2      1.026 CV     1
 ASSI { 4228}
   (( segid "    " and resid 121  and name HB2 ))
   (( segid "    " and resid 132  and name HG11))
      5.100     3.200     0.900 peak  4228 spectrum    1 weight  0.10000E+01 volume  0.43303E-03 ppm1      2.642 ppm2      1.024 CV     1
 ASSI { 4235}
   (( segid "    " and resid 139  and name HA  ))
   (  segid "    " and resid 115  and name HG2%)
      3.800     1.800     1.800 peak  4235 spectrum    1 weight  0.11000E+01 volume  0.77935E-03 ppm1      5.085 ppm2      1.124 CV     1
 ASSI { 4236}
   (( segid "    " and resid 139  and name HA  ))
   (( segid "    " and resid 115  and name HB  ))
      5.700     4.100     0.300 peak  4236 spectrum    1 weight  0.11000E+01 volume  0.20159E-03 ppm1      5.087 ppm2      4.116 CV     1
 ASSI { 4238}
   (( segid "    " and resid 139  and name HB1 ))
   (( segid "    " and resid 140  and name HG  ))
      6.000     6.000     0.000 peak  4238 spectrum    1 weight  0.11000E+01 volume  0.57035E-04 ppm1      2.880 ppm2      1.673 CV     1
 ASSI { 4239}
   (( segid "    " and resid 139  and name HB1 ))
   (( segid "    " and resid 73   and name HB1 ))
      3.700     1.700     1.700 peak  4239 spectrum    1 weight  0.11000E+01 volume  0.71759E-03 ppm1      2.888 ppm2      3.725 CV     1
 OR { 4239}
   (( segid "    " and resid 139  and name HB1 ))
   (( segid "    " and resid 73   and name HB2 ))
 ASSI { 4240}
   (( segid "    " and resid 139  and name HB1 ))
   (( segid "    " and resid 75   and name HA  ))
      5.500     3.800     0.500 peak  4240 spectrum    1 weight  0.11000E+01 volume  0.13726E-03 ppm1      2.886 ppm2      3.982 CV     1
 ASSI { 4244}
   (( segid "    " and resid 139  and name HB2 ))
   (( segid "    " and resid 73   and name HB1 ))
      4.300     2.300     1.700 peak  4244 spectrum    1 weight  0.11000E+01 volume  0.63948E-03 ppm1      2.686 ppm2      3.724 CV     1
 OR { 4244}
   (( segid "    " and resid 139  and name HB2 ))
   (( segid "    " and resid 73   and name HB2 ))
 ASSI { 4245}
   (( segid "    " and resid 139  and name HB2 ))
   (( segid "    " and resid 75   and name HA  ))
      4.500     2.500     1.500 peak  4245 spectrum    1 weight  0.11000E+01 volume  0.21155E-03 ppm1      2.668 ppm2      3.983 CV     1
 ASSI { 4253}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 139  and name HA  ))
      6.000     4.700     0.000 peak  4253 spectrum    1 weight  0.11000E+01 volume  0.98908E-04 ppm1      3.734 ppm2      5.095 CV     1
 OR { 4253}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 139  and name HA  ))
 ASSI { 4261}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 59   and name HG1 ))
      6.000     5.500     0.000 peak  4261 spectrum    1 weight  0.10000E+01 volume  0.63800E-04 ppm1      4.765 ppm2      1.784 CV     1
 ASSI { 4262}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 57   and name HA  ))
      5.400     3.600     0.600 peak  4262 spectrum    1 weight  0.11000E+01 volume  0.16492E-03 ppm1      4.770 ppm2      4.373 CV     1
 ASSI { 4266}
   (( segid "    " and resid 58   and name HB1 ))
   (  segid "    " and resid 108  and name HG1%)
      5.900     4.300     0.100 peak  4266 spectrum    1 weight  0.10000E+01 volume  0.11719E-03 ppm1      3.864 ppm2      0.946 CV     1
 ASSI { 4269}
   (( segid "    " and resid 58   and name HB1 ))
   (( segid "    " and resid 59   and name HA  ))
      5.500     3.800     0.500 peak  4269 spectrum    1 weight  0.10000E+01 volume  0.10792E-03 ppm1      3.864 ppm2      5.186 CV     1
 ASSI { 4271}
   (( segid "    " and resid 58   and name HB2 ))
   (  segid "    " and resid 108  and name HG1%)
      5.500     3.700     0.500 peak  4271 spectrum    1 weight  0.10000E+01 volume  0.23071E-03 ppm1      3.805 ppm2      0.955 CV     1
 ASSI { 4272}
   (( segid "    " and resid 58   and name HB2 ))
   (  segid "    " and resid 147  and name HB% )
      6.000     4.500     0.000 peak  4272 spectrum    1 weight  0.10000E+01 volume  0.11867E-03 ppm1      3.807 ppm2      1.132 CV     1
 ASSI { 4273}
   (( segid "    " and resid 58   and name HB2 ))
   (( segid "    " and resid 59   and name HG2 ))
      6.000     6.000     0.000 peak  4273 spectrum    1 weight  0.10000E+01 volume  0.58941E-04 ppm1      3.792 ppm2      1.547 CV     1
 OR { 4273}
   (( segid "    " and resid 58   and name HB2 ))
   (( segid "    " and resid 59   and name HB2 ))
 ASSI { 4289}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 79   and name HB1 ))
      6.000     6.000     0.000 peak  4289 spectrum    1 weight  0.11000E+01 volume  0.10686E-03 ppm1      3.729 ppm2      1.888 CV     1
 OR { 4289}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 79   and name HB2 ))
 OR { 4289}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 79   and name HB2 ))
 OR { 4289}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 79   and name HB1 ))
 ASSI { 4290}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 77   and name HA1 ))
      6.000     4.900     0.000 peak  4290 spectrum    1 weight  0.11000E+01 volume  0.16347E-03 ppm1      3.726 ppm2      4.407 CV     1
 OR { 4290}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 77   and name HA1 ))
 ASSI { 4291}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 79   and name HA  ))
      4.800     2.900     1.200 peak  4291 spectrum    1 weight  0.11000E+01 volume  0.59705E-03 ppm1      3.725 ppm2      4.513 CV     1
 OR { 4291}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 79   and name HA  ))
 ASSI { 4293}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 72   and name HA  ))
      6.000     4.900     0.000 peak  4293 spectrum    1 weight  0.11000E+01 volume  0.12358E-03 ppm1      3.718 ppm2      4.913 CV     1
 OR { 4293}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 72   and name HA  ))
 ASSI { 4295}
   (( segid "    " and resid 79   and name HB1 ))
   (( segid "    " and resid 73   and name HA  ))
      5.600     3.900     0.400 peak  4295 spectrum    1 weight  0.11000E+01 volume  0.28843E-03 ppm1      1.888 ppm2      5.547 CV     1
 OR { 4295}
   (( segid "    " and resid 79   and name HB2 ))
   (( segid "    " and resid 73   and name HA  ))
 ASSI { 4300}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 77   and name HA1 ))
      6.000     6.000     0.000 peak  4300 spectrum    1 weight  0.11000E+01 volume  0.29523E-04 ppm1      5.535 ppm2      4.402 CV     1
 ASSI { 4305}
   (( segid "    " and resid 102  and name HB2 ))
   (( segid "    " and resid 47   and name HA  ))
      6.000     5.300     0.000 peak  4305 spectrum    1 weight  0.10000E+01 volume  0.89641E-04 ppm1      3.582 ppm2      5.964 CV     1
 OR { 4305}
   (( segid "    " and resid 102  and name HB1 ))
   (( segid "    " and resid 47   and name HA  ))
 ASSI { 4309}
   (( segid "    " and resid 102  and name HA  ))
   (  segid "    " and resid 101  and name HD2%)
      6.000     6.000     0.000 peak  4309 spectrum    1 weight  0.11000E+01 volume  0.81484E-04 ppm1      4.446 ppm2      0.517 CV     1
 ASSI { 4313}
   (( segid "    " and resid 118  and name HB1 ))
   (( segid "    " and resid 135  and name HB1 ))
      5.100     3.200     0.900 peak  4313 spectrum    1 weight  0.11000E+01 volume  0.35641E-03 ppm1      3.565 ppm2      3.258 CV     1
 OR { 4313}
   (( segid "    " and resid 118  and name HB1 ))
   (( segid "    " and resid 135  and name HB2 ))
 ASSI { 4316}
   (( segid "    " and resid 118  and name HB2 ))
   (( segid "    " and resid 121  and name HB2 ))
      6.000     5.800     0.000 peak  4316 spectrum    1 weight  0.10000E+01 volume  0.76946E-04 ppm1      3.515 ppm2      2.660 CV     1
 ASSI { 4318}
   (( segid "    " and resid 118  and name HB2 ))
   (( segid "    " and resid 135  and name HN  ))
      6.000     6.000     0.000 peak  4318 spectrum    1 weight  0.10000E+01 volume  0.41642E-04 ppm1      3.519 ppm2      7.648 CV     1
 ASSI { 4322}
   (( segid "    " and resid 127  and name HB1 ))
   (( segid "    " and resid 130  and name HD2 ))
      3.900     1.900     1.900 peak  4322 spectrum    1 weight  0.10000E+01 volume  0.83797E-04 ppm1      2.997 ppm2      3.390 CV     1
 ASSI { 4325}
   (( segid "    " and resid 127  and name HB1 ))
   (  segid "    " and resid 122  and name HD% )
      5.900     4.300     0.100 peak  4325 spectrum    1 weight  0.11000E+01 volume  0.14871E-03 ppm1      3.006 ppm2      7.119 CV     1
 ASSI { 4327}
   (( segid "    " and resid 127  and name HB2 ))
   (( segid "    " and resid 132  and name HG12))
      5.600     3.900     0.400 peak  4327 spectrum    1 weight  0.11000E+01 volume  0.10257E-03 ppm1      2.685 ppm2      0.728 CV     1
 ASSI { 4328}
   (( segid "    " and resid 127  and name HB2 ))
   (( segid "    " and resid 130  and name HG2 ))
      6.000     5.000     0.000 peak  4328 spectrum    1 weight  0.10000E+01 volume  0.17124E-03 ppm1      2.688 ppm2      1.421 CV     1
 ASSI { 4329}
   (( segid "    " and resid 127  and name HB2 ))
   (( segid "    " and resid 130  and name HB1 ))
      6.000     5.800     0.000 peak  4329 spectrum    1 weight  0.10000E+01 volume  0.28625E-03 ppm1      2.678 ppm2      2.340 CV     1
 ASSI { 4331}
   (( segid "    " and resid 127  and name HB2 ))
   (  segid "    " and resid 122  and name HE% )
      5.000     3.100     1.000 peak  4331 spectrum    1 weight  0.11000E+01 volume  0.13826E-03 ppm1      2.688 ppm2      6.641 CV     1
 ASSI { 4332}
   (( segid "    " and resid 127  and name HB2 ))
   (  segid "    " and resid 122  and name HD% )
      4.100     2.100     1.900 peak  4332 spectrum    1 weight  0.11000E+01 volume  0.28188E-03 ppm1      2.691 ppm2      7.113 CV     1
 ASSI { 4334}
   (( segid "    " and resid 127  and name HB1 ))
   (  segid "    " and resid 122  and name HE% )
      6.000     5.700     0.000 peak  4334 spectrum    1 weight  0.11000E+01 volume  0.66883E-04 ppm1      3.021 ppm2      6.646 CV     1
 ASSI { 4338}
   (( segid "    " and resid 113  and name HB1 ))
   (( segid "    " and resid 113  and name HB2 ))
      1.500     1.500     4.500 peak  4338 spectrum    1 weight  0.11000E+01 volume  0.23332E-01 ppm1      1.988 ppm2      1.985 CV     1
 ASSI { 4344}
   (( segid "    " and resid 113  and name HG1 ))
   (( segid "    " and resid 113  and name HG2 ))
      2.200     0.600     0.600 peak  4344 spectrum    1 weight  0.11000E+01 volume  0.40486E-02 ppm1      2.667 ppm2      2.532 CV     1
 ASSI { 4357}
   (  segid "    " and resid 113  and name HE% )
   (( segid "    " and resid 113  and name HA  ))
      4.900     3.000     1.100 peak  4357 spectrum    1 weight  0.11000E+01 volume  0.47741E-03 ppm1      2.145 ppm2      5.529 CV     1
 ASSI { 4361}
   (( segid "    " and resid 113  and name HB2 ))
   (  segid "    " and resid 113  and name HE% )
      3.100     1.200     1.200 peak  4361 spectrum    1 weight  0.11000E+01 volume  0.15533E-02 ppm1      1.913 ppm2      2.152 CV     1
 ASSI { 4362}
   (  segid "    " and resid 113  and name HE% )
   (( segid "    " and resid 113  and name HG2 ))
      4.700     2.700     1.300 peak  4362 spectrum    1 weight  0.11000E+01 volume  0.43631E-03 ppm1      2.156 ppm2      2.526 CV     1
 ASSI { 4363}
   (  segid "    " and resid 113  and name HE% )
   (( segid "    " and resid 113  and name HG1 ))
      3.800     1.800     1.800 peak  4363 spectrum    1 weight  0.11000E+01 volume  0.70037E-03 ppm1      2.145 ppm2      2.672 CV     1
 ASSI { 4367}
   (( segid "    " and resid 113  and name HB2 ))
   (( segid "    " and resid 141  and name HA  ))
      4.500     2.500     1.500 peak  4367 spectrum    1 weight  0.11000E+01 volume  0.27938E-03 ppm1      1.945 ppm2      5.233 CV     1
 ASSI { 4368}
   (( segid "    " and resid 113  and name HG1 ))
   (( segid "    " and resid 141  and name HA  ))
      5.700     4.100     0.300 peak  4368 spectrum    1 weight  0.11000E+01 volume  0.12321E-03 ppm1      2.669 ppm2      5.223 CV     1
 ASSI { 4369}
   (( segid "    " and resid 113  and name HG2 ))
   (( segid "    " and resid 141  and name HA  ))
      6.000     5.700     0.000 peak  4369 spectrum    1 weight  0.11000E+01 volume  0.16967E-03 ppm1      2.524 ppm2      5.226 CV     1
 ASSI { 4374}
   (( segid "    " and resid 113  and name HB1 ))
   (  segid "    " and resid 112  and name HB% )
      4.900     4.900     1.100 peak  4374 spectrum    1 weight  0.11000E+01 volume  0.65551E-03 ppm1      1.963 ppm2      1.541 CV     1
 ASSI { 4377}
   (( segid "    " and resid 113  and name HG2 ))
   (  segid "    " and resid 50   and name HD1%)
      5.300     3.500     0.700 peak  4377 spectrum    1 weight  0.11000E+01 volume  0.37606E-03 ppm1      2.523 ppm2      0.835 CV     1
 ASSI { 4378}
   (( segid "    " and resid 113  and name HG1 ))
   (  segid "    " and resid 50   and name HD1%)
      5.600     3.900     0.400 peak  4378 spectrum    1 weight  0.11000E+01 volume  0.25614E-03 ppm1      2.658 ppm2      0.833 CV     1
 ASSI { 4379}
   (  segid "    " and resid 113  and name HE% )
   (  segid "    " and resid 50   and name HD1%)
      3.600     3.600     2.400 peak  4379 spectrum    1 weight  0.11000E+01 volume  0.17587E-02 ppm1      2.139 ppm2      0.839 CV     1
 ASSI { 4382}
   (( segid "    " and resid 113  and name HA  ))
   (( segid "    " and resid 36   and name HZ3 ))
      6.000     5.100     0.000 peak  4382 spectrum    1 weight  0.11000E+01 volume  0.99255E-04 ppm1      5.548 ppm2      7.025 CV     1
 OR { 4382}
   (( segid "    " and resid 113  and name HA  ))
   (( segid "    " and resid 36   and name HH2 ))
 ASSI { 4385}
   (( segid "    " and resid 113  and name HB2 ))
   (( segid "    " and resid 36   and name HH2 ))
      6.000     5.000     0.000 peak  4385 spectrum    1 weight  0.11000E+01 volume  0.23555E-03 ppm1      1.937 ppm2      7.019 CV     1
 ASSI { 4387}
   (  segid "    " and resid 113  and name HE% )
   (( segid "    " and resid 36   and name HH2 ))
      4.900     3.000     1.100 peak  4387 spectrum    1 weight  0.11000E+01 volume  0.52389E-03 ppm1      2.138 ppm2      7.020 CV     1
 ASSI { 4390}
   (  segid "    " and resid 113  and name HE% )
   (( segid "    " and resid 36   and name HZ2 ))
      5.300     5.300     0.700 peak  4390 spectrum    1 weight  0.11000E+01 volume  0.20448E-03 ppm1      2.147 ppm2      7.456 CV     1
 ASSI { 4391}
   (( segid "    " and resid 113  and name HB1 ))
   (( segid "    " and resid 36   and name HZ2 ))
      6.000     4.600     0.000 peak  4391 spectrum    1 weight  0.11000E+01 volume  0.97989E-04 ppm1      1.990 ppm2      7.450 CV     1
 ASSI { 4392}
   (( segid "    " and resid 113  and name HG1 ))
   (  segid "    " and resid 115  and name HG2%)
      5.100     5.100     0.900 peak  4392 spectrum    1 weight  0.11000E+01 volume  0.54423E-03 ppm1      2.665 ppm2      1.123 CV     1
 ASSI { 4394}
   (  segid "    " and resid 113  and name HE% )
   (  segid "    " and resid 115  and name HG2%)
      5.000     5.000     1.000 peak  4394 spectrum    1 weight  0.11000E+01 volume  0.41884E-03 ppm1      2.142 ppm2      1.121 CV     1
 ASSI { 4400}
   (  segid "    " and resid 113  and name HE% )
   (  segid "    " and resid 50   and name HD2%)
      2.100     2.100     3.900 peak  4400 spectrum    1 weight  0.11000E+01 volume  0.10425E-02 ppm1      2.142 ppm2      0.752 CV     1
 ASSI { 4403}
   (( segid "    " and resid 113  and name HG2 ))
   (  segid "    " and resid 114  and name HG2%)
      5.800     5.800     0.200 peak  4403 spectrum    1 weight  0.11000E+01 volume  0.19161E-03 ppm1      2.507 ppm2      0.928 CV     1
 ASSI { 4404}
   (( segid "    " and resid 113  and name HA  ))
   (  segid "    " and resid 114  and name HG2%)
      5.100     5.100     0.900 peak  4404 spectrum    1 weight  0.11000E+01 volume  0.21953E-03 ppm1      5.509 ppm2      0.937 CV     1
 ASSI { 4405}
   (  segid "    " and resid 113  and name HE% )
   (  segid "    " and resid 114  and name HG2%)
      6.000     6.000     0.000 peak  4405 spectrum    1 weight  0.11000E+01 volume  0.11692E-03 ppm1      2.153 ppm2      0.936 CV     1
 ASSI { 4406}
   (( segid "    " and resid 113  and name HA  ))
   (  segid "    " and resid 111  and name HG2%)
      6.000     5.900     0.000 peak  4406 spectrum    1 weight  0.10000E+01 volume  0.80007E-04 ppm1      5.516 ppm2      1.230 CV     1
 ASSI { 4414}
   (( segid "    " and resid 113  and name HB2 ))
   (( segid "    " and resid 36   and name HZ2 ))
      6.000     6.000     0.000 peak  4414 spectrum    1 weight  0.11000E+01 volume  0.79857E-04 ppm1      1.911 ppm2      7.442 CV     1
 ASSI { 4416}
   (( segid "    " and resid 113  and name HG1 ))
   (  segid "    " and resid 114  and name HG2%)
      6.000     6.000     0.000 peak  4416 spectrum    1 weight  0.11000E+01 volume  0.34127E-04 ppm1      2.675 ppm2      0.928 CV     1
 ASSI { 4417}
   (( segid "    " and resid 23   and name HG2 ))
   (( segid "    " and resid 23   and name HN  ))
      6.000     4.900     0.000 peak  4417 spectrum    1 weight  0.10000E+01 volume  0.38366E-04 ppm1      2.522 ppm2      8.159 CV     1
 ASSI { 4420}
   (  segid "    " and resid 113  and name HE% )
   (( segid "    " and resid 139  and name HB1 ))
      4.500     2.500     1.500 peak  4420 spectrum    1 weight  0.11000E+01 volume  0.28838E-03 ppm1      2.148 ppm2      2.889 CV     1
 ASSI { 4425}
   (( segid "    " and resid 47   and name HB2 ))
   (( segid "    " and resid 36   and name HZ3 ))
      6.000     6.000     0.000 peak  4425 spectrum    1 weight  0.11000E+01 volume  0.94568E-04 ppm1      1.757 ppm2      7.035 CV     1
 OR { 4425}
   (( segid "    " and resid 47   and name HB1 ))
   (( segid "    " and resid 36   and name HZ3 ))
 ASSI { 4426}
   (( segid "    " and resid 47   and name HG1 ))
   (( segid "    " and resid 36   and name HZ3 ))
      6.000     6.000     0.000 peak  4426 spectrum    1 weight  0.11000E+01 volume  0.87009E-04 ppm1      1.400 ppm2      7.014 CV     1
 OR { 4426}
   (( segid "    " and resid 47   and name HG2 ))
   (( segid "    " and resid 36   and name HZ3 ))
 ASSI { 4427}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 91   and name HA2 ))
      6.000     5.300     0.000 peak  4427 spectrum    1 weight  0.10000E+01 volume  0.90156E-04 ppm1      3.603 ppm2      3.943 CV     1
 ASSI { 4428}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 90   and name HA  ))
      5.100     3.300     0.900 peak  4428 spectrum    1 weight  0.10000E+01 volume  0.25171E-03 ppm1      3.611 ppm2      4.325 CV     1
 ASSI { 4435}
   (( segid "    " and resid 62   and name HG1 ))
   (( segid "    " and resid 91   and name HA2 ))
      5.400     3.600     0.600 peak  4435 spectrum    1 weight  0.10000E+01 volume  0.31003E-03 ppm1      1.536 ppm2      3.942 CV     1
 ASSI { 4436}
   (( segid "    " and resid 62   and name HG1 ))
   (( segid "    " and resid 91   and name HA1 ))
      4.600     2.700     1.400 peak  4436 spectrum    1 weight  0.10000E+01 volume  0.47178E-03 ppm1      1.527 ppm2      4.298 CV     1
 ASSI { 4437}
   (( segid "    " and resid 62   and name HD1 ))
   (( segid "    " and resid 62   and name HE1 ))
      2.900     1.100     1.100 peak  4437 spectrum    1 weight  0.11000E+01 volume  0.25057E-02 ppm1      1.750 ppm2      3.037 CV     1
 OR { 4437}
   (( segid "    " and resid 62   and name HD2 ))
   (( segid "    " and resid 62   and name HE2 ))
 OR { 4437}
   (( segid "    " and resid 62   and name HD1 ))
   (( segid "    " and resid 62   and name HE2 ))
 OR { 4437}
   (( segid "    " and resid 62   and name HD2 ))
   (( segid "    " and resid 62   and name HE1 ))
 ASSI { 4444}
   (( segid "    " and resid 62   and name HE2 ))
   (( segid "    " and resid 91   and name HA2 ))
      4.400     2.400     1.600 peak  4444 spectrum    1 weight  0.10000E+01 volume  0.47370E-03 ppm1      3.041 ppm2      3.931 CV     1
 OR { 4444}
   (( segid "    " and resid 62   and name HE1 ))
   (( segid "    " and resid 91   and name HA2 ))
 ASSI { 4445}
   (( segid "    " and resid 119  and name HA  ))
   (( segid "    " and resid 118  and name HB2 ))
      4.900     4.900     1.100 peak  4445 spectrum    1 weight  0.11000E+01 volume  0.56326E-03 ppm1      3.963 ppm2      3.566 CV     1
 ASSI { 4448}
   (( segid "    " and resid 119  and name HB1 ))
   (  segid "    " and resid 120  and name HE% )
      6.000     6.000     0.000 peak  4448 spectrum    1 weight  0.11000E+01 volume  0.11527E-03 ppm1      1.645 ppm2      6.702 CV     1
 ASSI { 4450}
   (( segid "    " and resid 119  and name HB2 ))
   (( segid "    " and resid 117  and name HB1 ))
      6.000     6.000     0.000 peak  4450 spectrum    1 weight  0.11000E+01 volume  0.10094E-03 ppm1      1.274 ppm2      2.992 CV     1
 ASSI { 4455}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 86   and name HG  ))
      2.700     0.900     0.900 peak  4455 spectrum    1 weight  0.10000E+01 volume  0.40130E-02 ppm1      0.933 ppm2      1.597 CV     1
 ASSI { 4459}
   (( segid "    " and resid 119  and name HG2 ))
   (( segid "    " and resid 137  and name HA  ))
      6.000     6.000     0.000 peak  4459 spectrum    1 weight  0.10000E+01 volume  0.15057E-03 ppm1      0.628 ppm2      4.666 CV     1
 ASSI { 4463}
   (( segid "    " and resid 119  and name HD2 ))
   (( segid "    " and resid 44   and name HB1 ))
      4.600     2.700     1.400 peak  4463 spectrum    1 weight  0.10000E+01 volume  0.57444E-03 ppm1      1.392 ppm2      1.962 CV     1
 OR { 4463}
   (( segid "    " and resid 119  and name HD1 ))
   (( segid "    " and resid 44   and name HB1 ))
 ASSI { 4464}
   (( segid "    " and resid 119  and name HD2 ))
   (( segid "    " and resid 120  and name HA  ))
      6.000     6.000     0.000 peak  4464 spectrum    1 weight  0.11000E+01 volume  0.23250E-03 ppm1      1.382 ppm2      4.782 CV     1
 OR { 4464}
   (( segid "    " and resid 119  and name HD1 ))
   (( segid "    " and resid 120  and name HA  ))
 ASSI { 4465}
   (( segid "    " and resid 119  and name HD2 ))
   (  segid "    " and resid 120  and name HE% )
      3.600     1.600     1.600 peak  4465 spectrum    1 weight  0.11000E+01 volume  0.52203E-03 ppm1      1.391 ppm2      6.705 CV     1
 OR { 4465}
   (( segid "    " and resid 119  and name HD1 ))
   (  segid "    " and resid 120  and name HE% )
 ASSI { 4466}
   (( segid "    " and resid 119  and name HD2 ))
   (  segid "    " and resid 120  and name HD% )
      5.000     3.100     1.000 peak  4466 spectrum    1 weight  0.11000E+01 volume  0.22135E-03 ppm1      1.388 ppm2      6.939 CV     1
 OR { 4466}
   (( segid "    " and resid 119  and name HD1 ))
   (  segid "    " and resid 120  and name HD% )
 ASSI { 4467}
   (( segid "    " and resid 119  and name HE1 ))
   (  segid "    " and resid 120  and name HD% )
      5.700     4.000     0.300 peak  4467 spectrum    1 weight  0.11000E+01 volume  0.29894E-03 ppm1      2.768 ppm2      6.942 CV     1
 OR { 4467}
   (( segid "    " and resid 119  and name HE2 ))
   (  segid "    " and resid 120  and name HD% )
 ASSI { 4468}
   (( segid "    " and resid 119  and name HE1 ))
   (( segid "    " and resid 44   and name HB1 ))
      5.100     3.200     0.900 peak  4468 spectrum    1 weight  0.10000E+01 volume  0.22248E-03 ppm1      2.772 ppm2      1.963 CV     1
 ASSI { 4469}
   (( segid "    " and resid 119  and name HE2 ))
   (( segid "    " and resid 118  and name HB1 ))
      5.300     3.500     0.700 peak  4469 spectrum    1 weight  0.11000E+01 volume  0.24777E-03 ppm1      2.771 ppm2      3.590 CV     1
 ASSI { 4473}
   (( segid "    " and resid 119  and name HA  ))
   (  segid "    " and resid 120  and name HD% )
      6.000     6.000     0.000 peak  4473 spectrum    1 weight  0.11000E+01 volume  0.10401E-03 ppm1      3.982 ppm2      6.943 CV     1
 ASSI { 4474}
   (( segid "    " and resid 145  and name HA  ))
   (  segid "    " and resid 143  and name HG2%)
      4.800     2.800     1.200 peak  4474 spectrum    1 weight  0.11000E+01 volume  0.28901E-03 ppm1      4.325 ppm2      1.048 CV     1
 ASSI { 4475}
   (( segid "    " and resid 145  and name HA  ))
   (( segid "    " and resid 68   and name HA  ))
      6.000     4.500     0.000 peak  4475 spectrum    1 weight  0.11000E+01 volume  0.17130E-03 ppm1      4.334 ppm2      5.601 CV     1
 ASSI { 4479}
   (( segid "    " and resid 145  and name HB2 ))
   (  segid "    " and resid 146  and name HG2%)
      4.100     2.100     1.900 peak  4479 spectrum    1 weight  0.11000E+01 volume  0.10780E-02 ppm1      1.679 ppm2      1.121 CV     1
 ASSI { 4480}
   (( segid "    " and resid 145  and name HB2 ))
   (( segid "    " and resid 67   and name HB  ))
      4.500     2.600     1.500 peak  4480 spectrum    1 weight  0.11000E+01 volume  0.56765E-03 ppm1      1.690 ppm2      3.993 CV     1
 ASSI { 4484}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 145  and name HG2 ))
      5.000     3.200     1.000 peak  4484 spectrum    1 weight  0.11000E+01 volume  0.11611E-03 ppm1      5.618 ppm2      1.391 CV     1
 ASSI { 4485}
   (( segid "    " and resid 145  and name HG2 ))
   (  segid "    " and resid 143  and name HG2%)
      3.000     3.000     3.000 peak  4485 spectrum    1 weight  0.11000E+01 volume  0.16790E-02 ppm1      1.405 ppm2      1.045 CV     1
 ASSI { 4487}
   (( segid "    " and resid 145  and name HE2 ))
   (( segid "    " and resid 67   and name HB  ))
      2.500     2.500     3.500 peak  4487 spectrum    1 weight  0.11000E+01 volume  0.38700E-03 ppm1      3.008 ppm2      3.991 CV     1
 OR { 4487}
   (( segid "    " and resid 145  and name HE1 ))
   (( segid "    " and resid 67   and name HB  ))
 ASSI { 4491}
   (( segid "    " and resid 145  and name HD1 ))
   (  segid "    " and resid 143  and name HG2%)
      4.200     2.200     1.800 peak  4491 spectrum    1 weight  0.11000E+01 volume  0.12923E-02 ppm1      1.775 ppm2      1.056 CV     1
 ASSI { 4493}
   (( segid "    " and resid 145  and name HE2 ))
   (( segid "    " and resid 68   and name HA  ))
      3.500     3.500     2.500 peak  4493 spectrum    1 weight  0.11000E+01 volume  0.54615E-04 ppm1      3.014 ppm2      5.594 CV     1
 OR { 4493}
   (( segid "    " and resid 145  and name HE1 ))
   (( segid "    " and resid 68   and name HA  ))
 ASSI { 4496}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 36   and name HB1 ))
      5.600     3.900     0.400 peak  4496 spectrum    1 weight  0.11000E+01 volume  0.32052E-03 ppm1      2.804 ppm2      3.076 CV     1
 OR { 4496}
   (( segid "    " and resid 46   and name HD1 ))
   (( segid "    " and resid 36   and name HB1 ))
 ASSI { 4497}
   (( segid "    " and resid 46   and name HD1 ))
   (( segid "    " and resid 43   and name HA2 ))
      3.400     3.400     2.600 peak  4497 spectrum    1 weight  0.11000E+01 volume  0.45311E-03 ppm1      2.787 ppm2      3.481 CV     1
 ASSI { 4499}
   (( segid "    " and resid 46   and name HD1 ))
   (( segid "    " and resid 44   and name HA  ))
      5.500     3.700     0.500 peak  4499 spectrum    1 weight  0.10000E+01 volume  0.13286E-03 ppm1      2.779 ppm2      4.378 CV     1
 OR { 4499}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 44   and name HA  ))
 ASSI { 4501}
   (( segid "    " and resid 43   and name HA2 ))
   (( segid "    " and resid 46   and name HD1 ))
      4.900     3.000     1.100 peak  4501 spectrum    1 weight  0.11000E+01 volume  0.12726E-03 ppm1      3.468 ppm2      2.777 CV     1
 OR { 4501}
   (( segid "    " and resid 43   and name HA2 ))
   (( segid "    " and resid 46   and name HD2 ))
 ASSI { 4502}
   (( segid "    " and resid 18   and name HB2 ))
   (( segid "    " and resid 18   and name HG2 ))
      3.000     1.100     1.100 peak  4502 spectrum    1 weight  0.10000E+01 volume  0.55262E-02 ppm1      1.876 ppm2      2.121 CV     1
 ASSI { 4505}
   (( segid "    " and resid 79   and name HD1 ))
   (( segid "    " and resid 81   and name HG1 ))
      2.700     2.700     3.300 peak  4505 spectrum    1 weight  0.11000E+01 volume  0.26250E-03 ppm1      3.240 ppm2      2.425 CV     1
 OR { 4505}
   (( segid "    " and resid 79   and name HD2 ))
   (( segid "    " and resid 81   and name HG1 ))
 ASSI { 4506}
   (( segid "    " and resid 79   and name HD1 ))
   (( segid "    " and resid 73   and name HB1 ))
      4.900     3.100     1.100 peak  4506 spectrum    1 weight  0.11000E+01 volume  0.53885E-03 ppm1      3.231 ppm2      3.735 CV     1
 OR { 4506}
   (( segid "    " and resid 79   and name HD2 ))
   (( segid "    " and resid 73   and name HB1 ))
 OR { 4506}
   (( segid "    " and resid 79   and name HD1 ))
   (( segid "    " and resid 73   and name HB2 ))
 OR { 4506}
   (( segid "    " and resid 79   and name HD2 ))
   (( segid "    " and resid 73   and name HB2 ))
 ASSI { 4507}
   (( segid "    " and resid 79   and name HD2 ))
   (( segid "    " and resid 78   and name HA  ))
      2.200     2.200     3.800 peak  4507 spectrum    1 weight  0.11000E+01 volume  0.84148E-03 ppm1      3.234 ppm2      4.054 CV     1
 OR { 4507}
   (( segid "    " and resid 79   and name HD1 ))
   (( segid "    " and resid 78   and name HA  ))
 ASSI { 4508}
   (( segid "    " and resid 79   and name HD2 ))
   (( segid "    " and resid 79   and name HH22))
      6.000     5.200     0.000 peak  4508 spectrum    1 weight  0.11000E+01 volume  0.12955E-03 ppm1      3.243 ppm2      6.543 CV     1
 OR { 4508}
   (( segid "    " and resid 79   and name HD1 ))
   (( segid "    " and resid 79   and name HH22))
 OR { 4508}
   (( segid "    " and resid 79   and name HD1 ))
   (( segid "    " and resid 79   and name HH21))
 OR { 4508}
   (( segid "    " and resid 79   and name HD2 ))
   (( segid "    " and resid 79   and name HH21))
 ASSI { 4512}
   (( segid "    " and resid 79   and name HD1 ))
   (( segid "    " and resid 73   and name HA  ))
      6.000     6.000     0.000 peak  4512 spectrum    1 weight  0.11000E+01 volume  0.87736E-04 ppm1      3.259 ppm2      5.547 CV     1
 OR { 4512}
   (( segid "    " and resid 79   and name HD2 ))
   (( segid "    " and resid 73   and name HA  ))
 ASSI { 4513}
   (( segid "    " and resid 79   and name HG2 ))
   (( segid "    " and resid 73   and name HA  ))
      3.800     1.800     1.800 peak  4513 spectrum    1 weight  0.11000E+01 volume  0.34007E-03 ppm1      1.694 ppm2      5.542 CV     1
 OR { 4513}
   (( segid "    " and resid 79   and name HG1 ))
   (( segid "    " and resid 73   and name HA  ))
 ASSI { 4515}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 57   and name HB2 ))
      4.700     2.800     1.300 peak  4515 spectrum    1 weight  0.11000E+01 volume  0.71789E-03 ppm1      5.203 ppm2      4.029 CV     1
 OR { 4515}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 57   and name HB1 ))
 ASSI { 4523}
   (( segid "    " and resid 59   and name HD2 ))
   (  segid "    " and resid 105  and name HD2%)
      6.000     6.000     0.000 peak  4523 spectrum    1 weight  0.11000E+01 volume  0.79301E-04 ppm1      3.063 ppm2      0.852 CV     1
 ASSI { 4528}
   (( segid "    " and resid 59   and name HD1 ))
   (  segid "    " and resid 105  and name HD2%)
      6.000     6.000     0.000 peak  4528 spectrum    1 weight  0.11000E+01 volume  0.97774E-04 ppm1      3.209 ppm2      0.861 CV     1
 ASSI { 4529}
   (( segid "    " and resid 17   and name HD1 ))
   (( segid "    " and resid 19   and name HA  ))
      3.800     3.800     2.200 peak  4529 spectrum    1 weight  0.10000E+01 volume  0.87479E-03 ppm1      3.214 ppm2      4.632 CV     1
 ASSI { 4534}
   (( segid "    " and resid 104  and name HA  ))
   (  segid "    " and resid 90   and name HD1%)
      6.000     4.600     0.000 peak  4534 spectrum    1 weight  0.11000E+01 volume  0.17534E-03 ppm1      4.314 ppm2      1.063 CV     1
 ASSI { 4536}
   (( segid "    " and resid 104  and name HB1 ))
   (  segid "    " and resid 90   and name HD2%)
      4.400     2.400     1.600 peak  4536 spectrum    1 weight  0.11000E+01 volume  0.27087E-03 ppm1      2.434 ppm2      0.753 CV     1
 ASSI { 4537}
   (( segid "    " and resid 104  and name HB2 ))
   (  segid "    " and resid 90   and name HD2%)
      6.000     4.500     0.000 peak  4537 spectrum    1 weight  0.11000E+01 volume  0.22617E-03 ppm1      1.653 ppm2      0.748 CV     1
 ASSI { 4540}
   (( segid "    " and resid 104  and name HG1 ))
   (  segid "    " and resid 90   and name HD2%)
      3.800     1.800     1.800 peak  4540 spectrum    1 weight  0.11000E+01 volume  0.48639E-03 ppm1      2.112 ppm2      0.752 CV     1
 ASSI { 4547}
   (( segid "    " and resid 104  and name HD1 ))
   (  segid "    " and resid 90   and name HD2%)
      3.400     1.400     1.400 peak  4547 spectrum    1 weight  0.11000E+01 volume  0.31252E-03 ppm1      3.641 ppm2      0.756 CV     1
 ASSI { 4550}
   (( segid "    " and resid 104  and name HD1 ))
   (( segid "    " and resid 102  and name HN  ))
      6.000     6.000     0.000 peak  4550 spectrum    1 weight  0.11000E+01 volume  0.76003E-04 ppm1      3.635 ppm2      7.145 CV     1
 ASSI { 4551}
   (( segid "    " and resid 104  and name HD2 ))
   (( segid "    " and resid 101  and name HA  ))
      4.200     2.200     1.800 peak  4551 spectrum    1 weight  0.10000E+01 volume  0.16467E-03 ppm1      3.130 ppm2      4.277 CV     1
 ASSI { 4553}
   (( segid "    " and resid 104  and name HG2 ))
   (  segid "    " and resid 90   and name HD2%)
      4.100     2.100     1.900 peak  4553 spectrum    1 weight  0.11000E+01 volume  0.20334E-02 ppm1      1.806 ppm2      0.765 CV     1
 ASSI { 4554}
   (( segid "    " and resid 104  and name HB2 ))
   (  segid "    " and resid 103  and name HG2%)
      6.000     6.000     0.000 peak  4554 spectrum    1 weight  0.11000E+01 volume  0.34014E-03 ppm1      1.663 ppm2      1.047 CV     1
 ASSI { 4559}
   (( segid "    " and resid 124  and name HD1 ))
   (( segid "    " and resid 123  and name HA1 ))
      2.900     2.900     3.100 peak  4559 spectrum    1 weight  0.11000E+01 volume  0.55894E-03 ppm1      3.942 ppm2      4.162 CV     1
 ASSI { 4560}
   (( segid "    " and resid 124  and name HD2 ))
   (( segid "    " and resid 123  and name HA1 ))
      4.000     4.000     2.000 peak  4560 spectrum    1 weight  0.11000E+01 volume  0.54200E-03 ppm1      3.569 ppm2      4.161 CV     1
 ASSI { 4570}
   (( segid "    " and resid 130  and name HA  ))
   (( segid "    " and resid 129  and name HA  ))
      4.100     2.100     1.900 peak  4570 spectrum    1 weight  0.11000E+01 volume  0.50863E-03 ppm1      4.736 ppm2      4.500 CV     1
 ASSI { 4571}
   (( segid "    " and resid 130  and name HB1 ))
   (  segid "    " and resid 132  and name HD1%)
      6.000     6.000     0.000 peak  4571 spectrum    1 weight  0.11000E+01 volume  0.12458E-03 ppm1      2.362 ppm2      0.459 CV     1
 ASSI { 4572}
   (( segid "    " and resid 130  and name HB1 ))
   (  segid "    " and resid 132  and name HG2%)
      5.900     5.900     0.100 peak  4572 spectrum    1 weight  0.11000E+01 volume  0.32575E-03 ppm1      2.355 ppm2      0.910 CV     1
 ASSI { 4574}
   (( segid "    " and resid 130  and name HB2 ))
   (  segid "    " and resid 132  and name HG2%)
      4.500     4.500     1.500 peak  4574 spectrum    1 weight  0.11000E+01 volume  0.58829E-03 ppm1      1.750 ppm2      0.910 CV     1
 ASSI { 4582}
   (( segid "    " and resid 130  and name HB2 ))
   (  segid "    " and resid 132  and name HD1%)
      5.600     3.900     0.400 peak  4582 spectrum    1 weight  0.11000E+01 volume  0.14685E-03 ppm1      1.743 ppm2      0.455 CV     1
 ASSI { 4583}
   (( segid "    " and resid 130  and name HG1 ))
   (( segid "    " and resid 132  and name HG12))
      6.000     5.100     0.000 peak  4583 spectrum    1 weight  0.10000E+01 volume  0.16595E-03 ppm1      1.796 ppm2      0.744 CV     1
 ASSI { 4585}
   (( segid "    " and resid 130  and name HG1 ))
   (( segid "    " and resid 81   and name HG2 ))
      2.600     2.600     3.400 peak  4585 spectrum    1 weight  0.10000E+01 volume  0.27074E-03 ppm1      1.789 ppm2      2.160 CV     1
 ASSI { 4590}
   (( segid "    " and resid 130  and name HD1 ))
   (( segid "    " and resid 132  and name HN  ))
      6.000     6.000     0.000 peak  4590 spectrum    1 weight  0.10000E+01 volume  0.65963E-04 ppm1      3.495 ppm2      7.875 CV     1
 ASSI { 4594}
   (( segid "    " and resid 130  and name HG1 ))
   (( segid "    " and resid 129  and name HA  ))
      6.000     6.000     0.000 peak  4594 spectrum    1 weight  0.11000E+01 volume  0.37830E-04 ppm1      1.786 ppm2      4.506 CV     1
 ASSI { 4595}
   (( segid "    " and resid 130  and name HD2 ))
   (( segid "    " and resid 129  and name HA  ))
      6.000     5.700     0.000 peak  4595 spectrum    1 weight  0.11000E+01 volume  0.91933E-04 ppm1      3.374 ppm2      4.506 CV     1
 ASSI { 4596}
   (( segid "    " and resid 130  and name HG2 ))
   (( segid "    " and resid 132  and name HA  ))
      6.000     4.900     0.000 peak  4596 spectrum    1 weight  0.11000E+01 volume  0.27661E-04 ppm1      1.473 ppm2      4.102 CV     1
 ASSI { 4597}
   (( segid "    " and resid 130  and name HB2 ))
   (( segid "    " and resid 132  and name HA  ))
      5.600     4.000     0.400 peak  4597 spectrum    1 weight  0.11000E+01 volume  0.39115E-04 ppm1      1.763 ppm2      4.089 CV     1
 ASSI { 4599}
   (( segid "    " and resid 135  and name HB1 ))
   (( segid "    " and resid 135  and name HA  ))
      3.200     1.300     1.300 peak  4599 spectrum    1 weight  0.11000E+01 volume  0.98805E-03 ppm1      3.214 ppm2      3.868 CV     1
 OR { 4599}
   (( segid "    " and resid 135  and name HB2 ))
   (( segid "    " and resid 135  and name HA  ))
 ASSI { 4600}
   (( segid "    " and resid 135  and name HB2 ))
   (( segid "    " and resid 135  and name HB1 ))
      2.300     0.700     0.700 peak  4600 spectrum    1 weight  0.11000E+01 volume  0.33611E-02 ppm1      3.208 ppm2      3.213 CV     1
 ASSI { 4603}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 135  and name HB2 ))
      3.200     1.300     1.300 peak  4603 spectrum    1 weight  0.11000E+01 volume  0.96105E-03 ppm1      3.865 ppm2      3.197 CV     1
 ASSI { 4604}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 118  and name HB2 ))
      4.200     2.200     1.800 peak  4604 spectrum    1 weight  0.11000E+01 volume  0.50606E-03 ppm1      3.869 ppm2      3.525 CV     1
 ASSI { 4606}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 137  and name HA  ))
      5.500     3.800     0.500 peak  4606 spectrum    1 weight  0.10000E+01 volume  0.29503E-03 ppm1      3.863 ppm2      4.645 CV     1
 ASSI { 4609}
   (( segid "    " and resid 135  and name HB1 ))
   (( segid "    " and resid 134  and name HB2 ))
      4.600     2.700     1.400 peak  4609 spectrum    1 weight  0.10000E+01 volume  0.15747E-03 ppm1      3.264 ppm2      2.022 CV     1
 ASSI { 4612}
   (( segid "    " and resid 135  and name HB1 ))
   (( segid "    " and resid 137  and name HA  ))
      5.800     4.200     0.200 peak  4612 spectrum    1 weight  0.10000E+01 volume  0.19714E-03 ppm1      3.216 ppm2      4.643 CV     1
 OR { 4612}
   (( segid "    " and resid 135  and name HB2 ))
   (( segid "    " and resid 137  and name HA  ))
 ASSI { 4613}
   (( segid "    " and resid 135  and name HB2 ))
   (( segid "    " and resid 118  and name HB2 ))
      6.000     6.000     0.000 peak  4613 spectrum    1 weight  0.11000E+01 volume  0.81699E-04 ppm1      3.215 ppm2      3.522 CV     1
 OR { 4613}
   (( segid "    " and resid 135  and name HB1 ))
   (( segid "    " and resid 118  and name HB2 ))
 ASSI { 4619}
   (  segid "    " and resid 144  and name HD1%)
   (( segid "    " and resid 108  and name HA  ))
      3.900     1.900     1.900 peak  4619 spectrum    1 weight  0.11000E+01 volume  0.17542E-02 ppm1      0.780 ppm2      3.340 CV     1
 ASSI { 4623}
   (( segid "    " and resid 144  and name HB2 ))
   (  segid "    " and resid 144  and name HD2%)
      3.800     1.800     1.800 peak  4623 spectrum    1 weight  0.11000E+01 volume  0.49057E-03 ppm1      1.316 ppm2      0.892 CV     1
 ASSI { 4627}
   (( segid "    " and resid 144  and name HB2 ))
   (( segid "    " and resid 144  and name HG  ))
      4.300     2.300     1.700 peak  4627 spectrum    1 weight  0.11000E+01 volume  0.38257E-03 ppm1      1.311 ppm2      1.476 CV     1
 ASSI { 4629}
   (( segid "    " and resid 144  and name HG  ))
   (  segid "    " and resid 144  and name HD2%)
      3.100     1.200     1.200 peak  4629 spectrum    1 weight  0.11000E+01 volume  0.11692E-02 ppm1      1.474 ppm2      0.855 CV     1
 ASSI { 4630}
   (( segid "    " and resid 144  and name HG  ))
   (( segid "    " and resid 144  and name HB1 ))
      3.400     1.400     1.400 peak  4630 spectrum    1 weight  0.11000E+01 volume  0.61948E-03 ppm1      1.457 ppm2      2.362 CV     1
 ASSI { 4632}
   (  segid "    " and resid 144  and name HD1%)
   (  segid "    " and resid 144  and name HD2%)
      2.800     1.000     1.000 peak  4632 spectrum    1 weight  0.11000E+01 volume  0.30412E-02 ppm1      0.785 ppm2      0.892 CV     1
 ASSI { 4633}
   (  segid "    " and resid 144  and name HD1%)
   (( segid "    " and resid 144  and name HG  ))
      2.700     0.900     0.900 peak  4633 spectrum    1 weight  0.11000E+01 volume  0.29081E-02 ppm1      0.786 ppm2      1.470 CV     1
 ASSI { 4634}
   (  segid "    " and resid 144  and name HD1%)
   (( segid "    " and resid 144  and name HB2 ))
      2.900     1.000     1.000 peak  4634 spectrum    1 weight  0.11000E+01 volume  0.21163E-02 ppm1      0.782 ppm2      1.307 CV     1
 ASSI { 4635}
   (  segid "    " and resid 144  and name HD1%)
   (( segid "    " and resid 144  and name HB1 ))
      4.000     2.000     2.000 peak  4635 spectrum    1 weight  0.11000E+01 volume  0.12426E-02 ppm1      0.781 ppm2      2.370 CV     1
 ASSI { 4636}
   (  segid "    " and resid 144  and name HD2%)
   (( segid "    " and resid 144  and name HB1 ))
      3.300     1.300     1.300 peak  4636 spectrum    1 weight  0.11000E+01 volume  0.10147E-02 ppm1      0.890 ppm2      2.368 CV     1
 ASSI { 4637}
   (  segid "    " and resid 144  and name HD2%)
   (( segid "    " and resid 144  and name HA  ))
      3.500     1.500     1.500 peak  4637 spectrum    1 weight  0.11000E+01 volume  0.34957E-02 ppm1      0.881 ppm2      4.666 CV     1
 ASSI { 4642}
   (( segid "    " and resid 144  and name HB2 ))
   (  segid "    " and resid 103  and name HG2%)
      3.900     1.900     1.900 peak  4642 spectrum    1 weight  0.11000E+01 volume  0.31860E-03 ppm1      1.299 ppm2      1.038 CV     1
 ASSI { 4643}
   (( segid "    " and resid 144  and name HB2 ))
   (  segid "    " and resid 106  and name HE% )
      3.800     1.800     1.800 peak  4643 spectrum    1 weight  0.11000E+01 volume  0.48147E-03 ppm1      1.311 ppm2      1.973 CV     1
 ASSI { 4646}
   (( segid "    " and resid 144  and name HB1 ))
   (( segid "    " and resid 68   and name HA  ))
      6.000     6.000     0.000 peak  4646 spectrum    1 weight  0.11000E+01 volume  0.79515E-04 ppm1      2.340 ppm2      5.612 CV     1
 ASSI { 4649}
   (( segid "    " and resid 144  and name HG  ))
   (  segid "    " and resid 108  and name HG1%)
      3.600     1.700     1.700 peak  4649 spectrum    1 weight  0.11000E+01 volume  0.17562E-02 ppm1      1.469 ppm2      0.951 CV     1
 ASSI { 4650}
   (  segid "    " and resid 144  and name HD1%)
   (( segid "    " and resid 66   and name HB  ))
      2.700     0.900     0.900 peak  4650 spectrum    1 weight  0.10000E+01 volume  0.20859E-02 ppm1      0.781 ppm2      1.699 CV     1
 ASSI { 4654}
   (  segid "    " and resid 144  and name HD1%)
   (( segid "    " and resid 67   and name HN  ))
      6.000     5.000     0.000 peak  4654 spectrum    1 weight  0.10000E+01 volume  0.59004E-04 ppm1      0.779 ppm2      7.811 CV     1
 ASSI { 4658}
   (( segid "    " and resid 144  and name HB1 ))
   (  segid "    " and resid 103  and name HG2%)
      5.700     5.700     0.300 peak  4658 spectrum    1 weight  0.11000E+01 volume  0.13321E-03 ppm1      2.391 ppm2      1.051 CV     1
 ASSI { 4661}
   (  segid "    " and resid 106  and name HE% )
   (( segid "    " and resid 144  and name HB1 ))
      3.700     1.700     1.700 peak  4661 spectrum    1 weight  0.11000E+01 volume  0.93690E-03 ppm1      1.978 ppm2      2.374 CV     1
 ASSI { 4662}
   (( segid "    " and resid 144  and name HG  ))
   (( segid "    " and resid 68   and name HA  ))
      6.000     6.000     0.000 peak  4662 spectrum    1 weight  0.11000E+01 volume  0.38495E-04 ppm1      1.448 ppm2      5.615 CV     1
 ASSI { 4663}
   (  segid "    " and resid 144  and name HD1%)
   (  segid "    " and resid 106  and name HE% )
      2.100     2.100     3.900 peak  4663 spectrum    1 weight  0.11000E+01 volume  0.10139E-02 ppm1      0.789 ppm2      1.965 CV     1
 ASSI { 4665}
   (  segid "    " and resid 144  and name HD1%)
   (  segid "    " and resid 108  and name HG1%)
      3.100     3.100     2.900 peak  4665 spectrum    1 weight  0.11000E+01 volume  0.71403E-02 ppm1      0.785 ppm2      0.946 CV     1
 ASSI { 4667}
   (  segid "    " and resid 144  and name HD1%)
   (  segid "    " and resid 66   and name HG2%)
      4.800     2.900     1.200 peak  4667 spectrum    1 weight  0.11000E+01 volume  0.22621E-03 ppm1      0.784 ppm2      0.030 CV     1
 ASSI {    1}
   (( segid "    " and resid 14   and name HN  ))
   (  segid "    " and resid 14   and name HB% )
      4.200     2.200     1.800 peak     1 spectrum    1 weight  0.11000E+01 volume  0.56149E-03 ppm1      8.029 ppm2      1.407 CV     1
 ASSI {    2}
   (( segid "    " and resid 90   and name HN  ))
   (  segid "    " and resid 90   and name HD2%)
      4.600     2.600     1.400 peak     2 spectrum    1 weight  0.11000E+01 volume  0.99123E-03 ppm1      8.964 ppm2      0.733 CV     1
 ASSI {    3}
   (( segid "    " and resid 90   and name HN  ))
   (  segid "    " and resid 90   and name HD1%)
      4.100     2.100     1.900 peak     3 spectrum    1 weight  0.11000E+01 volume  0.12814E-02 ppm1      8.965 ppm2      1.036 CV     1
 ASSI {    4}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 90   and name HG  ))
      4.200     2.200     1.800 peak     4 spectrum    1 weight  0.11000E+01 volume  0.12682E-02 ppm1      8.965 ppm2      1.565 CV     1
 ASSI {    5}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 90   and name HB1 ))
      2.800     1.000     1.000 peak     5 spectrum    1 weight  0.11000E+01 volume  0.30457E-02 ppm1      8.964 ppm2      1.943 CV     1
 ASSI {    7}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 90   and name HA  ))
      2.800     1.000     1.000 peak     7 spectrum    1 weight  0.11000E+01 volume  0.20467E-02 ppm1      8.964 ppm2      4.332 CV     1
 ASSI {    9}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 101  and name HA  ))
      2.700     0.900     0.900 peak     9 spectrum    1 weight  0.11000E+01 volume  0.29385E-02 ppm1      8.223 ppm2      4.254 CV     1
 ASSI {   11}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 101  and name HB1 ))
      3.300     1.400     1.400 peak    11 spectrum    1 weight  0.11000E+01 volume  0.43773E-02 ppm1      8.225 ppm2      1.587 CV     1
 ASSI {   13}
   (( segid "    " and resid 101  and name HN  ))
   (  segid "    " and resid 101  and name HD2%)
      4.600     2.700     1.400 peak    13 spectrum    1 weight  0.11000E+01 volume  0.58864E-03 ppm1      8.228 ppm2      0.499 CV     1
 ASSI {   15}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 99   and name HA  ))
      2.700     0.900     0.900 peak    15 spectrum    1 weight  0.11000E+01 volume  0.17792E-02 ppm1      7.252 ppm2      4.181 CV     1
 ASSI {   16}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 99   and name HB2 ))
      2.600     0.800     0.800 peak    16 spectrum    1 weight  0.11000E+01 volume  0.38397E-02 ppm1      7.252 ppm2      1.324 CV     1
 ASSI {   17}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 99   and name HB1 ))
      2.400     0.700     0.700 peak    17 spectrum    1 weight  0.11000E+01 volume  0.32221E-02 ppm1      7.252 ppm2      1.480 CV     1
 ASSI {   18}
   (( segid "    " and resid 99   and name HN  ))
   (  segid "    " and resid 99   and name HD1%)
      3.300     3.300     2.700 peak    18 spectrum    1 weight  0.11000E+01 volume  0.36990E-02 ppm1      7.253 ppm2      1.285 CV     1
 ASSI {   19}
   (( segid "    " and resid 99   and name HN  ))
   (  segid "    " and resid 99   and name HD2%)
      3.800     1.800     1.800 peak    19 spectrum    1 weight  0.11000E+01 volume  0.24044E-02 ppm1      7.253 ppm2      0.740 CV     1
 ASSI {   21}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 86   and name HA  ))
      2.800     1.000     1.000 peak    21 spectrum    1 weight  0.11000E+01 volume  0.25286E-02 ppm1      8.803 ppm2      4.603 CV     1
 ASSI {   22}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 86   and name HB2 ))
      2.700     0.900     0.900 peak    22 spectrum    1 weight  0.11000E+01 volume  0.35054E-02 ppm1      8.805 ppm2      1.282 CV     1
 ASSI {   23}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 86   and name HB1 ))
      2.500     0.800     0.800 peak    23 spectrum    1 weight  0.11000E+01 volume  0.55375E-02 ppm1      8.805 ppm2      2.024 CV     1
 ASSI {   25}
   (( segid "    " and resid 86   and name HN  ))
   (  segid "    " and resid 86   and name HD1%)
      4.100     2.100     1.900 peak    25 spectrum    1 weight  0.11000E+01 volume  0.16958E-02 ppm1      8.805 ppm2      0.969 CV     1
 ASSI {   26}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 86   and name HG  ))
      4.700     4.700     1.300 peak    26 spectrum    1 weight  0.11000E+01 volume  0.52418E-03 ppm1      8.798 ppm2      1.553 CV     1
 ASSI {   30}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 74   and name HB2 ))
      2.500     0.800     0.800 peak    30 spectrum    1 weight  0.11000E+01 volume  0.40062E-02 ppm1      8.639 ppm2      1.940 CV     1
 OR {   30}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 74   and name HB1 ))
 ASSI {   31}
   (( segid "    " and resid 74   and name HN  ))
   (  segid "    " and resid 74   and name HD1%)
      5.100     5.100     0.900 peak    31 spectrum    1 weight  0.11000E+01 volume  0.74023E-03 ppm1      8.643 ppm2      1.221 CV     1
 ASSI {   32}
   (( segid "    " and resid 74   and name HN  ))
   (  segid "    " and resid 74   and name HD2%)
      2.700     0.900     0.900 peak    32 spectrum    1 weight  0.11000E+01 volume  0.43356E-02 ppm1      8.640 ppm2      0.831 CV     1
 ASSI {   33}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 74   and name HG  ))
      2.800     1.000     1.000 peak    33 spectrum    1 weight  0.11000E+01 volume  0.48538E-02 ppm1      8.640 ppm2      1.714 CV     1
 ASSI {   34}
   (( segid "    " and resid 74   and name HN  ))
   (  segid "    " and resid 138  and name HD1%)
      3.700     3.700     2.300 peak    34 spectrum    1 weight  0.11000E+01 volume  0.21246E-02 ppm1      8.641 ppm2      0.955 CV     1
 ASSI {   36}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 70   and name HA  ))
      2.400     0.700     0.700 peak    36 spectrum    1 weight  0.11000E+01 volume  0.58614E-02 ppm1      9.003 ppm2      5.373 CV     1
 ASSI {   37}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 70   and name HB1 ))
      2.800     1.000     1.000 peak    37 spectrum    1 weight  0.11000E+01 volume  0.20790E-02 ppm1      8.998 ppm2      1.884 CV     1
 ASSI {   41}
   (( segid "    " and resid 70   and name HN  ))
   (  segid "    " and resid 70   and name HD2%)
      4.000     2.000     2.000 peak    41 spectrum    1 weight  0.11000E+01 volume  0.61201E-03 ppm1      8.999 ppm2      0.785 CV     1
 ASSI {   42}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 105  and name HA  ))
      2.800     0.900     0.900 peak    42 spectrum    1 weight  0.11000E+01 volume  0.37413E-02 ppm1      7.380 ppm2      4.357 CV     1
 ASSI {   44}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 105  and name HB1 ))
      3.500     1.500     1.500 peak    44 spectrum    1 weight  0.11000E+01 volume  0.42034E-02 ppm1      7.380 ppm2      1.781 CV     1
 ASSI {   45}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 105  and name HB2 ))
      2.200     2.200     3.800 peak    45 spectrum    1 weight  0.11000E+01 volume  0.65841E-02 ppm1      7.380 ppm2      1.670 CV     1
 ASSI {   47}
   (( segid "    " and resid 105  and name HN  ))
   (  segid "    " and resid 105  and name HD1%)
      4.100     2.100     1.900 peak    47 spectrum    1 weight  0.11000E+01 volume  0.18975E-02 ppm1      7.381 ppm2      0.968 CV     1
 ASSI {   50}
   (( segid "    " and resid 150  and name HN  ))
   (( segid "    " and resid 150  and name HA  ))
      2.700     0.900     0.900 peak    50 spectrum    1 weight  0.11000E+01 volume  0.45231E-02 ppm1      8.702 ppm2      4.164 CV     1
 ASSI {   51}
   (( segid "    " and resid 150  and name HN  ))
   (( segid "    " and resid 150  and name HB1 ))
      2.200     0.600     0.600 peak    51 spectrum    1 weight  0.11000E+01 volume  0.13868E-01 ppm1      8.703 ppm2      1.575 CV     1
 OR {   51}
   (( segid "    " and resid 150  and name HN  ))
   (( segid "    " and resid 150  and name HB2 ))
 ASSI {   52}
   (( segid "    " and resid 150  and name HN  ))
   (  segid "    " and resid 150  and name HD2%)
      3.400     1.400     1.400 peak    52 spectrum    1 weight  0.11000E+01 volume  0.30856E-02 ppm1      8.702 ppm2      0.852 CV     1
 OR {   52}
   (( segid "    " and resid 150  and name HN  ))
   (  segid "    " and resid 150  and name HD1%)
 ASSI {   55}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 45   and name HB1 ))
      2.300     0.700     0.700 peak    55 spectrum    1 weight  0.11000E+01 volume  0.32320E-02 ppm1      8.355 ppm2      1.689 CV     1
 ASSI {   56}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 45   and name HB2 ))
      3.100     1.200     1.200 peak    56 spectrum    1 weight  0.11000E+01 volume  0.27619E-02 ppm1      8.356 ppm2      0.823 CV     1
 OR {   56}
   (( segid "    " and resid 45   and name HN  ))
   (  segid "    " and resid 45   and name HD1%)
 ASSI {   58}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 45   and name HG  ))
      3.600     3.600     2.400 peak    58 spectrum    1 weight  0.11000E+01 volume  0.10477E-02 ppm1      8.354 ppm2      1.327 CV     1
 ASSI {   60}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 44   and name HA  ))
      2.700     0.900     0.900 peak    60 spectrum    1 weight  0.11000E+01 volume  0.32494E-02 ppm1      7.651 ppm2      4.369 CV     1
 ASSI {   61}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 44   and name HB1 ))
      2.900     1.000     1.000 peak    61 spectrum    1 weight  0.11000E+01 volume  0.45913E-02 ppm1      7.651 ppm2      1.956 CV     1
 ASSI {   62}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 44   and name HB2 ))
      3.100     1.200     1.200 peak    62 spectrum    1 weight  0.11000E+01 volume  0.34808E-02 ppm1      7.654 ppm2      1.673 CV     1
 ASSI {   63}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 44   and name HG  ))
      3.400     1.400     1.400 peak    63 spectrum    1 weight  0.11000E+01 volume  0.48401E-02 ppm1      7.652 ppm2      1.563 CV     1
 ASSI {   64}
   (( segid "    " and resid 44   and name HN  ))
   (  segid "    " and resid 44   and name HD2%)
      2.700     2.700     3.300 peak    64 spectrum    1 weight  0.11000E+01 volume  0.30013E-02 ppm1      7.651 ppm2      0.821 CV     1
 ASSI {   65}
   (( segid "    " and resid 44   and name HN  ))
   (  segid "    " and resid 44   and name HD1%)
      2.600     0.800     0.800 peak    65 spectrum    1 weight  0.11000E+01 volume  0.24027E-02 ppm1      7.651 ppm2      0.929 CV     1
 ASSI {   67}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 37   and name HA  ))
      2.800     1.000     1.000 peak    67 spectrum    1 weight  0.11000E+01 volume  0.28665E-02 ppm1      9.581 ppm2      4.587 CV     1
 ASSI {   68}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 37   and name HB1 ))
      2.700     0.900     0.900 peak    68 spectrum    1 weight  0.11000E+01 volume  0.43150E-02 ppm1      9.580 ppm2      1.914 CV     1
 ASSI {   69}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 37   and name HB2 ))
      2.400     0.700     0.700 peak    69 spectrum    1 weight  0.11000E+01 volume  0.46036E-02 ppm1      9.581 ppm2      1.722 CV     1
 ASSI {   71}
   (( segid "    " and resid 37   and name HN  ))
   (  segid "    " and resid 37   and name HD1%)
      4.600     2.700     1.400 peak    71 spectrum    1 weight  0.11000E+01 volume  0.11362E-02 ppm1      9.580 ppm2      0.972 CV     1
 OR {   71}
   (( segid "    " and resid 37   and name HN  ))
   (  segid "    " and resid 37   and name HD2%)
 ASSI {   74}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 40   and name HA  ))
      3.000     1.100     1.100 peak    74 spectrum    1 weight  0.11000E+01 volume  0.21477E-02 ppm1      8.636 ppm2      4.599 CV     1
 ASSI {   75}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 40   and name HB2 ))
      2.300     0.700     0.700 peak    75 spectrum    1 weight  0.11000E+01 volume  0.39319E-02 ppm1      8.635 ppm2      1.604 CV     1
 ASSI {   76}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 40   and name HB1 ))
      3.500     1.600     1.600 peak    76 spectrum    1 weight  0.11000E+01 volume  0.32166E-02 ppm1      8.636 ppm2      1.807 CV     1
 ASSI {   77}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 40   and name HG  ))
      3.100     1.200     1.200 peak    77 spectrum    1 weight  0.11000E+01 volume  0.29801E-02 ppm1      8.634 ppm2      1.353 CV     1
 ASSI {   79}
   (( segid "    " and resid 40   and name HN  ))
   (  segid "    " and resid 40   and name HD1%)
      3.700     1.700     1.700 peak    79 spectrum    1 weight  0.11000E+01 volume  0.31672E-02 ppm1      8.634 ppm2      0.788 CV     1
 ASSI {   81}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 50   and name HA  ))
      3.100     1.200     1.200 peak    81 spectrum    1 weight  0.11000E+01 volume  0.15350E-02 ppm1      9.127 ppm2      4.445 CV     1
 ASSI {   83}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 50   and name HB1 ))
      3.400     1.400     1.400 peak    83 spectrum    1 weight  0.11000E+01 volume  0.31462E-02 ppm1      9.127 ppm2      1.548 CV     1
 ASSI {   88}
   (( segid "    " and resid 138  and name HN  ))
   (( segid "    " and resid 138  and name HB1 ))
      3.200     1.300     1.300 peak    88 spectrum    1 weight  0.11000E+01 volume  0.35685E-02 ppm1      8.256 ppm2      1.886 CV     1
 ASSI {   89}
   (( segid "    " and resid 138  and name HN  ))
   (( segid "    " and resid 138  and name HB2 ))
      2.400     0.700     0.700 peak    89 spectrum    1 weight  0.11000E+01 volume  0.40232E-02 ppm1      8.258 ppm2      1.436 CV     1
 ASSI {   90}
   (( segid "    " and resid 138  and name HN  ))
   (  segid "    " and resid 138  and name HD2%)
      4.400     2.400     1.600 peak    90 spectrum    1 weight  0.11000E+01 volume  0.10713E-02 ppm1      8.255 ppm2      0.848 CV     1
 ASSI {   91}
   (( segid "    " and resid 138  and name HN  ))
   (  segid "    " and resid 138  and name HD1%)
      3.800     1.800     1.800 peak    91 spectrum    1 weight  0.11000E+01 volume  0.13133E-02 ppm1      8.255 ppm2      1.101 CV     1
 ASSI {   95}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 140  and name HB1 ))
      2.900     1.100     1.100 peak    95 spectrum    1 weight  0.11000E+01 volume  0.26825E-02 ppm1      9.910 ppm2      1.871 CV     1
 ASSI {   96}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 140  and name HG  ))
      2.500     0.800     0.800 peak    96 spectrum    1 weight  0.11000E+01 volume  0.27128E-02 ppm1      9.911 ppm2      1.649 CV     1
 ASSI {   97}
   (( segid "    " and resid 140  and name HN  ))
   (  segid "    " and resid 140  and name HD1%)
      4.000     2.000     2.000 peak    97 spectrum    1 weight  0.11000E+01 volume  0.17919E-02 ppm1      9.912 ppm2      0.917 CV     1
 ASSI {  102}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 18   and name HA  ))
      3.400     1.400     1.400 peak   102 spectrum    1 weight  0.11000E+01 volume  0.13215E-02 ppm1      8.108 ppm2      4.206 CV     1
 ASSI {  104}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 51   and name HB  ))
      2.800     1.000     1.000 peak   104 spectrum    1 weight  0.11000E+01 volume  0.32414E-02 ppm1      8.142 ppm2      2.050 CV     1
 ASSI {  105}
   (( segid "    " and resid 51   and name HN  ))
   (  segid "    " and resid 51   and name HG1%)
      3.600     1.700     1.700 peak   105 spectrum    1 weight  0.11000E+01 volume  0.34178E-02 ppm1      8.140 ppm2      1.040 CV     1
 ASSI {  106}
   (( segid "    " and resid 51   and name HN  ))
   (  segid "    " and resid 51   and name HG2%)
      3.100     3.100     2.900 peak   106 spectrum    1 weight  0.11000E+01 volume  0.25302E-02 ppm1      8.142 ppm2      0.893 CV     1
 ASSI {  108}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 61   and name HA  ))
      2.700     0.900     0.900 peak   108 spectrum    1 weight  0.11000E+01 volume  0.29756E-02 ppm1      7.937 ppm2      4.406 CV     1
 ASSI {  109}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 61   and name HB  ))
      3.000     1.100     1.100 peak   109 spectrum    1 weight  0.11000E+01 volume  0.22610E-02 ppm1      7.940 ppm2      1.970 CV     1
 ASSI {  114}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 64   and name HA  ))
      2.100     0.600     0.600 peak   114 spectrum    1 weight  0.11000E+01 volume  0.71681E-02 ppm1      8.824 ppm2      4.452 CV     1
 ASSI {  115}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 65   and name HB  ))
      2.900     1.100     1.100 peak   115 spectrum    1 weight  0.11000E+01 volume  0.46614E-02 ppm1      8.822 ppm2      1.720 CV     1
 ASSI {  117}
   (( segid "    " and resid 65   and name HN  ))
   (  segid "    " and resid 65   and name HG1%)
      2.400     0.800     0.800 peak   117 spectrum    1 weight  0.11000E+01 volume  0.53039E-02 ppm1      8.821 ppm2      0.844 CV     1
 ASSI {  120}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 89   and name HA  ))
      4.100     2.100     1.900 peak   120 spectrum    1 weight  0.11000E+01 volume  0.18752E-02 ppm1      9.129 ppm2      4.574 CV     1
 ASSI {  121}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 65   and name HA  ))
      2.100     0.600     0.600 peak   121 spectrum    1 weight  0.11000E+01 volume  0.94896E-02 ppm1      9.129 ppm2      4.254 CV     1
 ASSI {  123}
   (( segid "    " and resid 66   and name HN  ))
   (  segid "    " and resid 66   and name HG1%)
      3.100     1.200     1.200 peak   123 spectrum    1 weight  0.11000E+01 volume  0.23071E-02 ppm1      9.129 ppm2      0.671 CV     1
 ASSI {  126}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 68   and name HA  ))
      2.800     1.000     1.000 peak   126 spectrum    1 weight  0.11000E+01 volume  0.19929E-02 ppm1      9.581 ppm2      5.586 CV     1
 ASSI {  129}
   (( segid "    " and resid 68   and name HN  ))
   (  segid "    " and resid 68   and name HG2%)
      2.400     0.700     0.700 peak   129 spectrum    1 weight  0.11000E+01 volume  0.35267E-02 ppm1      9.579 ppm2      0.966 CV     1
 ASSI {  130}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 67   and name HA  ))
      2.000     0.500     0.500 peak   130 spectrum    1 weight  0.11000E+01 volume  0.10340E-01 ppm1      9.579 ppm2      5.302 CV     1
 ASSI {  132}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 80   and name HA  ))
      2.800     1.000     1.000 peak   132 spectrum    1 weight  0.11000E+01 volume  0.26233E-02 ppm1      8.904 ppm2      4.386 CV     1
 ASSI {  133}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 79   and name HA  ))
      1.800     0.400     0.400 peak   133 spectrum    1 weight  0.11000E+01 volume  0.87368E-02 ppm1      8.904 ppm2      4.484 CV     1
 ASSI {  134}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 80   and name HB  ))
      3.300     1.400     1.400 peak   134 spectrum    1 weight  0.11000E+01 volume  0.29399E-02 ppm1      8.904 ppm2      1.970 CV     1
 ASSI {  135}
   (( segid "    " and resid 80   and name HN  ))
   (  segid "    " and resid 80   and name HG2%)
      2.300     0.600     0.600 peak   135 spectrum    1 weight  0.11000E+01 volume  0.36823E-02 ppm1      8.905 ppm2      0.811 CV     1
 ASSI {  138}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 87   and name HA  ))
      3.000     1.100     1.100 peak   138 spectrum    1 weight  0.11000E+01 volume  0.20840E-02 ppm1      8.337 ppm2      5.342 CV     1
 ASSI {  139}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 86   and name HA  ))
      2.200     0.600     0.600 peak   139 spectrum    1 weight  0.11000E+01 volume  0.10051E-01 ppm1      8.334 ppm2      4.602 CV     1
 ASSI {  142}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 87   and name HB  ))
      2.500     0.800     0.800 peak   142 spectrum    1 weight  0.11000E+01 volume  0.55672E-02 ppm1      8.334 ppm2      1.878 CV     1
 ASSI {  144}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 95   and name HA  ))
      2.800     1.000     1.000 peak   144 spectrum    1 weight  0.11000E+01 volume  0.32728E-02 ppm1      6.765 ppm2      4.280 CV     1
 ASSI {  145}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 94   and name HA  ))
      3.200     1.300     1.300 peak   145 spectrum    1 weight  0.11000E+01 volume  0.19000E-02 ppm1      6.765 ppm2      4.658 CV     1
 ASSI {  148}
   (( segid "    " and resid 95   and name HN  ))
   (  segid "    " and resid 95   and name HG1%)
      3.500     1.500     1.500 peak   148 spectrum    1 weight  0.11000E+01 volume  0.20117E-02 ppm1      6.762 ppm2      0.293 CV     1
 ASSI {  150}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 103  and name HA  ))
      2.900     1.000     1.000 peak   150 spectrum    1 weight  0.11000E+01 volume  0.22949E-02 ppm1      7.934 ppm2      3.944 CV     1
 ASSI {  152}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 103  and name HB  ))
      2.300     0.700     0.700 peak   152 spectrum    1 weight  0.11000E+01 volume  0.48224E-02 ppm1      7.936 ppm2      2.277 CV     1
 ASSI {  153}
   (( segid "    " and resid 103  and name HN  ))
   (  segid "    " and resid 103  and name HG1%)
      3.400     1.400     1.400 peak   153 spectrum    1 weight  0.11000E+01 volume  0.47103E-02 ppm1      7.936 ppm2      1.288 CV     1
 ASSI {  154}
   (( segid "    " and resid 103  and name HN  ))
   (  segid "    " and resid 103  and name HG2%)
      2.800     1.000     1.000 peak   154 spectrum    1 weight  0.11000E+01 volume  0.21574E-02 ppm1      7.936 ppm2      1.017 CV     1
 ASSI {  157}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 107  and name HA  ))
      2.400     0.700     0.700 peak   157 spectrum    1 weight  0.11000E+01 volume  0.45091E-02 ppm1      8.467 ppm2      4.730 CV     1
 ASSI {  158}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 108  and name HB  ))
      2.300     0.600     0.600 peak   158 spectrum    1 weight  0.11000E+01 volume  0.54879E-02 ppm1      8.468 ppm2      2.047 CV     1
 ASSI {  159}
   (( segid "    " and resid 108  and name HN  ))
   (  segid "    " and resid 108  and name HG1%)
      3.200     1.300     1.300 peak   159 spectrum    1 weight  0.11000E+01 volume  0.75012E-02 ppm1      8.468 ppm2      0.931 CV     1
 ASSI {  160}
   (( segid "    " and resid 108  and name HN  ))
   (  segid "    " and resid 108  and name HG2%)
      3.000     1.100     1.100 peak   160 spectrum    1 weight  0.11000E+01 volume  0.30381E-02 ppm1      8.466 ppm2      0.839 CV     1
 ASSI {  162}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 113  and name HA  ))
      2.200     0.600     0.600 peak   162 spectrum    1 weight  0.11000E+01 volume  0.64335E-02 ppm1      9.711 ppm2      5.506 CV     1
 ASSI {  163}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 114  and name HB  ))
      2.700     0.900     0.900 peak   163 spectrum    1 weight  0.11000E+01 volume  0.30171E-02 ppm1      9.713 ppm2      2.021 CV     1
 ASSI {  166}
   (( segid "    " and resid 142  and name HN  ))
   (( segid "    " and resid 142  and name HA  ))
      2.900     1.000     1.000 peak   166 spectrum    1 weight  0.11000E+01 volume  0.19026E-02 ppm1      9.363 ppm2      5.043 CV     1
 ASSI {  167}
   (( segid "    " and resid 142  and name HN  ))
   (( segid "    " and resid 141  and name HA  ))
      2.000     0.500     0.500 peak   167 spectrum    1 weight  0.11000E+01 volume  0.79590E-02 ppm1      9.361 ppm2      5.217 CV     1
 ASSI {  168}
   (( segid "    " and resid 142  and name HN  ))
   (( segid "    " and resid 142  and name HB  ))
      3.100     1.200     1.200 peak   168 spectrum    1 weight  0.11000E+01 volume  0.42558E-02 ppm1      9.362 ppm2      1.938 CV     1
 ASSI {  169}
   (( segid "    " and resid 142  and name HN  ))
   (  segid "    " and resid 142  and name HG1%)
      3.600     1.700     1.700 peak   169 spectrum    1 weight  0.11000E+01 volume  0.97961E-03 ppm1      9.362 ppm2      0.911 CV     1
 ASSI {  170}
   (( segid "    " and resid 142  and name HN  ))
   (  segid "    " and resid 142  and name HG2%)
      2.500     0.800     0.800 peak   170 spectrum    1 weight  0.11000E+01 volume  0.33047E-02 ppm1      9.361 ppm2      0.827 CV     1
 ASSI {  172}
   (( segid "    " and resid 148  and name HN  ))
   (( segid "    " and resid 148  and name HA  ))
      2.900     1.000     1.000 peak   172 spectrum    1 weight  0.11000E+01 volume  0.25956E-02 ppm1      8.706 ppm2      4.583 CV     1
 ASSI {  173}
   (( segid "    " and resid 148  and name HN  ))
   (( segid "    " and resid 147  and name HA  ))
      2.100     0.500     0.500 peak   173 spectrum    1 weight  0.11000E+01 volume  0.11507E-01 ppm1      8.705 ppm2      5.003 CV     1
 ASSI {  174}
   (( segid "    " and resid 148  and name HN  ))
   (( segid "    " and resid 148  and name HB  ))
      3.300     1.300     1.300 peak   174 spectrum    1 weight  0.11000E+01 volume  0.21146E-02 ppm1      8.703 ppm2      2.112 CV     1
 ASSI {  175}
   (( segid "    " and resid 148  and name HN  ))
   (  segid "    " and resid 148  and name HG2%)
      2.700     0.900     0.900 peak   175 spectrum    1 weight  0.11000E+01 volume  0.51681E-02 ppm1      8.705 ppm2      0.841 CV     1
 ASSI {  177}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 48   and name HA  ))
      2.500     0.800     0.800 peak   177 spectrum    1 weight  0.11000E+01 volume  0.54402E-02 ppm1      9.114 ppm2      4.655 CV     1
 ASSI {  178}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 49   and name HA  ))
      3.000     1.100     1.100 peak   178 spectrum    1 weight  0.11000E+01 volume  0.19994E-02 ppm1      9.117 ppm2      3.950 CV     1
 ASSI {  179}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 49   and name HB  ))
      3.000     1.100     1.100 peak   179 spectrum    1 weight  0.11000E+01 volume  0.54142E-02 ppm1      9.115 ppm2      3.821 CV     1
 ASSI {  182}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 67   and name HA  ))
      2.900     1.000     1.000 peak   182 spectrum    1 weight  0.11000E+01 volume  0.20322E-02 ppm1      7.829 ppm2      5.300 CV     1
 ASSI {  183}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 66   and name HA  ))
      2.100     0.600     0.600 peak   183 spectrum    1 weight  0.11000E+01 volume  0.96012E-02 ppm1      7.828 ppm2      5.053 CV     1
 ASSI {  184}
   (( segid "    " and resid 67   and name HN  ))
   (  segid "    " and resid 67   and name HG2%)
      3.000     1.100     1.100 peak   184 spectrum    1 weight  0.11000E+01 volume  0.21466E-02 ppm1      7.829 ppm2      1.071 CV     1
 ASSI {  185}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 67   and name HB  ))
      3.100     1.200     1.200 peak   185 spectrum    1 weight  0.11000E+01 volume  0.33913E-02 ppm1      7.828 ppm2      3.979 CV     1
 ASSI {  187}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 72   and name HA  ))
      2.900     1.000     1.000 peak   187 spectrum    1 weight  0.11000E+01 volume  0.18243E-02 ppm1      9.111 ppm2      4.886 CV     1
 ASSI {  188}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 71   and name HA  ))
      2.100     0.500     0.500 peak   188 spectrum    1 weight  0.11000E+01 volume  0.96912E-02 ppm1      9.114 ppm2      5.019 CV     1
 ASSI {  189}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 72   and name HB  ))
      2.300     0.700     0.700 peak   189 spectrum    1 weight  0.11000E+01 volume  0.40317E-02 ppm1      9.114 ppm2      4.003 CV     1
 ASSI {  192}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 78   and name HB  ))
      2.100     0.600     0.600 peak   192 spectrum    1 weight  0.11000E+01 volume  0.12016E-01 ppm1      7.769 ppm2      4.052 CV     1
 OR {  192}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 78   and name HA  ))
 ASSI {  193}
   (( segid "    " and resid 78   and name HN  ))
   (  segid "    " and resid 78   and name HG2%)
      3.900     1.900     1.900 peak   193 spectrum    1 weight  0.11000E+01 volume  0.20410E-02 ppm1      7.769 ppm2      1.223 CV     1
 ASSI {  196}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 89   and name HA  ))
      3.000     1.100     1.100 peak   196 spectrum    1 weight  0.11000E+01 volume  0.18844E-02 ppm1      9.140 ppm2      4.574 CV     1
 ASSI {  197}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 88   and name HA  ))
      2.400     0.700     0.700 peak   197 spectrum    1 weight  0.11000E+01 volume  0.80209E-02 ppm1      9.140 ppm2      4.961 CV     1
 ASSI {  198}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 89   and name HB  ))
      2.400     0.700     0.700 peak   198 spectrum    1 weight  0.11000E+01 volume  0.61006E-02 ppm1      9.140 ppm2      4.137 CV     1
 ASSI {  202}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 110  and name HA  ))
      2.400     0.700     0.700 peak   202 spectrum    1 weight  0.11000E+01 volume  0.58932E-02 ppm1      8.981 ppm2      4.617 CV     1
 ASSI {  204}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 111  and name HB  ))
      2.700     0.900     0.900 peak   204 spectrum    1 weight  0.11000E+01 volume  0.29734E-02 ppm1      8.980 ppm2      3.765 CV     1
 ASSI {  207}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 114  and name HA  ))
      2.200     0.600     0.600 peak   207 spectrum    1 weight  0.11000E+01 volume  0.75239E-02 ppm1      9.293 ppm2      5.601 CV     1
 ASSI {  208}
   (( segid "    " and resid 115  and name HN  ))
   (  segid "    " and resid 115  and name HG2%)
      3.800     1.800     1.800 peak   208 spectrum    1 weight  0.11000E+01 volume  0.19671E-02 ppm1      9.291 ppm2      1.109 CV     1
 ASSI {  211}
   (( segid "    " and resid 143  and name HN  ))
   (( segid "    " and resid 143  and name HA  ))
      2.800     1.000     1.000 peak   211 spectrum    1 weight  0.11000E+01 volume  0.26268E-02 ppm1      9.171 ppm2      5.600 CV     1
 ASSI {  212}
   (( segid "    " and resid 143  and name HN  ))
   (( segid "    " and resid 142  and name HA  ))
      2.100     0.600     0.600 peak   212 spectrum    1 weight  0.11000E+01 volume  0.93071E-02 ppm1      9.169 ppm2      5.051 CV     1
 ASSI {  213}
   (( segid "    " and resid 143  and name HN  ))
   (( segid "    " and resid 143  and name HB  ))
      2.600     0.800     0.800 peak   213 spectrum    1 weight  0.11000E+01 volume  0.30036E-02 ppm1      9.169 ppm2      4.073 CV     1
 ASSI {  214}
   (( segid "    " and resid 143  and name HN  ))
   (  segid "    " and resid 143  and name HG2%)
      4.100     2.100     1.900 peak   214 spectrum    1 weight  0.11000E+01 volume  0.13905E-02 ppm1      9.168 ppm2      1.046 CV     1
 ASSI {  216}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 146  and name HA  ))
      2.800     1.000     1.000 peak   216 spectrum    1 weight  0.11000E+01 volume  0.28714E-02 ppm1      7.358 ppm2      4.511 CV     1
 ASSI {  218}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 146  and name HB  ))
      3.000     1.200     1.200 peak   218 spectrum    1 weight  0.11000E+01 volume  0.19550E-02 ppm1      7.361 ppm2      4.048 CV     1
 ASSI {  219}
   (( segid "    " and resid 146  and name HN  ))
   (  segid "    " and resid 146  and name HG2%)
      3.700     1.700     1.700 peak   219 spectrum    1 weight  0.11000E+01 volume  0.28327E-02 ppm1      7.361 ppm2      1.083 CV     1
 ASSI {  221}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 5    and name HA  ))
      3.100     1.200     1.200 peak   221 spectrum    1 weight  0.11000E+01 volume  0.19199E-02 ppm1      8.361 ppm2      4.415 CV     1
 ASSI {  222}
   (( segid "    " and resid 6    and name HN  ))
   (  segid "    " and resid 6    and name HB% )
      3.900     3.900     2.100 peak   222 spectrum    1 weight  0.11000E+01 volume  0.72654E-03 ppm1      8.359 ppm2      1.369 CV     1
 ASSI {  223}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 6    and name HA  ))
      4.800     2.800     1.200 peak   223 spectrum    1 weight  0.11000E+01 volume  0.19857E-03 ppm1      8.356 ppm2      4.278 CV     1
 ASSI {  226}
   (( segid "    " and resid 9    and name HN  ))
   (  segid "    " and resid 9    and name HB% )
      3.700     1.700     1.700 peak   226 spectrum    1 weight  0.11000E+01 volume  0.10887E-02 ppm1      8.211 ppm2      1.386 CV     1
 ASSI {  227}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 13   and name HA1 ))
      4.000     2.000     2.000 peak   227 spectrum    1 weight  0.11000E+01 volume  0.57872E-03 ppm1      8.035 ppm2      3.931 CV     1
 OR {  227}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 13   and name HA2 ))
 ASSI {  230}
   (( segid "    " and resid 16   and name HN  ))
   (  segid "    " and resid 16   and name HB% )
      3.800     1.800     1.800 peak   230 spectrum    1 weight  0.11000E+01 volume  0.10120E-02 ppm1      8.136 ppm2      1.411 CV     1
 ASSI {  233}
   (( segid "    " and resid 21   and name HN  ))
   (  segid "    " and resid 21   and name HB% )
      3.700     1.700     1.700 peak   233 spectrum    1 weight  0.11000E+01 volume  0.11358E-02 ppm1      8.066 ppm2      1.388 CV     1
 ASSI {  236}
   (( segid "    " and resid 22   and name HN  ))
   (  segid "    " and resid 22   and name HB% )
      3.600     1.600     1.600 peak   236 spectrum    1 weight  0.11000E+01 volume  0.13487E-02 ppm1      8.030 ppm2      1.391 CV     1
 ASSI {  238}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 27   and name HA  ))
      1.900     0.400     0.400 peak   238 spectrum    1 weight  0.11000E+01 volume  0.36717E-01 ppm1      8.331 ppm2      4.396 CV     1
 ASSI {  239}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 28   and name HA  ))
      2.700     0.900     0.900 peak   239 spectrum    1 weight  0.11000E+01 volume  0.47851E-02 ppm1      8.327 ppm2      4.583 CV     1
 ASSI {  240}
   (( segid "    " and resid 28   and name HN  ))
   (  segid "    " and resid 28   and name HB% )
      2.500     0.800     0.800 peak   240 spectrum    1 weight  0.11000E+01 volume  0.87117E-02 ppm1      8.333 ppm2      1.358 CV     1
 ASSI {  242}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 30   and name HA  ))
      4.000     2.000     2.000 peak   242 spectrum    1 weight  0.11000E+01 volume  0.56526E-03 ppm1      8.495 ppm2      4.489 CV     1
 ASSI {  243}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 29   and name HA  ))
      3.500     1.600     1.600 peak   243 spectrum    1 weight  0.11000E+01 volume  0.76337E-03 ppm1      8.491 ppm2      4.700 CV     1
 ASSI {  245}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 32   and name HA  ))
      2.900     1.100     1.100 peak   245 spectrum    1 weight  0.11000E+01 volume  0.32027E-02 ppm1      8.385 ppm2      4.610 CV     1
 ASSI {  246}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 31   and name HA  ))
      2.200     0.600     0.600 peak   246 spectrum    1 weight  0.11000E+01 volume  0.16642E-01 ppm1      8.385 ppm2      4.414 CV     1
 ASSI {  247}
   (( segid "    " and resid 32   and name HN  ))
   (  segid "    " and resid 32   and name HB% )
      2.800     1.000     1.000 peak   247 spectrum    1 weight  0.11000E+01 volume  0.52024E-02 ppm1      8.383 ppm2      1.383 CV     1
 ASSI {  249}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 98   and name HA  ))
      2.600     0.900     0.900 peak   249 spectrum    1 weight  0.11000E+01 volume  0.34928E-02 ppm1      8.965 ppm2      3.824 CV     1
 ASSI {  250}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 97   and name HA  ))
      2.900     1.000     1.000 peak   250 spectrum    1 weight  0.11000E+01 volume  0.17315E-02 ppm1      8.965 ppm2      4.010 CV     1
 ASSI {  251}
   (( segid "    " and resid 98   and name HN  ))
   (  segid "    " and resid 98   and name HB% )
      2.300     0.700     0.700 peak   251 spectrum    1 weight  0.11000E+01 volume  0.72009E-02 ppm1      8.965 ppm2      1.119 CV     1
 ASSI {  254}
   (( segid "    " and resid 112  and name HN  ))
   (  segid "    " and resid 112  and name HB% )
      2.900     1.000     1.000 peak   254 spectrum    1 weight  0.11000E+01 volume  0.25822E-02 ppm1      9.967 ppm2      1.520 CV     1
 ASSI {  255}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 111  and name HA  ))
      2.300     0.700     0.700 peak   255 spectrum    1 weight  0.11000E+01 volume  0.66798E-02 ppm1      9.969 ppm2      5.602 CV     1
 ASSI {  258}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 115  and name HA  ))
      2.200     0.600     0.600 peak   258 spectrum    1 weight  0.11000E+01 volume  0.78417E-02 ppm1      8.641 ppm2      5.118 CV     1
 ASSI {  259}
   (( segid "    " and resid 116  and name HN  ))
   (  segid "    " and resid 116  and name HB% )
      2.600     0.800     0.800 peak   259 spectrum    1 weight  0.11000E+01 volume  0.41195E-02 ppm1      8.641 ppm2      1.100 CV     1
 ASSI {  262}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 136  and name HA  ))
      2.800     1.000     1.000 peak   262 spectrum    1 weight  0.11000E+01 volume  0.29760E-02 ppm1      7.407 ppm2      4.393 CV     1
 ASSI {  263}
   (( segid "    " and resid 136  and name HN  ))
   (  segid "    " and resid 136  and name HB% )
      2.500     0.800     0.800 peak   263 spectrum    1 weight  0.11000E+01 volume  0.58498E-02 ppm1      7.406 ppm2      1.256 CV     1
 ASSI {  265}
   (( segid "    " and resid 137  and name HN  ))
   (( segid "    " and resid 137  and name HA  ))
      2.900     1.000     1.000 peak   265 spectrum    1 weight  0.11000E+01 volume  0.21350E-02 ppm1      8.401 ppm2      4.630 CV     1
 ASSI {  266}
   (( segid "    " and resid 137  and name HN  ))
   (( segid "    " and resid 136  and name HA  ))
      2.100     0.500     0.500 peak   266 spectrum    1 weight  0.11000E+01 volume  0.15109E-01 ppm1      8.404 ppm2      4.395 CV     1
 ASSI {  267}
   (( segid "    " and resid 137  and name HN  ))
   (  segid "    " and resid 137  and name HB% )
      2.500     0.800     0.800 peak   267 spectrum    1 weight  0.11000E+01 volume  0.76048E-02 ppm1      8.407 ppm2      1.443 CV     1
 ASSI {  269}
   (( segid "    " and resid 147  and name HN  ))
   (( segid "    " and resid 147  and name HA  ))
      2.700     0.900     0.900 peak   269 spectrum    1 weight  0.11000E+01 volume  0.31736E-02 ppm1      8.279 ppm2      5.002 CV     1
 ASSI {  270}
   (( segid "    " and resid 147  and name HN  ))
   (( segid "    " and resid 146  and name HA  ))
      2.200     0.600     0.600 peak   270 spectrum    1 weight  0.11000E+01 volume  0.15043E-01 ppm1      8.283 ppm2      4.514 CV     1
 ASSI {  271}
   (( segid "    " and resid 147  and name HN  ))
   (  segid "    " and resid 147  and name HB% )
      2.500     0.800     0.800 peak   271 spectrum    1 weight  0.11000E+01 volume  0.65237E-02 ppm1      8.283 ppm2      1.108 CV     1
 ASSI {  273}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 39   and name HA  ))
      2.900     1.000     1.000 peak   273 spectrum    1 weight  0.11000E+01 volume  0.23614E-02 ppm1      8.293 ppm2      3.457 CV     1
 ASSI {  274}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 39   and name HB  ))
      2.300     0.700     0.700 peak   274 spectrum    1 weight  0.11000E+01 volume  0.42024E-02 ppm1      8.295 ppm2      1.608 CV     1
 ASSI {  275}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 39   and name HG11))
      2.200     0.600     0.600 peak   275 spectrum    1 weight  0.11000E+01 volume  0.40121E-02 ppm1      8.295 ppm2      1.789 CV     1
 ASSI {  276}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 39   and name HG12))
      3.300     1.300     1.300 peak   276 spectrum    1 weight  0.11000E+01 volume  0.27843E-02 ppm1      8.294 ppm2      0.971 CV     1
 ASSI {  277}
   (( segid "    " and resid 39   and name HN  ))
   (  segid "    " and resid 39   and name HD1%)
      3.800     1.800     1.800 peak   277 spectrum    1 weight  0.11000E+01 volume  0.27569E-02 ppm1      8.295 ppm2      0.760 CV     1
 OR {  277}
   (( segid "    " and resid 39   and name HN  ))
   (  segid "    " and resid 39   and name HG2%)
 ASSI {  278}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 38   and name HA  ))
      2.200     0.600     0.600 peak   278 spectrum    1 weight  0.11000E+01 volume  0.43944E-02 ppm1      8.294 ppm2      4.762 CV     1
 ASSI {  280}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 96   and name HA  ))
      2.700     0.900     0.900 peak   280 spectrum    1 weight  0.11000E+01 volume  0.17579E-02 ppm1      7.638 ppm2      4.004 CV     1
 ASSI {  281}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 95   and name HA  ))
      2.800     1.000     1.000 peak   281 spectrum    1 weight  0.11000E+01 volume  0.56390E-02 ppm1      7.639 ppm2      4.295 CV     1
 ASSI {  283}
   (( segid "    " and resid 96   and name HN  ))
   (  segid "    " and resid 96   and name HD1%)
      3.800     1.800     1.800 peak   283 spectrum    1 weight  0.11000E+01 volume  0.23527E-02 ppm1      7.638 ppm2      0.747 CV     1
 ASSI {  284}
   (( segid "    " and resid 96   and name HN  ))
   (  segid "    " and resid 96   and name HG2%)
      2.600     2.600     3.400 peak   284 spectrum    1 weight  0.11000E+01 volume  0.43552E-02 ppm1      7.639 ppm2      0.267 CV     1
 ASSI {  285}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 96   and name HG12))
      2.200     0.600     0.600 peak   285 spectrum    1 weight  0.11000E+01 volume  0.39871E-02 ppm1      7.639 ppm2      1.153 CV     1
 ASSI {  288}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 131  and name HA  ))
      2.200     0.600     0.600 peak   288 spectrum    1 weight  0.11000E+01 volume  0.98345E-02 ppm1      7.855 ppm2      4.388 CV     1
 ASSI {  290}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 132  and name HB  ))
      2.600     0.800     0.800 peak   290 spectrum    1 weight  0.11000E+01 volume  0.21676E-02 ppm1      7.854 ppm2      1.128 CV     1
 ASSI {  293}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 132  and name HG12))
      3.500     1.500     1.500 peak   293 spectrum    1 weight  0.11000E+01 volume  0.77943E-03 ppm1      7.855 ppm2      0.739 CV     1
 ASSI {  294}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 132  and name HG11))
      3.200     1.200     1.200 peak   294 spectrum    1 weight  0.11000E+01 volume  0.11579E-02 ppm1      7.856 ppm2      0.982 CV     1
 ASSI {  296}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 36   and name HA  ))
      2.500     0.800     0.800 peak   296 spectrum    1 weight  0.11000E+01 volume  0.67746E-02 ppm1      8.282 ppm2      4.712 CV     1
 ASSI {  297}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 35   and name HA  ))
      2.100     0.500     0.500 peak   297 spectrum    1 weight  0.11000E+01 volume  0.14234E-01 ppm1      8.274 ppm2      4.287 CV     1
 ASSI {  298}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 36   and name HB1 ))
      3.000     1.100     1.100 peak   298 spectrum    1 weight  0.11000E+01 volume  0.48872E-02 ppm1      8.270 ppm2      3.054 CV     1
 ASSI {  301}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 36   and name HE1 ))
      4.600     2.600     1.400 peak   301 spectrum    1 weight  0.11000E+01 volume  0.45618E-03 ppm1      8.280 ppm2     10.072 CV     1
 ASSI {  302}
   (( segid "    " and resid 36   and name HE1 ))
   (( segid "    " and resid 36   and name HA  ))
      4.000     2.000     2.000 peak   302 spectrum    1 weight  0.11000E+01 volume  0.26327E-02 ppm1     10.075 ppm2      4.727 CV     1
 ASSI {  303}
   (( segid "    " and resid 36   and name HE1 ))
   (( segid "    " and resid 36   and name HD1 ))
      2.900     1.100     1.100 peak   303 spectrum    1 weight  0.11000E+01 volume  0.34603E-02 ppm1     10.072 ppm2      7.278 CV     1
 ASSI {  304}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 36   and name HD1 ))
      2.800     1.000     1.000 peak   304 spectrum    1 weight  0.11000E+01 volume  0.32976E-02 ppm1      8.271 ppm2      7.273 CV     1
 ASSI {  306}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 56   and name HA2 ))
      2.900     1.100     1.100 peak   306 spectrum    1 weight  0.11000E+01 volume  0.24877E-02 ppm1      7.805 ppm2      3.739 CV     1
 ASSI {  307}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 56   and name HA1 ))
      4.100     2.100     1.900 peak   307 spectrum    1 weight  0.11000E+01 volume  0.22186E-02 ppm1      7.804 ppm2      4.159 CV     1
 ASSI {  308}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 57   and name HB2 ))
      2.500     0.800     0.800 peak   308 spectrum    1 weight  0.11000E+01 volume  0.57185E-02 ppm1      7.805 ppm2      3.956 CV     1
 ASSI {  309}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 57   and name HB1 ))
      3.000     1.100     1.100 peak   309 spectrum    1 weight  0.11000E+01 volume  0.59787E-02 ppm1      7.806 ppm2      4.042 CV     1
 ASSI {  310}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 57   and name HA  ))
      2.600     0.800     0.800 peak   310 spectrum    1 weight  0.11000E+01 volume  0.76370E-02 ppm1      7.806 ppm2      4.352 CV     1
 ASSI {  312}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 58   and name HA  ))
      2.600     0.800     0.800 peak   312 spectrum    1 weight  0.11000E+01 volume  0.42348E-02 ppm1      8.204 ppm2      4.758 CV     1
 ASSI {  313}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 57   and name HA  ))
      2.200     0.600     0.600 peak   313 spectrum    1 weight  0.11000E+01 volume  0.16052E-01 ppm1      8.205 ppm2      4.347 CV     1
 ASSI {  314}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 58   and name HB1 ))
      2.900     2.900     3.100 peak   314 spectrum    1 weight  0.11000E+01 volume  0.28985E-02 ppm1      8.202 ppm2      3.934 CV     1
 ASSI {  315}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 58   and name HB2 ))
      2.800     1.000     1.000 peak   315 spectrum    1 weight  0.11000E+01 volume  0.34931E-02 ppm1      8.204 ppm2      3.800 CV     1
 ASSI {  317}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 73   and name HA  ))
      2.700     0.900     0.900 peak   317 spectrum    1 weight  0.11000E+01 volume  0.20998E-02 ppm1      9.176 ppm2      5.518 CV     1
 ASSI {  318}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 72   and name HA  ))
      2.100     0.600     0.600 peak   318 spectrum    1 weight  0.11000E+01 volume  0.10343E-01 ppm1      9.175 ppm2      4.881 CV     1
 ASSI {  319}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 73   and name HB1 ))
      2.800     1.000     1.000 peak   319 spectrum    1 weight  0.11000E+01 volume  0.34919E-02 ppm1      9.175 ppm2      3.713 CV     1
 OR {  319}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 73   and name HB2 ))
 ASSI {  321}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 102  and name HA  ))
      2.700     0.900     0.900 peak   321 spectrum    1 weight  0.11000E+01 volume  0.28993E-02 ppm1      7.165 ppm2      4.453 CV     1
 ASSI {  322}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 101  and name HA  ))
      3.300     1.400     1.400 peak   322 spectrum    1 weight  0.11000E+01 volume  0.14205E-02 ppm1      7.165 ppm2      4.244 CV     1
 ASSI {  324}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 102  and name HB1 ))
      2.500     0.800     0.800 peak   324 spectrum    1 weight  0.11000E+01 volume  0.32973E-02 ppm1      7.166 ppm2      3.598 CV     1
 ASSI {  326}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 118  and name HA  ))
      2.700     0.900     0.900 peak   326 spectrum    1 weight  0.11000E+01 volume  0.26788E-02 ppm1      8.616 ppm2      3.939 CV     1
 ASSI {  327}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 118  and name HB2 ))
      2.500     0.800     0.800 peak   327 spectrum    1 weight  0.11000E+01 volume  0.27801E-02 ppm1      8.614 ppm2      3.512 CV     1
 ASSI {  328}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 118  and name HB1 ))
      2.800     1.000     1.000 peak   328 spectrum    1 weight  0.11000E+01 volume  0.34022E-02 ppm1      8.617 ppm2      3.573 CV     1
 ASSI {  330}
   (( segid "    " and resid 127  and name HN  ))
   (( segid "    " and resid 126  and name HA2 ))
      2.300     0.700     0.700 peak   330 spectrum    1 weight  0.11000E+01 volume  0.40974E-02 ppm1      8.488 ppm2      3.499 CV     1
 ASSI {  331}
   (( segid "    " and resid 127  and name HN  ))
   (( segid "    " and resid 126  and name HA1 ))
      2.800     1.000     1.000 peak   331 spectrum    1 weight  0.11000E+01 volume  0.59164E-02 ppm1      8.488 ppm2      3.800 CV     1
 ASSI {  332}
   (( segid "    " and resid 127  and name HN  ))
   (( segid "    " and resid 127  and name HA  ))
      2.600     0.800     0.800 peak   332 spectrum    1 weight  0.11000E+01 volume  0.34319E-02 ppm1      8.488 ppm2      4.494 CV     1
 ASSI {  333}
   (( segid "    " and resid 127  and name HN  ))
   (( segid "    " and resid 127  and name HB1 ))
      2.300     0.700     0.700 peak   333 spectrum    1 weight  0.11000E+01 volume  0.29984E-02 ppm1      8.488 ppm2      2.996 CV     1
 ASSI {  334}
   (( segid "    " and resid 127  and name HN  ))
   (( segid "    " and resid 127  and name HB2 ))
      2.700     0.900     0.900 peak   334 spectrum    1 weight  0.11000E+01 volume  0.27163E-02 ppm1      8.487 ppm2      2.696 CV     1
 ASSI {  337}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 12   and name HA  ))
      4.200     2.200     1.800 peak   337 spectrum    1 weight  0.11000E+01 volume  0.43493E-03 ppm1      8.497 ppm2      4.402 CV     1
 ASSI {  338}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 13   and name HA2 ))
      4.300     2.300     1.700 peak   338 spectrum    1 weight  0.11000E+01 volume  0.40778E-03 ppm1      8.486 ppm2      3.930 CV     1
 OR {  338}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 13   and name HA1 ))
 ASSI {  341}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 41   and name HA1 ))
      2.900     1.100     1.100 peak   341 spectrum    1 weight  0.11000E+01 volume  0.41365E-02 ppm1      7.561 ppm2      4.124 CV     1
 ASSI {  342}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 41   and name HA2 ))
      2.300     0.700     0.700 peak   342 spectrum    1 weight  0.11000E+01 volume  0.55964E-02 ppm1      7.560 ppm2      3.609 CV     1
 ASSI {  349}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 53   and name HA1 ))
      2.900     1.000     1.000 peak   349 spectrum    1 weight  0.11000E+01 volume  0.32341E-02 ppm1      9.204 ppm2      3.999 CV     1
 ASSI {  350}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 53   and name HA2 ))
      2.400     0.700     0.700 peak   350 spectrum    1 weight  0.11000E+01 volume  0.42617E-02 ppm1      9.205 ppm2      3.412 CV     1
 ASSI {  353}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 55   and name HA  ))
      4.100     4.100     1.900 peak   353 spectrum    1 weight  0.11000E+01 volume  0.52772E-03 ppm1      8.838 ppm2      4.366 CV     1
 ASSI {  356}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 62   and name HA  ))
      1.900     0.500     0.500 peak   356 spectrum    1 weight  0.11000E+01 volume  0.10888E-01 ppm1      8.735 ppm2      3.592 CV     1
 ASSI {  357}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 63   and name HA2 ))
      2.300     0.600     0.600 peak   357 spectrum    1 weight  0.11000E+01 volume  0.57619E-02 ppm1      8.735 ppm2      3.515 CV     1
 ASSI {  358}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 63   and name HA1 ))
      2.700     0.900     0.900 peak   358 spectrum    1 weight  0.11000E+01 volume  0.43759E-02 ppm1      8.735 ppm2      4.421 CV     1
 ASSI {  360}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 76   and name HA  ))
      3.200     1.300     1.300 peak   360 spectrum    1 weight  0.11000E+01 volume  0.22483E-02 ppm1      8.196 ppm2      4.554 CV     1
 ASSI {  361}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 77   and name HA1 ))
      2.900     1.100     1.100 peak   361 spectrum    1 weight  0.11000E+01 volume  0.49771E-02 ppm1      8.196 ppm2      4.407 CV     1
 ASSI {  362}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 77   and name HA2 ))
      2.300     0.700     0.700 peak   362 spectrum    1 weight  0.11000E+01 volume  0.81602E-02 ppm1      8.197 ppm2      3.763 CV     1
 ASSI {  364}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 90   and name HA  ))
      2.100     0.600     0.600 peak   364 spectrum    1 weight  0.11000E+01 volume  0.74098E-02 ppm1     10.629 ppm2      4.331 CV     1
 ASSI {  365}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 91   and name HA1 ))
      2.900     1.000     1.000 peak   365 spectrum    1 weight  0.11000E+01 volume  0.34959E-02 ppm1     10.624 ppm2      4.267 CV     1
 ASSI {  366}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 91   and name HA2 ))
      2.500     0.800     0.800 peak   366 spectrum    1 weight  0.11000E+01 volume  0.34905E-02 ppm1     10.629 ppm2      3.922 CV     1
 ASSI {  368}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 108  and name HA  ))
      2.100     0.600     0.600 peak   368 spectrum    1 weight  0.11000E+01 volume  0.70287E-02 ppm1      8.830 ppm2      3.322 CV     1
 ASSI {  369}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 109  and name HA2 ))
      2.500     0.800     0.800 peak   369 spectrum    1 weight  0.11000E+01 volume  0.39977E-02 ppm1      8.829 ppm2      3.717 CV     1
 ASSI {  370}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 109  and name HA1 ))
      3.200     1.300     1.300 peak   370 spectrum    1 weight  0.11000E+01 volume  0.27227E-02 ppm1      8.828 ppm2      4.392 CV     1
 ASSI {  372}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 122  and name HA  ))
      3.100     1.200     1.200 peak   372 spectrum    1 weight  0.11000E+01 volume  0.12979E-02 ppm1      7.988 ppm2      4.496 CV     1
 ASSI {  373}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 123  and name HA2 ))
      2.600     0.800     0.800 peak   373 spectrum    1 weight  0.11000E+01 volume  0.61745E-02 ppm1      7.988 ppm2      3.558 CV     1
 ASSI {  377}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 126  and name HA1 ))
      3.000     1.100     1.100 peak   377 spectrum    1 weight  0.11000E+01 volume  0.31217E-02 ppm1      7.065 ppm2      3.799 CV     1
 ASSI {  378}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 126  and name HA2 ))
      2.400     0.700     0.700 peak   378 spectrum    1 weight  0.11000E+01 volume  0.42203E-02 ppm1      7.066 ppm2      3.499 CV     1
 ASSI {  380}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 75   and name HA  ))
      2.700     0.900     0.900 peak   380 spectrum    1 weight  0.11000E+01 volume  0.44166E-02 ppm1      8.661 ppm2      3.975 CV     1
 ASSI {  381}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 74   and name HA  ))
      2.300     0.600     0.600 peak   381 spectrum    1 weight  0.11000E+01 volume  0.62482E-02 ppm1      8.660 ppm2      4.717 CV     1
 ASSI {  383}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 75   and name HG1 ))
      3.300     3.300     2.700 peak   383 spectrum    1 weight  0.11000E+01 volume  0.15801E-02 ppm1      8.658 ppm2      2.214 CV     1
 OR {  383}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 75   and name HG2 ))
 ASSI {  387}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 82   and name HB1 ))
      3.900     3.900     2.100 peak   387 spectrum    1 weight  0.11000E+01 volume  0.59383E-03 ppm1      8.700 ppm2      2.173 CV     1
 ASSI {  388}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 82   and name HB2 ))
      4.000     2.000     2.000 peak   388 spectrum    1 weight  0.11000E+01 volume  0.76313E-03 ppm1      8.702 ppm2      2.049 CV     1
 OR {  388}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 82   and name HG2 ))
 ASSI {  390}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 82   and name HA  ))
      2.100     0.500     0.500 peak   390 spectrum    1 weight  0.11000E+01 volume  0.13047E-01 ppm1      9.067 ppm2      5.037 CV     1
 ASSI {  391}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 83   and name HG2 ))
      3.300     1.400     1.400 peak   391 spectrum    1 weight  0.11000E+01 volume  0.45321E-02 ppm1      9.067 ppm2      2.180 CV     1
 OR {  391}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 83   and name HG1 ))
 ASSI {  392}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 83   and name HB1 ))
      2.500     0.800     0.800 peak   392 spectrum    1 weight  0.11000E+01 volume  0.45311E-02 ppm1      9.065 ppm2      2.062 CV     1
 ASSI {  393}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 83   and name HB2 ))
      3.000     1.100     1.100 peak   393 spectrum    1 weight  0.11000E+01 volume  0.35217E-02 ppm1      9.066 ppm2      1.920 CV     1
 ASSI {  395}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 85   and name HA  ))
      2.600     0.800     0.800 peak   395 spectrum    1 weight  0.11000E+01 volume  0.33918E-02 ppm1      8.308 ppm2      4.390 CV     1
 ASSI {  396}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 85   and name HB1 ))
      3.000     1.100     1.100 peak   396 spectrum    1 weight  0.11000E+01 volume  0.52838E-02 ppm1      8.310 ppm2      1.984 CV     1
 OR {  396}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 85   and name HG1 ))
 OR {  396}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 85   and name HG2 ))
 ASSI {  397}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 85   and name HB2 ))
      2.700     0.900     0.900 peak   397 spectrum    1 weight  0.11000E+01 volume  0.34114E-02 ppm1      8.309 ppm2      1.728 CV     1
 ASSI {  399}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 110  and name HA  ))
      3.000     1.100     1.100 peak   399 spectrum    1 weight  0.11000E+01 volume  0.22762E-02 ppm1      8.479 ppm2      4.615 CV     1
 ASSI {  403}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 140  and name HA  ))
      2.100     0.600     0.600 peak   403 spectrum    1 weight  0.11000E+01 volume  0.96771E-02 ppm1      9.189 ppm2      5.279 CV     1
 ASSI {  404}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 141  and name HB2 ))
      3.100     1.200     1.200 peak   404 spectrum    1 weight  0.11000E+01 volume  0.42786E-02 ppm1      9.189 ppm2      1.953 CV     1
 OR {  404}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 141  and name HG2 ))
 ASSI {  405}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 141  and name HB1 ))
      2.400     0.700     0.700 peak   405 spectrum    1 weight  0.11000E+01 volume  0.44149E-02 ppm1      9.189 ppm2      2.008 CV     1
 ASSI {  408}
   (( segid "    " and resid 151  and name HN  ))
   (( segid "    " and resid 150  and name HA  ))
      2.400     0.700     0.700 peak   408 spectrum    1 weight  0.11000E+01 volume  0.13257E-01 ppm1      8.515 ppm2      4.159 CV     1
 ASSI {  410}
   (( segid "    " and resid 151  and name HN  ))
   (( segid "    " and resid 151  and name HB1 ))
      2.800     1.000     1.000 peak   410 spectrum    1 weight  0.11000E+01 volume  0.48378E-02 ppm1      8.513 ppm2      2.067 CV     1
 OR {  410}
   (( segid "    " and resid 151  and name HN  ))
   (( segid "    " and resid 151  and name HG2 ))
 ASSI {  411}
   (( segid "    " and resid 151  and name HN  ))
   (( segid "    " and resid 151  and name HB2 ))
      2.400     0.700     0.700 peak   411 spectrum    1 weight  0.11000E+01 volume  0.72105E-02 ppm1      8.512 ppm2      1.950 CV     1
 ASSI {  412}
   (( segid "    " and resid 151  and name HN  ))
   (( segid "    " and resid 151  and name HG1 ))
      3.500     3.500     2.500 peak   412 spectrum    1 weight  0.11000E+01 volume  0.31293E-02 ppm1      8.512 ppm2      2.308 CV     1
 ASSI {  413}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 33   and name HA  ))
      2.300     2.300     3.700 peak   413 spectrum    1 weight  0.11000E+01 volume  0.16078E-01 ppm1      8.511 ppm2      4.422 CV     1
 ASSI {  415}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 26   and name HA  ))
      2.800     1.000     1.000 peak   415 spectrum    1 weight  0.11000E+01 volume  0.35746E-02 ppm1      8.396 ppm2      4.524 CV     1
 ASSI {  416}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 25   and name HA  ))
      2.100     0.600     0.600 peak   416 spectrum    1 weight  0.11000E+01 volume  0.19156E-01 ppm1      8.399 ppm2      4.419 CV     1
 ASSI {  420}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 93   and name HA  ))
      2.300     0.600     0.600 peak   420 spectrum    1 weight  0.11000E+01 volume  0.84336E-02 ppm1      8.947 ppm2      4.253 CV     1
 ASSI {  421}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 92   and name HA  ))
      3.000     1.100     1.100 peak   421 spectrum    1 weight  0.11000E+01 volume  0.33300E-02 ppm1      8.947 ppm2      4.844 CV     1
 ASSI {  422}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 93   and name HB1 ))
      3.500     1.500     1.500 peak   422 spectrum    1 weight  0.11000E+01 volume  0.21574E-02 ppm1      8.946 ppm2      3.197 CV     1
 OR {  422}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 93   and name HB2 ))
 ASSI {  424}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 121  and name HA  ))
      2.800     1.000     1.000 peak   424 spectrum    1 weight  0.11000E+01 volume  0.25451E-02 ppm1      7.717 ppm2      4.455 CV     1
 ASSI {  426}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 121  and name HB1 ))
      3.400     1.500     1.500 peak   426 spectrum    1 weight  0.11000E+01 volume  0.26250E-02 ppm1      7.718 ppm2      3.247 CV     1
 ASSI {  429}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 139  and name HA  ))
      2.900     1.000     1.000 peak   429 spectrum    1 weight  0.11000E+01 volume  0.24624E-02 ppm1      8.829 ppm2      5.079 CV     1
 ASSI {  430}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 138  and name HA  ))
      2.200     0.600     0.600 peak   430 spectrum    1 weight  0.11000E+01 volume  0.87720E-02 ppm1      8.828 ppm2      5.232 CV     1
 ASSI {  431}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 139  and name HB1 ))
      3.100     1.200     1.200 peak   431 spectrum    1 weight  0.11000E+01 volume  0.24809E-02 ppm1      8.828 ppm2      2.878 CV     1
 ASSI {  432}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 139  and name HB2 ))
      2.900     1.100     1.100 peak   432 spectrum    1 weight  0.11000E+01 volume  0.24742E-02 ppm1      8.828 ppm2      2.674 CV     1
 ASSI {  436}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 41   and name HA1 ))
      3.200     1.300     1.300 peak   436 spectrum    1 weight  0.11000E+01 volume  0.15674E-02 ppm1      7.070 ppm2      4.115 CV     1
 ASSI {  441}
   (( segid "    " and resid 42   and name HD22))
   (( segid "    " and resid 42   and name HD21))
      1.900     0.400     0.400 peak   441 spectrum    1 weight  0.11000E+01 volume  0.39401E-02 ppm1      7.848 ppm2      6.493 CV     1
 ASSI {  443}
   (( segid "    " and resid 42   and name HD22))
   (( segid "    " and resid 42   and name HB1 ))
      4.300     2.300     1.700 peak   443 spectrum    1 weight  0.11000E+01 volume  0.64602E-03 ppm1      7.851 ppm2      3.294 CV     1
 ASSI {  444}
   (( segid "    " and resid 42   and name HD22))
   (( segid "    " and resid 42   and name HB2 ))
      3.900     1.900     1.900 peak   444 spectrum    1 weight  0.11000E+01 volume  0.11289E-02 ppm1      7.854 ppm2      2.756 CV     1
 ASSI {  445}
   (( segid "    " and resid 42   and name HD21))
   (( segid "    " and resid 42   and name HB2 ))
      3.400     1.500     1.500 peak   445 spectrum    1 weight  0.11000E+01 volume  0.10044E-02 ppm1      6.491 ppm2      2.770 CV     1
 ASSI {  446}
   (( segid "    " and resid 42   and name HD21))
   (( segid "    " and resid 42   and name HB1 ))
      3.700     1.700     1.700 peak   446 spectrum    1 weight  0.11000E+01 volume  0.76998E-03 ppm1      6.489 ppm2      3.280 CV     1
 ASSI {  452}
   (( segid "    " and resid 76   and name HD22))
   (( segid "    " and resid 76   and name HD21))
      2.300     0.700     0.700 peak   452 spectrum    1 weight  0.11000E+01 volume  0.33189E-02 ppm1      7.639 ppm2      6.856 CV     1
 ASSI {  457}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 38   and name HA  ))
      2.900     1.000     1.000 peak   457 spectrum    1 weight  0.11000E+01 volume  0.19579E-02 ppm1      8.982 ppm2      4.758 CV     1
 ASSI {  458}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 37   and name HA  ))
      2.300     0.700     0.700 peak   458 spectrum    1 weight  0.11000E+01 volume  0.73375E-02 ppm1      8.983 ppm2      4.569 CV     1
 ASSI {  459}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 38   and name HB2 ))
      2.900     1.000     1.000 peak   459 spectrum    1 weight  0.11000E+01 volume  0.28896E-02 ppm1      8.984 ppm2      2.591 CV     1
 OR {  459}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 38   and name HB1 ))
 ASSI {  461}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 92   and name HA  ))
      3.000     1.100     1.100 peak   461 spectrum    1 weight  0.11000E+01 volume  0.34313E-02 ppm1      7.802 ppm2      4.846 CV     1
 ASSI {  462}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 91   and name HA1 ))
      3.000     1.100     1.100 peak   462 spectrum    1 weight  0.11000E+01 volume  0.24660E-02 ppm1      7.802 ppm2      4.278 CV     1
 ASSI {  464}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 92   and name HB1 ))
      2.600     0.900     0.900 peak   464 spectrum    1 weight  0.11000E+01 volume  0.37793E-02 ppm1      7.802 ppm2      2.880 CV     1
 ASSI {  467}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 94   and name HA  ))
      3.100     1.200     1.200 peak   467 spectrum    1 weight  0.11000E+01 volume  0.23678E-02 ppm1      9.096 ppm2      4.659 CV     1
 ASSI {  468}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 93   and name HA  ))
      2.900     1.100     1.100 peak   468 spectrum    1 weight  0.11000E+01 volume  0.27796E-02 ppm1      9.096 ppm2      4.257 CV     1
 ASSI {  469}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 94   and name HB2 ))
      2.800     1.000     1.000 peak   469 spectrum    1 weight  0.11000E+01 volume  0.30362E-02 ppm1      9.096 ppm2      2.704 CV     1
 ASSI {  470}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 94   and name HB1 ))
      2.900     1.100     1.100 peak   470 spectrum    1 weight  0.11000E+01 volume  0.21584E-02 ppm1      9.097 ppm2      2.801 CV     1
 ASSI {  472}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 100  and name HA  ))
      2.800     1.000     1.000 peak   472 spectrum    1 weight  0.11000E+01 volume  0.25760E-02 ppm1      7.201 ppm2      4.611 CV     1
 ASSI {  474}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 100  and name HB2 ))
      2.500     0.800     0.800 peak   474 spectrum    1 weight  0.11000E+01 volume  0.62250E-02 ppm1      7.200 ppm2      2.388 CV     1
 ASSI {  475}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 100  and name HB1 ))
      2.300     0.700     0.700 peak   475 spectrum    1 weight  0.11000E+01 volume  0.40966E-02 ppm1      7.202 ppm2      2.567 CV     1
 ASSI {  477}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 106  and name HA  ))
      2.400     0.700     0.700 peak   477 spectrum    1 weight  0.11000E+01 volume  0.77156E-02 ppm1      7.651 ppm2      4.370 CV     1
 ASSI {  479}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 107  and name HB2 ))
      2.500     0.800     0.800 peak   479 spectrum    1 weight  0.11000E+01 volume  0.38209E-02 ppm1      7.650 ppm2      2.265 CV     1
 ASSI {  480}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 107  and name HB1 ))
      3.700     1.700     1.700 peak   480 spectrum    1 weight  0.11000E+01 volume  0.20186E-02 ppm1      7.649 ppm2      2.548 CV     1
 ASSI {  482}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 117  and name HA  ))
      2.600     0.800     0.800 peak   482 spectrum    1 weight  0.11000E+01 volume  0.31330E-02 ppm1      8.159 ppm2      4.460 CV     1
 ASSI {  483}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 116  and name HA  ))
      2.000     0.500     0.500 peak   483 spectrum    1 weight  0.11000E+01 volume  0.10324E-01 ppm1      8.160 ppm2      5.340 CV     1
 ASSI {  484}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 117  and name HB2 ))
      2.100     0.600     0.600 peak   484 spectrum    1 weight  0.11000E+01 volume  0.45622E-02 ppm1      8.160 ppm2      2.469 CV     1
 ASSI {  485}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 117  and name HB1 ))
      3.100     1.200     1.200 peak   485 spectrum    1 weight  0.11000E+01 volume  0.49360E-02 ppm1      8.160 ppm2      2.969 CV     1
 ASSI {  486}
   (( segid "    " and resid 149  and name HN  ))
   (( segid "    " and resid 151  and name HN  ))
      2.500     2.500     3.500 peak   486 spectrum    1 weight  0.11000E+01 volume  0.53009E-01 ppm1      8.505 ppm2      8.509 CV     1
 ASSI {  487}
   (( segid "    " and resid 149  and name HN  ))
   (( segid "    " and resid 148  and name HA  ))
      2.100     0.600     0.600 peak   487 spectrum    1 weight  0.11000E+01 volume  0.15686E-01 ppm1      8.505 ppm2      4.582 CV     1
 ASSI {  488}
   (( segid "    " and resid 149  and name HN  ))
   (( segid "    " and resid 149  and name HA  ))
      2.800     1.000     1.000 peak   488 spectrum    1 weight  0.11000E+01 volume  0.27266E-02 ppm1      8.504 ppm2      4.820 CV     1
 ASSI {  489}
   (( segid "    " and resid 149  and name HN  ))
   (( segid "    " and resid 149  and name HB2 ))
      2.600     0.800     0.800 peak   489 spectrum    1 weight  0.11000E+01 volume  0.74037E-02 ppm1      8.504 ppm2      2.498 CV     1
 ASSI {  490}
   (( segid "    " and resid 149  and name HN  ))
   (( segid "    " and resid 149  and name HB1 ))
      2.900     1.000     1.000 peak   490 spectrum    1 weight  0.11000E+01 volume  0.37512E-02 ppm1      8.503 ppm2      2.720 CV     1
 ASSI {  494}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 64   and name HG2 ))
      2.100     0.500     0.500 peak   494 spectrum    1 weight  0.11000E+01 volume  0.50775E-02 ppm1      8.060 ppm2      2.180 CV     1
 OR {  494}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 64   and name HB1 ))
 ASSI {  495}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 64   and name HB2 ))
      3.100     1.200     1.200 peak   495 spectrum    1 weight  0.11000E+01 volume  0.23843E-02 ppm1      8.060 ppm2      1.613 CV     1
 ASSI {  496}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 64   and name HG1 ))
      3.900     1.900     1.900 peak   496 spectrum    1 weight  0.11000E+01 volume  0.29417E-02 ppm1      8.059 ppm2      2.472 CV     1
 ASSI {  499}
   (( segid "    " and resid 64   and name HE21))
   (( segid "    " and resid 64   and name HE22))
      1.800     0.400     0.400 peak   499 spectrum    1 weight  0.11000E+01 volume  0.13264E-01 ppm1      6.331 ppm2      7.300 CV     1
 ASSI {  501}
   (( segid "    " and resid 64   and name HE22))
   (( segid "    " and resid 64   and name HG1 ))
      4.100     2.100     1.900 peak   501 spectrum    1 weight  0.11000E+01 volume  0.10422E-02 ppm1      7.290 ppm2      2.459 CV     1
 ASSI {  502}
   (( segid "    " and resid 64   and name HE21))
   (( segid "    " and resid 64   and name HG1 ))
      3.700     1.700     1.700 peak   502 spectrum    1 weight  0.11000E+01 volume  0.12090E-02 ppm1      6.332 ppm2      2.471 CV     1
 ASSI {  503}
   (( segid "    " and resid 64   and name HE21))
   (( segid "    " and resid 64   and name HG2 ))
      3.100     1.200     1.200 peak   503 spectrum    1 weight  0.11000E+01 volume  0.16063E-02 ppm1      6.329 ppm2      2.157 CV     1
 OR {  503}
   (( segid "    " and resid 64   and name HE21))
   (( segid "    " and resid 64   and name HB1 ))
 ASSI {  504}
   (( segid "    " and resid 64   and name HE22))
   (( segid "    " and resid 64   and name HG2 ))
      3.800     1.800     1.800 peak   504 spectrum    1 weight  0.11000E+01 volume  0.21293E-02 ppm1      7.294 ppm2      2.145 CV     1
 OR {  504}
   (( segid "    " and resid 64   and name HE22))
   (( segid "    " and resid 64   and name HB1 ))
 ASSI {  506}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 71   and name HA  ))
      2.600     0.900     0.900 peak   506 spectrum    1 weight  0.11000E+01 volume  0.25788E-02 ppm1      9.067 ppm2      5.034 CV     1
 ASSI {  507}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 70   and name HA  ))
      1.900     0.500     0.500 peak   507 spectrum    1 weight  0.11000E+01 volume  0.62975E-02 ppm1      9.068 ppm2      5.372 CV     1
 ASSI {  509}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 71   and name HB1 ))
      3.800     1.800     1.800 peak   509 spectrum    1 weight  0.11000E+01 volume  0.19267E-02 ppm1      9.065 ppm2      2.176 CV     1
 OR {  509}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 71   and name HG2 ))
 ASSI {  510}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 71   and name HB2 ))
      3.100     1.200     1.200 peak   510 spectrum    1 weight  0.11000E+01 volume  0.18519E-02 ppm1      9.063 ppm2      2.080 CV     1
 ASSI {  511}
   (( segid "    " and resid 71   and name HE21))
   (( segid "    " and resid 71   and name HE22))
      1.200     0.200     1.000 peak   511 spectrum    1 weight  0.11000E+01 volume  0.72658E-01 ppm1      7.478 ppm2      6.661 CV     1
 ASSI {  515}
   (( segid "    " and resid 71   and name HE22))
   (( segid "    " and resid 71   and name HB1 ))
      3.900     1.900     1.900 peak   515 spectrum    1 weight  0.11000E+01 volume  0.23232E-02 ppm1      6.656 ppm2      2.192 CV     1
 OR {  515}
   (( segid "    " and resid 71   and name HE22))
   (( segid "    " and resid 71   and name HG2 ))
 ASSI {  516}
   (( segid "    " and resid 71   and name HE22))
   (( segid "    " and resid 71   and name HG1 ))
      3.200     1.300     1.300 peak   516 spectrum    1 weight  0.11000E+01 volume  0.30959E-02 ppm1      6.660 ppm2      2.318 CV     1
 ASSI {  517}
   (( segid "    " and resid 71   and name HE21))
   (( segid "    " and resid 71   and name HG2 ))
      3.100     1.200     1.200 peak   517 spectrum    1 weight  0.11000E+01 volume  0.36582E-02 ppm1      7.478 ppm2      2.193 CV     1
 OR {  517}
   (( segid "    " and resid 71   and name HE21))
   (( segid "    " and resid 71   and name HB1 ))
 ASSI {  518}
   (( segid "    " and resid 71   and name HE21))
   (( segid "    " and resid 71   and name HG1 ))
      2.400     2.400     3.600 peak   518 spectrum    1 weight  0.11000E+01 volume  0.45039E-02 ppm1      7.478 ppm2      2.320 CV     1
 ASSI {  520}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 81   and name HA  ))
      3.000     1.100     1.100 peak   520 spectrum    1 weight  0.11000E+01 volume  0.19362E-02 ppm1      7.775 ppm2      4.673 CV     1
 ASSI {  522}
   (( segid "    " and resid 81   and name HE21))
   (( segid "    " and resid 81   and name HE22))
      1.300     0.200     0.900 peak   522 spectrum    1 weight  0.11000E+01 volume  0.60564E-01 ppm1      7.685 ppm2      6.706 CV     1
 ASSI {  526}
   (( segid "    " and resid 81   and name HE22))
   (( segid "    " and resid 81   and name HG2 ))
      3.400     1.500     1.500 peak   526 spectrum    1 weight  0.11000E+01 volume  0.28174E-02 ppm1      6.701 ppm2      2.176 CV     1
 ASSI {  527}
   (( segid "    " and resid 81   and name HE22))
   (( segid "    " and resid 81   and name HG1 ))
      3.600     1.600     1.600 peak   527 spectrum    1 weight  0.11000E+01 volume  0.28011E-02 ppm1      6.704 ppm2      2.379 CV     1
 ASSI {  528}
   (( segid "    " and resid 81   and name HE21))
   (( segid "    " and resid 81   and name HG2 ))
      2.200     0.600     0.600 peak   528 spectrum    1 weight  0.11000E+01 volume  0.42808E-02 ppm1      7.685 ppm2      2.172 CV     1
 ASSI {  529}
   (( segid "    " and resid 81   and name HE21))
   (( segid "    " and resid 81   and name HG1 ))
      2.600     0.900     0.900 peak   529 spectrum    1 weight  0.11000E+01 volume  0.54722E-02 ppm1      7.685 ppm2      2.382 CV     1
 ASSI {  533}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 96   and name HA  ))
      2.100     0.500     0.500 peak   533 spectrum    1 weight  0.11000E+01 volume  0.12998E-01 ppm1      9.050 ppm2      4.007 CV     1
 ASSI {  534}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 97   and name HB2 ))
      2.400     0.700     0.700 peak   534 spectrum    1 weight  0.11000E+01 volume  0.51117E-02 ppm1      9.050 ppm2      2.250 CV     1
 OR {  534}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 97   and name HB1 ))
 ASSI {  535}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 97   and name HG2 ))
      4.400     2.400     1.600 peak   535 spectrum    1 weight  0.11000E+01 volume  0.18797E-02 ppm1      9.048 ppm2      2.464 CV     1
 ASSI {  536}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 97   and name HG1 ))
      3.900     1.900     1.900 peak   536 spectrum    1 weight  0.11000E+01 volume  0.32053E-02 ppm1      9.051 ppm2      2.638 CV     1
 ASSI {  537}
   (( segid "    " and resid 97   and name HE21))
   (( segid "    " and resid 97   and name HE22))
      1.300     0.200     0.900 peak   537 spectrum    1 weight  0.11000E+01 volume  0.73767E-01 ppm1      7.742 ppm2      6.779 CV     1
 ASSI {  541}
   (( segid "    " and resid 97   and name HE21))
   (( segid "    " and resid 97   and name HG2 ))
      3.800     1.800     1.800 peak   541 spectrum    1 weight  0.11000E+01 volume  0.19763E-02 ppm1      7.744 ppm2      2.484 CV     1
 ASSI {  542}
   (( segid "    " and resid 97   and name HE21))
   (( segid "    " and resid 97   and name HG1 ))
      2.700     0.900     0.900 peak   542 spectrum    1 weight  0.11000E+01 volume  0.15430E-02 ppm1      7.746 ppm2      2.636 CV     1
 ASSI {  543}
   (( segid "    " and resid 97   and name HE22))
   (( segid "    " and resid 97   and name HG2 ))
      4.300     2.300     1.700 peak   543 spectrum    1 weight  0.11000E+01 volume  0.14897E-02 ppm1      6.776 ppm2      2.470 CV     1
 ASSI {  544}
   (( segid "    " and resid 97   and name HE22))
   (( segid "    " and resid 97   and name HG1 ))
      4.200     2.200     1.800 peak   544 spectrum    1 weight  0.11000E+01 volume  0.10599E-02 ppm1      6.769 ppm2      2.637 CV     1
 ASSI {  545}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 23   and name HA  ))
      2.600     0.900     0.900 peak   545 spectrum    1 weight  0.11000E+01 volume  0.82981E-02 ppm1      8.271 ppm2      4.449 CV     1
 ASSI {  547}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 24   and name HA  ))
      3.000     1.100     1.100 peak   547 spectrum    1 weight  0.11000E+01 volume  0.24282E-02 ppm1      8.271 ppm2      4.565 CV     1
 ASSI {  549}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 125  and name HA  ))
      2.800     1.000     1.000 peak   549 spectrum    1 weight  0.11000E+01 volume  0.42631E-02 ppm1      8.076 ppm2      4.139 CV     1
 ASSI {  550}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 124  and name HA  ))
      3.100     3.100     2.900 peak   550 spectrum    1 weight  0.11000E+01 volume  0.19693E-02 ppm1      8.078 ppm2      3.926 CV     1
 ASSI {  551}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 125  and name HB1 ))
      3.100     1.200     1.200 peak   551 spectrum    1 weight  0.11000E+01 volume  0.60845E-02 ppm1      8.077 ppm2      2.252 CV     1
 ASSI {  552}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 125  and name HB2 ))
      2.800     1.000     1.000 peak   552 spectrum    1 weight  0.11000E+01 volume  0.44275E-02 ppm1      8.076 ppm2      2.115 CV     1
 ASSI {  554}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 125  and name HG2 ))
      3.400     1.400     1.400 peak   554 spectrum    1 weight  0.11000E+01 volume  0.22389E-02 ppm1      8.075 ppm2      2.407 CV     1
 ASSI {  557}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 7    and name HB2 ))
      3.500     3.500     2.500 peak   557 spectrum    1 weight  0.11000E+01 volume  0.12528E-02 ppm1      8.415 ppm2      1.933 CV     1
 ASSI {  558}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 7    and name HB1 ))
      4.100     2.100     1.900 peak   558 spectrum    1 weight  0.11000E+01 volume  0.83869E-03 ppm1      8.420 ppm2      2.041 CV     1
 OR {  558}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 7    and name HG2 ))
 ASSI {  559}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 7    and name HG1 ))
      5.000     3.100     1.000 peak   559 spectrum    1 weight  0.11000E+01 volume  0.26233E-03 ppm1      8.419 ppm2      2.239 CV     1
 ASSI {  560}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 26   and name HB2 ))
      2.700     0.900     0.900 peak   560 spectrum    1 weight  0.11000E+01 volume  0.55091E-02 ppm1      8.399 ppm2      1.899 CV     1
 OR {  560}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 26   and name HB1 ))
 ASSI {  561}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 26   and name HG1 ))
      3.300     1.300     1.300 peak   561 spectrum    1 weight  0.11000E+01 volume  0.23878E-02 ppm1      8.401 ppm2      2.286 CV     1
 OR {  561}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 26   and name HG2 ))
 ASSI {  563}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 18   and name HA  ))
      3.300     1.400     1.400 peak   563 spectrum    1 weight  0.11000E+01 volume  0.15439E-02 ppm1      8.418 ppm2      4.204 CV     1
 ASSI {  566}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 10   and name HB2 ))
      3.200     1.300     1.300 peak   566 spectrum    1 weight  0.11000E+01 volume  0.24086E-02 ppm1      8.279 ppm2      1.954 CV     1
 ASSI {  567}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 10   and name HB1 ))
      3.300     1.300     1.300 peak   567 spectrum    1 weight  0.11000E+01 volume  0.21867E-02 ppm1      8.274 ppm2      2.029 CV     1
 ASSI {  568}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 10   and name HG2 ))
      4.100     2.100     1.900 peak   568 spectrum    1 weight  0.11000E+01 volume  0.79548E-03 ppm1      8.279 ppm2      2.242 CV     1
 OR {  568}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 10   and name HG1 ))
 ASSI {  570}
   (( segid "    " and resid 36   and name HE1 ))
   (( segid "    " and resid 36   and name HZ2 ))
      3.200     1.200     1.200 peak   570 spectrum    1 weight  0.11000E+01 volume  0.22667E-02 ppm1     10.075 ppm2      7.434 CV     1
 ASSI {  571}
   (( segid "    " and resid 36   and name HE1 ))
   (( segid "    " and resid 36   and name HZ3 ))
      4.600     2.600     1.400 peak   571 spectrum    1 weight  0.11000E+01 volume  0.42973E-03 ppm1     10.075 ppm2      6.970 CV     1
 ASSI {  572}
   (( segid "    " and resid 36   and name HE1 ))
   (( segid "    " and resid 36   and name HH2 ))
      5.000     3.200     1.000 peak   572 spectrum    1 weight  0.11000E+01 volume  0.47459E-03 ppm1     10.074 ppm2      7.027 CV     1
 ASSI {  573}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 36   and name HZ2 ))
      3.900     3.900     2.100 peak   573 spectrum    1 weight  0.11000E+01 volume  0.98627E-03 ppm1      8.271 ppm2      7.397 CV     1
 ASSI {  574}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 36   and name HZ3 ))
      4.500     2.500     1.500 peak   574 spectrum    1 weight  0.11000E+01 volume  0.56904E-03 ppm1      8.270 ppm2      6.980 CV     1
 OR {  574}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 36   and name HH2 ))
 ASSI {  575}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 36   and name HB2 ))
      2.700     0.900     0.900 peak   575 spectrum    1 weight  0.11000E+01 volume  0.26018E-02 ppm1      8.269 ppm2      2.853 CV     1
 ASSI {  577}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 119  and name HA  ))
      3.300     1.300     1.300 peak   577 spectrum    1 weight  0.11000E+01 volume  0.17867E-02 ppm1      7.592 ppm2      3.955 CV     1
 ASSI {  578}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 120  and name HA  ))
      2.900     1.100     1.100 peak   578 spectrum    1 weight  0.11000E+01 volume  0.25050E-02 ppm1      7.590 ppm2      4.698 CV     1
 ASSI {  580}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 120  and name HB2 ))
      2.400     0.700     0.700 peak   580 spectrum    1 weight  0.11000E+01 volume  0.35191E-02 ppm1      7.592 ppm2      2.545 CV     1
 ASSI {  581}
   (( segid "    " and resid 120  and name HN  ))
   (  segid "    " and resid 120  and name HD% )
      2.900     1.000     1.000 peak   581 spectrum    1 weight  0.11000E+01 volume  0.22037E-02 ppm1      7.589 ppm2      6.904 CV     1
 ASSI {  586}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 122  and name HB2 ))
      2.800     2.800     3.200 peak   586 spectrum    1 weight  0.11000E+01 volume  0.24363E-02 ppm1      9.379 ppm2      2.645 CV     1
 ASSI {  590}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 131  and name HA  ))
      3.000     1.100     1.100 peak   590 spectrum    1 weight  0.11000E+01 volume  0.19803E-02 ppm1      8.659 ppm2      4.393 CV     1
 ASSI {  591}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 130  and name HA  ))
      2.400     0.700     0.700 peak   591 spectrum    1 weight  0.11000E+01 volume  0.73529E-02 ppm1      8.660 ppm2      4.720 CV     1
 ASSI {  592}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 131  and name HB1 ))
      2.600     0.900     0.900 peak   592 spectrum    1 weight  0.11000E+01 volume  0.37479E-02 ppm1      8.660 ppm2      2.977 CV     1
 ASSI {  593}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 131  and name HB2 ))
      3.100     1.200     1.200 peak   593 spectrum    1 weight  0.11000E+01 volume  0.41306E-02 ppm1      8.659 ppm2      2.841 CV     1
 ASSI {  597}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 68   and name HA  ))
      2.300     0.700     0.700 peak   597 spectrum    1 weight  0.11000E+01 volume  0.51941E-02 ppm1      8.728 ppm2      5.587 CV     1
 ASSI {  601}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 87   and name HA  ))
      2.100     0.500     0.500 peak   601 spectrum    1 weight  0.11000E+01 volume  0.11297E-01 ppm1      8.891 ppm2      5.350 CV     1
 ASSI {  602}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 88   and name HA  ))
      2.800     1.000     1.000 peak   602 spectrum    1 weight  0.11000E+01 volume  0.28981E-02 ppm1      8.892 ppm2      4.959 CV     1
 ASSI {  603}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 88   and name HB1 ))
      3.300     1.300     1.300 peak   603 spectrum    1 weight  0.11000E+01 volume  0.18216E-02 ppm1      8.894 ppm2      3.123 CV     1
 OR {  603}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 88   and name HB2 ))
 ASSI {  605}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 88   and name HZ  ))
      4.300     2.300     1.700 peak   605 spectrum    1 weight  0.11000E+01 volume  0.64366E-03 ppm1      8.888 ppm2      6.845 CV     1
 ASSI {  607}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 19   and name HA  ))
      3.000     1.100     1.100 peak   607 spectrum    1 weight  0.11000E+01 volume  0.30912E-02 ppm1      8.102 ppm2      4.604 CV     1
 ASSI {  608}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 19   and name HB2 ))
      3.800     1.800     1.800 peak   608 spectrum    1 weight  0.11000E+01 volume  0.10394E-02 ppm1      8.097 ppm2      3.045 CV     1
 ASSI {  609}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 19   and name HB1 ))
      3.700     1.700     1.700 peak   609 spectrum    1 weight  0.11000E+01 volume  0.93997E-03 ppm1      8.099 ppm2      3.162 CV     1
 ASSI {  612}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 46   and name HA  ))
      2.200     0.600     0.600 peak   612 spectrum    1 weight  0.11000E+01 volume  0.85847E-02 ppm1      9.011 ppm2      5.923 CV     1
 ASSI {  613}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 47   and name HB1 ))
      2.400     0.700     0.700 peak   613 spectrum    1 weight  0.11000E+01 volume  0.61270E-02 ppm1      9.009 ppm2      1.768 CV     1
 OR {  613}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 47   and name HB2 ))
 ASSI {  614}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 47   and name HG1 ))
      3.800     3.800     2.200 peak   614 spectrum    1 weight  0.11000E+01 volume  0.15669E-02 ppm1      9.008 ppm2      1.342 CV     1
 OR {  614}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 47   and name HG2 ))
 ASSI {  615}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 47   and name HD2 ))
      5.200     3.400     0.800 peak   615 spectrum    1 weight  0.11000E+01 volume  0.65806E-03 ppm1      9.009 ppm2      1.460 CV     1
 ASSI {  617}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 47   and name HA  ))
      2.100     0.600     0.600 peak   617 spectrum    1 weight  0.11000E+01 volume  0.72252E-02 ppm1      9.520 ppm2      5.930 CV     1
 ASSI {  620}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 62   and name HA  ))
      2.500     0.800     0.800 peak   620 spectrum    1 weight  0.11000E+01 volume  0.38388E-02 ppm1      8.254 ppm2      3.594 CV     1
 ASSI {  621}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 61   and name HA  ))
      2.100     0.500     0.500 peak   621 spectrum    1 weight  0.11000E+01 volume  0.14310E-01 ppm1      8.254 ppm2      4.400 CV     1
 ASSI {  622}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 62   and name HB2 ))
      2.300     0.700     0.700 peak   622 spectrum    1 weight  0.11000E+01 volume  0.67173E-02 ppm1      8.254 ppm2      1.698 CV     1
 OR {  622}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 62   and name HD2 ))
 ASSI {  623}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 62   and name HD1 ))
      3.400     1.500     1.500 peak   623 spectrum    1 weight  0.11000E+01 volume  0.40279E-02 ppm1      8.254 ppm2      1.759 CV     1
 ASSI {  624}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 62   and name HG1 ))
      2.900     1.000     1.000 peak   624 spectrum    1 weight  0.11000E+01 volume  0.15978E-02 ppm1      8.254 ppm2      1.513 CV     1
 ASSI {  626}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 62   and name HE1 ))
      5.400     3.700     0.600 peak   626 spectrum    1 weight  0.11000E+01 volume  0.27791E-03 ppm1      8.253 ppm2      3.063 CV     1
 OR {  626}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 62   and name HE2 ))
 ASSI {  629}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 119  and name HB2 ))
      3.300     1.300     1.300 peak   629 spectrum    1 weight  0.11000E+01 volume  0.42694E-02 ppm1      9.140 ppm2      1.250 CV     1
 ASSI {  630}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 119  and name HB1 ))
      2.400     0.700     0.700 peak   630 spectrum    1 weight  0.11000E+01 volume  0.48333E-02 ppm1      9.139 ppm2      1.635 CV     1
 ASSI {  631}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 119  and name HD2 ))
      4.600     2.600     1.400 peak   631 spectrum    1 weight  0.11000E+01 volume  0.11466E-02 ppm1      9.137 ppm2      1.369 CV     1
 OR {  631}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 119  and name HD1 ))
 ASSI {  634}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 119  and name HE2 ))
      3.400     1.400     1.400 peak   634 spectrum    1 weight  0.11000E+01 volume  0.17688E-02 ppm1      9.142 ppm2      2.745 CV     1
 OR {  634}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 119  and name HE1 ))
 ASSI {  637}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 144  and name HA  ))
      2.400     0.700     0.700 peak   637 spectrum    1 weight  0.11000E+01 volume  0.33253E-02 ppm1      8.959 ppm2      4.639 CV     1
 ASSI {  638}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 145  and name HB2 ))
      3.300     1.400     1.400 peak   638 spectrum    1 weight  0.11000E+01 volume  0.26419E-02 ppm1      8.958 ppm2      1.669 CV     1
 OR {  638}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 145  and name HD2 ))
 ASSI {  640}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 145  and name HG1 ))
      3.000     1.100     1.100 peak   640 spectrum    1 weight  0.11000E+01 volume  0.18465E-02 ppm1      8.959 ppm2      1.564 CV     1
 ASSI {  641}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 145  and name HG2 ))
      2.600     0.800     0.800 peak   641 spectrum    1 weight  0.11000E+01 volume  0.14054E-02 ppm1      8.958 ppm2      1.410 CV     1
 ASSI {  642}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 145  and name HD2 ))
      4.400     4.400     1.600 peak   642 spectrum    1 weight  0.11000E+01 volume  0.68096E-03 ppm1      8.958 ppm2      1.764 CV     1
 ASSI {  644}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 46   and name HA  ))
      2.900     1.000     1.000 peak   644 spectrum    1 weight  0.11000E+01 volume  0.19588E-02 ppm1      8.815 ppm2      5.920 CV     1
 ASSI {  645}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 45   and name HA  ))
      2.100     0.600     0.600 peak   645 spectrum    1 weight  0.11000E+01 volume  0.82364E-02 ppm1      8.816 ppm2      5.212 CV     1
 ASSI {  646}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 46   and name HB2 ))
      2.700     0.900     0.900 peak   646 spectrum    1 weight  0.11000E+01 volume  0.26906E-02 ppm1      8.816 ppm2      1.761 CV     1
 OR {  646}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 46   and name HB1 ))
 ASSI {  647}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 46   and name HG2 ))
      3.300     1.400     1.400 peak   647 spectrum    1 weight  0.11000E+01 volume  0.21645E-02 ppm1      8.816 ppm2      1.323 CV     1
 OR {  647}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 46   and name HG1 ))
 ASSI {  648}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 46   and name HD2 ))
      5.100     3.300     0.900 peak   648 spectrum    1 weight  0.11000E+01 volume  0.61296E-03 ppm1      8.820 ppm2      2.743 CV     1
 OR {  648}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 46   and name HD1 ))
 ASSI {  649}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 46   and name HH21))
      5.700     4.000     0.300 peak   649 spectrum    1 weight  0.11000E+01 volume  0.19881E-03 ppm1      8.822 ppm2      7.052 CV     1
 OR {  649}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 46   and name HH22))
 OR {  649}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 46   and name HH11))
 ASSI {  650}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 46   and name HE  ))
      6.000     4.900     0.000 peak   650 spectrum    1 weight  0.11000E+01 volume  0.11404E-03 ppm1      8.819 ppm2      7.197 CV     1
 ASSI {  652}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 59   and name HA  ))
      2.700     0.900     0.900 peak   652 spectrum    1 weight  0.11000E+01 volume  0.35096E-02 ppm1      8.024 ppm2      5.192 CV     1
 ASSI {  653}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 58   and name HA  ))
      2.200     0.600     0.600 peak   653 spectrum    1 weight  0.11000E+01 volume  0.12042E-01 ppm1      8.022 ppm2      4.771 CV     1
 ASSI {  654}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 59   and name HG2 ))
      2.400     0.700     0.700 peak   654 spectrum    1 weight  0.11000E+01 volume  0.86284E-02 ppm1      8.022 ppm2      1.537 CV     1
 OR {  654}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 59   and name HB2 ))
 ASSI {  655}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 59   and name HB1 ))
      3.500     1.500     1.500 peak   655 spectrum    1 weight  0.11000E+01 volume  0.32311E-02 ppm1      8.020 ppm2      1.914 CV     1
 ASSI {  656}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 59   and name HG1 ))
      2.600     0.800     0.800 peak   656 spectrum    1 weight  0.11000E+01 volume  0.46605E-02 ppm1      8.022 ppm2      1.758 CV     1
 ASSI {  660}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 79   and name HA  ))
      2.900     1.000     1.000 peak   660 spectrum    1 weight  0.11000E+01 volume  0.17938E-02 ppm1      8.930 ppm2      4.485 CV     1
 ASSI {  661}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 78   and name HA  ))
      2.100     0.600     0.600 peak   661 spectrum    1 weight  0.11000E+01 volume  0.12895E-01 ppm1      8.931 ppm2      4.051 CV     1
 ASSI {  662}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 79   and name HG1 ))
      3.100     1.200     1.200 peak   662 spectrum    1 weight  0.11000E+01 volume  0.17232E-02 ppm1      8.929 ppm2      1.689 CV     1
 OR {  662}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 79   and name HG2 ))
 ASSI {  663}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 79   and name HB2 ))
      2.400     0.700     0.700 peak   663 spectrum    1 weight  0.11000E+01 volume  0.70826E-02 ppm1      8.932 ppm2      1.875 CV     1
 OR {  663}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 79   and name HB1 ))
 ASSI {  664}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 79   and name HD2 ))
      5.600     3.900     0.400 peak   664 spectrum    1 weight  0.11000E+01 volume  0.36338E-03 ppm1      8.930 ppm2      3.227 CV     1
 OR {  664}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 79   and name HD1 ))
 ASSI {  666}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 17   and name HA  ))
      3.600     3.600     2.400 peak   666 spectrum    1 weight  0.11000E+01 volume  0.11792E-02 ppm1      8.192 ppm2      4.291 CV     1
 ASSI {  667}
   (( segid "    " and resid 51   and name HN  ))
   (  segid "    " and resid 111  and name HG2%)
      4.400     2.400     1.600 peak   667 spectrum    1 weight  0.11000E+01 volume  0.15161E-02 ppm1      8.145 ppm2      1.175 CV     1
 ASSI {  668}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 50   and name HB2 ))
      2.600     0.800     0.800 peak   668 spectrum    1 weight  0.11000E+01 volume  0.27968E-02 ppm1      8.142 ppm2      1.442 CV     1
 ASSI {  669}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 50   and name HG  ))
      3.500     1.600     1.600 peak   669 spectrum    1 weight  0.11000E+01 volume  0.31040E-02 ppm1      8.143 ppm2      1.546 CV     1
 OR {  669}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 50   and name HB1 ))
 ASSI {  670}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 111  and name HB  ))
      2.900     1.100     1.100 peak   670 spectrum    1 weight  0.11000E+01 volume  0.38161E-02 ppm1      8.141 ppm2      3.768 CV     1
 ASSI {  672}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 110  and name HA  ))
      4.800     2.900     1.200 peak   672 spectrum    1 weight  0.11000E+01 volume  0.55959E-03 ppm1      8.143 ppm2      4.622 CV     1
 ASSI {  677}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 111  and name HN  ))
      2.800     1.000     1.000 peak   677 spectrum    1 weight  0.11000E+01 volume  0.27125E-02 ppm1      8.142 ppm2      8.992 CV     1
 ASSI {  678}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 50   and name HN  ))
      2.300     0.600     0.600 peak   678 spectrum    1 weight  0.11000E+01 volume  0.62507E-02 ppm1      8.141 ppm2      9.131 CV     1
 ASSI {  681}
   (( segid "    " and resid 61   and name HN  ))
   (  segid "    " and resid 147  and name HB% )
      4.700     4.700     1.300 peak   681 spectrum    1 weight  0.11000E+01 volume  0.72464E-03 ppm1      7.938 ppm2      1.119 CV     1
 ASSI {  682}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 64   and name HB2 ))
      3.100     1.200     1.200 peak   682 spectrum    1 weight  0.11000E+01 volume  0.39628E-02 ppm1      7.939 ppm2      1.618 CV     1
 ASSI {  683}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 64   and name HG2 ))
      2.800     1.000     1.000 peak   683 spectrum    1 weight  0.11000E+01 volume  0.21463E-02 ppm1      7.939 ppm2      2.166 CV     1
 ASSI {  686}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 60   and name HA  ))
      2.200     2.200     3.800 peak   686 spectrum    1 weight  0.11000E+01 volume  0.84991E-02 ppm1      7.940 ppm2      4.628 CV     1
 ASSI {  691}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 63   and name HN  ))
      6.000     5.000     0.000 peak   691 spectrum    1 weight  0.11000E+01 volume  0.25713E-03 ppm1      7.941 ppm2      8.749 CV     1
 ASSI {  692}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 64   and name HB2 ))
      3.100     1.200     1.200 peak   692 spectrum    1 weight  0.11000E+01 volume  0.37791E-02 ppm1      8.823 ppm2      1.613 CV     1
 ASSI {  693}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 64   and name HB1 ))
      3.300     1.300     1.300 peak   693 spectrum    1 weight  0.11000E+01 volume  0.25314E-02 ppm1      8.824 ppm2      2.175 CV     1
 OR {  693}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 64   and name HG2 ))
 ASSI {  696}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 147  and name HA  ))
      4.300     2.400     1.700 peak   696 spectrum    1 weight  0.11000E+01 volume  0.74612E-03 ppm1      8.822 ppm2      5.010 CV     1
 ASSI {  698}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 148  and name HN  ))
      2.800     1.000     1.000 peak   698 spectrum    1 weight  0.11000E+01 volume  0.31526E-02 ppm1      8.825 ppm2      8.728 CV     1
 ASSI {  702}
   (( segid "    " and resid 66   and name HN  ))
   (  segid "    " and resid 65   and name HG2%)
      3.000     1.100     1.100 peak   702 spectrum    1 weight  0.11000E+01 volume  0.30006E-02 ppm1      9.128 ppm2      0.468 CV     1
 ASSI {  703}
   (( segid "    " and resid 66   and name HN  ))
   (  segid "    " and resid 65   and name HG1%)
      4.100     2.100     1.900 peak   703 spectrum    1 weight  0.11000E+01 volume  0.21227E-02 ppm1      9.130 ppm2      0.853 CV     1
 ASSI {  705}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 64   and name HB1 ))
      4.800     2.900     1.200 peak   705 spectrum    1 weight  0.11000E+01 volume  0.45689E-03 ppm1      9.124 ppm2      2.183 CV     1
 ASSI {  706}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 87   and name HA  ))
      4.400     2.400     1.600 peak   706 spectrum    1 weight  0.11000E+01 volume  0.46279E-03 ppm1      9.135 ppm2      5.343 CV     1
 ASSI {  712}
   (( segid "    " and resid 68   and name HN  ))
   (  segid "    " and resid 87   and name HG2%)
      4.700     2.700     1.300 peak   712 spectrum    1 weight  0.11000E+01 volume  0.91472E-03 ppm1      9.584 ppm2      0.756 CV     1
 ASSI {  713}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 86   and name HB2 ))
      4.500     2.600     1.500 peak   713 spectrum    1 weight  0.11000E+01 volume  0.65593E-03 ppm1      9.577 ppm2      1.272 CV     1
 ASSI {  714}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 86   and name HB1 ))
      3.400     1.400     1.400 peak   714 spectrum    1 weight  0.11000E+01 volume  0.94850E-03 ppm1      9.577 ppm2      2.030 CV     1
 ASSI {  718}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 86   and name HN  ))
      2.600     0.800     0.800 peak   718 spectrum    1 weight  0.11000E+01 volume  0.21366E-02 ppm1      9.579 ppm2      8.809 CV     1
 ASSI {  721}
   (( segid "    " and resid 80   and name HN  ))
   (  segid "    " and resid 72   and name HG2%)
      4.100     2.100     1.900 peak   721 spectrum    1 weight  0.11000E+01 volume  0.50434E-03 ppm1      8.908 ppm2      1.171 CV     1
 ASSI {  723}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 79   and name HB1 ))
      3.300     1.400     1.400 peak   723 spectrum    1 weight  0.11000E+01 volume  0.19508E-02 ppm1      8.905 ppm2      1.873 CV     1
 OR {  723}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 79   and name HB2 ))
 ASSI {  724}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 79   and name HD1 ))
      2.400     2.400     3.600 peak   724 spectrum    1 weight  0.11000E+01 volume  0.53410E-03 ppm1      8.902 ppm2      3.231 CV     1
 OR {  724}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 79   and name HD2 ))
 ASSI {  727}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 74   and name HA  ))
      5.100     5.100     0.900 peak   727 spectrum    1 weight  0.11000E+01 volume  0.49088E-03 ppm1      8.906 ppm2      4.691 CV     1
 ASSI {  729}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 73   and name HA  ))
      2.900     1.100     1.100 peak   729 spectrum    1 weight  0.11000E+01 volume  0.38482E-02 ppm1      8.903 ppm2      5.521 CV     1
 ASSI {  730}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 81   and name HN  ))
      2.200     0.600     0.600 peak   730 spectrum    1 weight  0.11000E+01 volume  0.59032E-02 ppm1      8.903 ppm2      7.781 CV     1
 ASSI {  732}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 72   and name HN  ))
      4.100     2.100     1.900 peak   732 spectrum    1 weight  0.10000E+01 volume  0.62594E-03 ppm1      8.903 ppm2      9.147 CV     1
 ASSI {  735}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 86   and name HB2 ))
      4.600     2.700     1.400 peak   735 spectrum    1 weight  0.11000E+01 volume  0.93360E-03 ppm1      8.335 ppm2      1.270 CV     1
 ASSI {  737}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 86   and name HB1 ))
      3.800     1.800     1.800 peak   737 spectrum    1 weight  0.11000E+01 volume  0.13509E-02 ppm1      8.334 ppm2      2.016 CV     1
 ASSI {  739}
   (( segid "    " and resid 87   and name HN  ))
   (  segid "    " and resid 88   and name HD% )
      4.600     2.600     1.400 peak   739 spectrum    1 weight  0.11000E+01 volume  0.38652E-03 ppm1      8.333 ppm2      6.933 CV     1
 ASSI {  747}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 93   and name HB2 ))
      4.000     4.000     2.000 peak   747 spectrum    1 weight  0.11000E+01 volume  0.10542E-02 ppm1      6.761 ppm2      3.139 CV     1
 ASSI {  748}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 93   and name HB1 ))
      4.200     4.200     1.800 peak   748 spectrum    1 weight  0.11000E+01 volume  0.10351E-02 ppm1      6.764 ppm2      3.190 CV     1
 ASSI {  751}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 95   and name HN  ))
      2.400     0.700     0.700 peak   751 spectrum    1 weight  0.11000E+01 volume  0.59676E-02 ppm1      9.096 ppm2      6.766 CV     1
 ASSI {  753}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 104  and name HG2 ))
      5.100     3.300     0.900 peak   753 spectrum    1 weight  0.11000E+01 volume  0.45122E-03 ppm1      7.934 ppm2      1.769 CV     1
 ASSI {  754}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 104  and name HD2 ))
      2.400     0.700     0.700 peak   754 spectrum    1 weight  0.11000E+01 volume  0.20375E-02 ppm1      7.935 ppm2      3.105 CV     1
 ASSI {  755}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 104  and name HD1 ))
      3.200     1.200     1.200 peak   755 spectrum    1 weight  0.11000E+01 volume  0.33427E-02 ppm1      7.935 ppm2      3.626 CV     1
 ASSI {  763}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 103  and name HN  ))
      2.300     0.600     0.600 peak   763 spectrum    1 weight  0.11000E+01 volume  0.68994E-02 ppm1      7.166 ppm2      7.944 CV     1
 ASSI {  766}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 107  and name HB1 ))
      2.600     0.900     0.900 peak   766 spectrum    1 weight  0.11000E+01 volume  0.21949E-02 ppm1      8.466 ppm2      2.548 CV     1
 ASSI {  767}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 109  and name HA2 ))
      5.000     5.000     1.000 peak   767 spectrum    1 weight  0.11000E+01 volume  0.65098E-03 ppm1      8.467 ppm2      3.725 CV     1
 ASSI {  771}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 108  and name HN  ))
      2.800     1.000     1.000 peak   771 spectrum    1 weight  0.11000E+01 volume  0.23187E-02 ppm1      8.205 ppm2      8.472 CV     1
 ASSI {  773}
   (( segid "    " and resid 114  and name HN  ))
   (  segid "    " and resid 114  and name HG2%)
      2.900     1.000     1.000 peak   773 spectrum    1 weight  0.11000E+01 volume  0.22694E-02 ppm1      9.712 ppm2      0.901 CV     1
 OR {  773}
   (( segid "    " and resid 114  and name HN  ))
   (  segid "    " and resid 114  and name HG1%)
 ASSI {  777}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 115  and name HA  ))
      4.200     4.200     1.800 peak   777 spectrum    1 weight  0.11000E+01 volume  0.45783E-03 ppm1      9.703 ppm2      5.066 CV     1
 ASSI {  784}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 114  and name HN  ))
      3.000     1.100     1.100 peak   784 spectrum    1 weight  0.11000E+01 volume  0.20479E-02 ppm1      9.910 ppm2      9.717 CV     1
 ASSI {  788}
   (( segid "    " and resid 142  and name HN  ))
   (( segid "    " and resid 70   and name HB2 ))
      3.900     3.900     2.100 peak   788 spectrum    1 weight  0.11000E+01 volume  0.83255E-03 ppm1      9.359 ppm2      1.181 CV     1
 ASSI {  789}
   (( segid "    " and resid 142  and name HN  ))
   (( segid "    " and resid 112  and name HB1  ))
      4.800     4.800     1.200 peak   789 spectrum    1 weight  0.11000E+01 volume  0.34756E-03 ppm1      9.365 ppm2      1.524 CV     1
 ASSI {  797}
   (( segid "    " and resid 148  and name HN  ))
   (  segid "    " and resid 66   and name HG1%)
      3.600     1.600     1.600 peak   797 spectrum    1 weight  0.11000E+01 volume  0.11421E-02 ppm1      8.708 ppm2      0.672 CV     1
 ASSI {  798}
   (( segid "    " and resid 148  and name HN  ))
   (  segid "    " and resid 147  and name HB% )
      3.100     1.200     1.200 peak   798 spectrum    1 weight  0.11000E+01 volume  0.34530E-02 ppm1      8.706 ppm2      1.115 CV     1
 ASSI {  800}
   (( segid "    " and resid 148  and name HN  ))
   (( segid "    " and resid 65   and name HB  ))
      2.000     2.000     4.000 peak   800 spectrum    1 weight  0.11000E+01 volume  0.16132E-02 ppm1      8.705 ppm2      1.722 CV     1
 ASSI {  801}
   (( segid "    " and resid 148  and name HN  ))
   (( segid "    " and resid 146  and name HB  ))
      2.600     2.600     3.400 peak   801 spectrum    1 weight  0.10000E+01 volume  0.30247E-03 ppm1      8.702 ppm2      4.057 CV     1
 ASSI {  815}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 36   and name HA  ))
      2.700     0.900     0.900 peak   815 spectrum    1 weight  0.11000E+01 volume  0.77791E-02 ppm1      9.581 ppm2      4.678 CV     1
 ASSI {  820}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 37   and name HN  ))
      2.900     1.000     1.000 peak   820 spectrum    1 weight  0.11000E+01 volume  0.29647E-02 ppm1      9.010 ppm2      9.583 CV     1
 ASSI {  826}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 41   and name HN  ))
      2.400     0.700     0.700 peak   826 spectrum    1 weight  0.11000E+01 volume  0.44990E-02 ppm1      8.636 ppm2      7.565 CV     1
 ASSI {  832}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 46   and name HG2 ))
      4.500     2.500     1.500 peak   832 spectrum    1 weight  0.11000E+01 volume  0.56172E-03 ppm1      7.651 ppm2      1.335 CV     1
 ASSI {  834}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 42   and name HB1 ))
      6.000     4.500     0.000 peak   834 spectrum    1 weight  0.11000E+01 volume  0.32490E-03 ppm1      7.650 ppm2      3.311 CV     1
 ASSI {  835}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 43   and name HA2 ))
      3.100     1.200     1.200 peak   835 spectrum    1 weight  0.11000E+01 volume  0.14287E-02 ppm1      7.654 ppm2      3.470 CV     1
 ASSI {  840}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 45   and name HN  ))
      1.800     0.400     0.400 peak   840 spectrum    1 weight  0.11000E+01 volume  0.53807E-02 ppm1      7.652 ppm2      8.360 CV     1
 ASSI {  841}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 43   and name HN  ))
      2.300     0.700     0.700 peak   841 spectrum    1 weight  0.11000E+01 volume  0.29467E-02 ppm1      7.652 ppm2      9.883 CV     1
 ASSI {  842}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 117  and name HN  ))
      4.900     3.100     1.100 peak   842 spectrum    1 weight  0.10000E+01 volume  0.49183E-03 ppm1      7.657 ppm2      8.152 CV     1
 ASSI {  848}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 44   and name HN  ))
      4.700     2.700     1.300 peak   848 spectrum    1 weight  0.11000E+01 volume  0.12859E-02 ppm1      7.066 ppm2      7.664 CV     1
 ASSI {  849}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 44   and name HB1 ))
      4.400     2.400     1.600 peak   849 spectrum    1 weight  0.11000E+01 volume  0.86348E-03 ppm1      8.353 ppm2      1.947 CV     1
 ASSI {  851}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 44   and name HA  ))
      3.500     1.600     1.600 peak   851 spectrum    1 weight  0.11000E+01 volume  0.11440E-02 ppm1      8.350 ppm2      4.361 CV     1
 ASSI {  852}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 38   and name HA  ))
      3.700     1.700     1.700 peak   852 spectrum    1 weight  0.11000E+01 volume  0.82145E-03 ppm1      8.350 ppm2      4.744 CV     1
 ASSI {  853}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 46   and name HA  ))
      3.900     1.900     1.900 peak   853 spectrum    1 weight  0.11000E+01 volume  0.52843E-03 ppm1      8.356 ppm2      5.932 CV     1
 ASSI {  854}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 43   and name HA2 ))
      4.700     2.800     1.300 peak   854 spectrum    1 weight  0.11000E+01 volume  0.44107E-03 ppm1      8.355 ppm2      3.458 CV     1
 ASSI {  858}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 49   and name HB  ))
      3.700     1.700     1.700 peak   858 spectrum    1 weight  0.11000E+01 volume  0.10991E-02 ppm1      9.126 ppm2      3.812 CV     1
 ASSI {  859}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 49   and name HA  ))
      2.300     0.700     0.700 peak   859 spectrum    1 weight  0.11000E+01 volume  0.42407E-02 ppm1      9.128 ppm2      3.954 CV     1
 ASSI {  860}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 112  and name HA  ))
      2.300     0.700     0.700 peak   860 spectrum    1 weight  0.11000E+01 volume  0.33087E-02 ppm1      9.127 ppm2      5.169 CV     1
 ASSI {  864}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 83   and name HB1 ))
      3.400     1.400     1.400 peak   864 spectrum    1 weight  0.11000E+01 volume  0.67294E-03 ppm1      8.999 ppm2      2.073 CV     1
 ASSI {  866}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 83   and name HA  ))
      4.400     2.400     1.600 peak   866 spectrum    1 weight  0.11000E+01 volume  0.58108E-03 ppm1      9.001 ppm2      5.025 CV     1
 ASSI {  870}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 71   and name HG2 ))
      5.100     3.300     0.900 peak   870 spectrum    1 weight  0.11000E+01 volume  0.62830E-03 ppm1      9.005 ppm2      2.188 CV     1
 ASSI {  871}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 139  and name HB2 ))
      4.600     2.600     1.400 peak   871 spectrum    1 weight  0.11000E+01 volume  0.51048E-03 ppm1      8.640 ppm2      2.663 CV     1
 ASSI {  872}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 73   and name HB2 ))
      2.600     0.900     0.900 peak   872 spectrum    1 weight  0.11000E+01 volume  0.53358E-02 ppm1      8.639 ppm2      3.718 CV     1
 OR {  872}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 73   and name HB1 ))
 ASSI {  873}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 78   and name HB  ))
      3.600     1.600     1.600 peak   873 spectrum    1 weight  0.11000E+01 volume  0.15832E-02 ppm1      8.639 ppm2      4.051 CV     1
 OR {  873}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 78   and name HA  ))
 ASSI {  874}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 79   and name HA  ))
      3.800     1.800     1.800 peak   874 spectrum    1 weight  0.11000E+01 volume  0.11822E-02 ppm1      8.641 ppm2      4.478 CV     1
 ASSI {  875}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 73   and name HA  ))
      2.100     0.500     0.500 peak   875 spectrum    1 weight  0.11000E+01 volume  0.71756E-02 ppm1      8.640 ppm2      5.522 CV     1
 ASSI {  884}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 85   and name HA  ))
      2.000     0.500     0.500 peak   884 spectrum    1 weight  0.11000E+01 volume  0.87866E-02 ppm1      8.805 ppm2      4.391 CV     1
 ASSI {  889}
   (( segid "    " and resid 90   and name HN  ))
   (  segid "    " and resid 89   and name HG2%)
      3.200     1.300     1.300 peak   889 spectrum    1 weight  0.11000E+01 volume  0.30570E-02 ppm1      8.964 ppm2      0.972 CV     1
 ASSI {  891}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 65   and name HA  ))
      2.900     1.000     1.000 peak   891 spectrum    1 weight  0.11000E+01 volume  0.21005E-02 ppm1      8.965 ppm2      4.263 CV     1
 ASSI {  892}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 89   and name HA  ))
      2.300     0.600     0.600 peak   892 spectrum    1 weight  0.11000E+01 volume  0.72573E-02 ppm1      8.965 ppm2      4.576 CV     1
 ASSI {  900}
   (( segid "    " and resid 99   and name HN  ))
   (  segid "    " and resid 98   and name HB% )
      2.600     0.900     0.900 peak   900 spectrum    1 weight  0.11000E+01 volume  0.33977E-02 ppm1      7.253 ppm2      1.132 CV     1
 ASSI {  903}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 97   and name HA  ))
      4.100     2.100     1.900 peak   903 spectrum    1 weight  0.11000E+01 volume  0.65404E-03 ppm1      7.248 ppm2      4.013 CV     1
 ASSI {  908}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 99   and name HN  ))
      3.000     1.100     1.100 peak   908 spectrum    1 weight  0.11000E+01 volume  0.20091E-02 ppm1      8.966 ppm2      7.256 CV     1
 ASSI {  909}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 99   and name HN  ))
      3.000     1.100     1.100 peak   909 spectrum    1 weight  0.11000E+01 volume  0.33595E-02 ppm1      8.225 ppm2      7.248 CV     1
 ASSI {  912}
   (( segid "    " and resid 101  and name HN  ))
   (  segid "    " and resid 39   and name HD1%)
      3.800     1.800     1.800 peak   912 spectrum    1 weight  0.11000E+01 volume  0.21454E-02 ppm1      8.225 ppm2      0.817 CV     1
 OR {  912}
   (( segid "    " and resid 101  and name HN  ))
   (  segid "    " and resid 39   and name HG2%)
 ASSI {  913}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 101  and name HG  ))
      2.500     0.800     0.800 peak   913 spectrum    1 weight  0.11000E+01 volume  0.41552E-02 ppm1      8.224 ppm2      1.791 CV     1
 ASSI {  915}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 100  and name HB1 ))
      2.700     0.900     0.900 peak   915 spectrum    1 weight  0.11000E+01 volume  0.20532E-02 ppm1      8.222 ppm2      2.569 CV     1
 ASSI {  916}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 102  and name HB1 ))
      5.300     3.600     0.700 peak   916 spectrum    1 weight  0.11000E+01 volume  0.35867E-03 ppm1      8.222 ppm2      3.582 CV     1
 OR {  916}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 102  and name HB2 ))
 ASSI {  917}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 98   and name HA  ))
      3.700     1.700     1.700 peak   917 spectrum    1 weight  0.11000E+01 volume  0.58321E-03 ppm1      8.226 ppm2      3.829 CV     1
 ASSI {  921}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 101  and name HN  ))
      2.400     0.700     0.700 peak   921 spectrum    1 weight  0.11000E+01 volume  0.50675E-02 ppm1      7.167 ppm2      8.225 CV     1
 ASSI {  922}
   (( segid "    " and resid 105  and name HN  ))
   (  segid "    " and resid 39   and name HD1%)
      4.600     2.600     1.400 peak   922 spectrum    1 weight  0.11000E+01 volume  0.85805E-03 ppm1      7.382 ppm2      0.749 CV     1
 ASSI {  924}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 104  and name HB1 ))
      4.200     2.200     1.800 peak   924 spectrum    1 weight  0.11000E+01 volume  0.88969E-03 ppm1      7.381 ppm2      2.447 CV     1
 ASSI {  933}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 105  and name HN  ))
      2.300     0.600     0.600 peak   933 spectrum    1 weight  0.11000E+01 volume  0.77435E-02 ppm1      7.863 ppm2      7.385 CV     1
 ASSI {  934}
   (( segid "    " and resid 138  and name HN  ))
   (( segid "    " and resid 137  and name HA  ))
      2.300     0.600     0.600 peak   934 spectrum    1 weight  0.11000E+01 volume  0.59095E-02 ppm1      8.257 ppm2      4.632 CV     1
 ASSI {  937}
   (( segid "    " and resid 138  and name HN  ))
   (( segid "    " and resid 118  and name HB2 ))
      4.300     2.300     1.700 peak   937 spectrum    1 weight  0.10000E+01 volume  0.34166E-03 ppm1      8.256 ppm2      3.537 CV     1
 ASSI {  943}
   (( segid "    " and resid 140  and name HN  ))
   (  segid "    " and resid 138  and name HD2%)
      4.100     4.100     1.900 peak   943 spectrum    1 weight  0.11000E+01 volume  0.11627E-02 ppm1      9.911 ppm2      0.833 CV     1
 ASSI {  944}
   (( segid "    " and resid 140  and name HN  ))
   (  segid "    " and resid 138  and name HD1%)
      2.100     2.100     3.900 peak   944 spectrum    1 weight  0.11000E+01 volume  0.96902E-03 ppm1      9.910 ppm2      1.139 CV     1
 ASSI {  945}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 138  and name HB2 ))
      5.000     3.200     1.000 peak   945 spectrum    1 weight  0.11000E+01 volume  0.46822E-03 ppm1      9.913 ppm2      1.417 CV     1
 ASSI {  946}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 141  and name HB2 ))
      3.900     3.900     2.100 peak   946 spectrum    1 weight  0.11000E+01 volume  0.15168E-02 ppm1      9.909 ppm2      2.025 CV     1
 ASSI {  950}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 139  and name HA  ))
      2.100     0.600     0.600 peak   950 spectrum    1 weight  0.11000E+01 volume  0.99779E-02 ppm1      9.910 ppm2      5.077 CV     1
 ASSI {  959}
   (( segid "    " and resid 150  and name HN  ))
   (( segid "    " and resid 64   and name HG2 ))
      2.100     2.100     3.900 peak   959 spectrum    1 weight  0.11000E+01 volume  0.96171E-03 ppm1      8.696 ppm2      2.122 CV     1
 ASSI {  960}
   (( segid "    " and resid 150  and name HN  ))
   (( segid "    " and resid 149  and name HB2 ))
      3.600     1.600     1.600 peak   960 spectrum    1 weight  0.11000E+01 volume  0.24620E-02 ppm1      8.702 ppm2      2.492 CV     1
 ASSI {  961}
   (( segid "    " and resid 150  and name HN  ))
   (( segid "    " and resid 149  and name HB1 ))
      3.300     1.400     1.400 peak   961 spectrum    1 weight  0.11000E+01 volume  0.40152E-02 ppm1      8.700 ppm2      2.717 CV     1
 ASSI {  963}
   (( segid "    " and resid 150  and name HN  ))
   (( segid "    " and resid 148  and name HA  ))
      2.200     2.200     3.800 peak   963 spectrum    1 weight  0.11000E+01 volume  0.77447E-03 ppm1      8.700 ppm2      4.589 CV     1
 ASSI {  964}
   (( segid "    " and resid 150  and name HN  ))
   (( segid "    " and resid 149  and name HA  ))
      1.900     0.500     0.500 peak   964 spectrum    1 weight  0.11000E+01 volume  0.11865E-01 ppm1      8.704 ppm2      4.823 CV     1
 ASSI {  966}
   (( segid "    " and resid 150  and name HN  ))
   (( segid "    " and resid 151  and name HN  ))
      2.400     0.700     0.700 peak   966 spectrum    1 weight  0.11000E+01 volume  0.33595E-02 ppm1      8.702 ppm2      8.520 CV     1
 ASSI {  968}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 63   and name HN  ))
      2.300     0.700     0.700 peak   968 spectrum    1 weight  0.11000E+01 volume  0.38901E-02 ppm1      8.059 ppm2      8.739 CV     1
 ASSI {  974}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 49   and name HN  ))
      3.400     1.500     1.500 peak   974 spectrum    1 weight  0.11000E+01 volume  0.23359E-02 ppm1      9.521 ppm2      9.109 CV     1
 ASSI {  976}
   (( segid "    " and resid 67   and name HN  ))
   (  segid "    " and resid 66   and name HG1%)
      4.100     2.100     1.900 peak   976 spectrum    1 weight  0.11000E+01 volume  0.18802E-02 ppm1      7.827 ppm2      0.670 CV     1
 ASSI {  978}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 66   and name HB  ))
      2.700     0.900     0.900 peak   978 spectrum    1 weight  0.11000E+01 volume  0.39911E-02 ppm1      7.827 ppm2      1.679 CV     1
 ASSI {  979}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 144  and name HA  ))
      4.500     2.500     1.500 peak   979 spectrum    1 weight  0.10000E+01 volume  0.48026E-03 ppm1      7.829 ppm2      4.633 CV     1
 ASSI {  980}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 146  and name HN  ))
      2.700     0.900     0.900 peak   980 spectrum    1 weight  0.11000E+01 volume  0.35047E-02 ppm1      7.827 ppm2      7.368 CV     1
 ASSI {  986}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 81   and name HN  ))
      3.100     1.200     1.200 peak   986 spectrum    1 weight  0.11000E+01 volume  0.20543E-02 ppm1      9.113 ppm2      7.782 CV     1
 ASSI {  987}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 81   and name HB2 ))
      3.800     1.800     1.800 peak   987 spectrum    1 weight  0.11000E+01 volume  0.17542E-02 ppm1      9.112 ppm2      1.985 CV     1
 ASSI {  988}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 71   and name HB1 ))
      3.600     1.600     1.600 peak   988 spectrum    1 weight  0.11000E+01 volume  0.19349E-02 ppm1      9.114 ppm2      2.083 CV     1
 OR {  988}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 71   and name HB2 ))
 ASSI {  989}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 71   and name HG2 ))
      4.300     2.300     1.700 peak   989 spectrum    1 weight  0.11000E+01 volume  0.27571E-02 ppm1      9.115 ppm2      2.173 CV     1
 ASSI {  990}
   (( segid "    " and resid 72   and name HN  ))
   (  segid "    " and resid 70   and name HD1%)
      4.700     2.800     1.300 peak   990 spectrum    1 weight  0.11000E+01 volume  0.60092E-03 ppm1      9.114 ppm2      0.937 CV     1
 ASSI {  991}
   (( segid "    " and resid 72   and name HN  ))
   (  segid "    " and resid 80   and name HG2%)
      4.800     2.800     1.200 peak   991 spectrum    1 weight  0.11000E+01 volume  0.65782E-03 ppm1      9.118 ppm2      0.811 CV     1
 ASSI {  994}
   (( segid "    " and resid 81   and name HN  ))
   (  segid "    " and resid 80   and name HG1%)
      4.200     2.200     1.800 peak   994 spectrum    1 weight  0.11000E+01 volume  0.14474E-02 ppm1      7.770 ppm2      0.965 CV     1
 ASSI {  995}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 74   and name HG  ))
      4.200     2.200     1.800 peak   995 spectrum    1 weight  0.11000E+01 volume  0.11329E-02 ppm1      7.772 ppm2      1.702 CV     1
 ASSI {  996}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 74   and name HB2 ))
      2.000     2.000     4.000 peak   996 spectrum    1 weight  0.11000E+01 volume  0.50092E-02 ppm1      7.774 ppm2      1.967 CV     1
 ASSI {  997}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 77   and name HA1 ))
      3.100     1.200     1.200 peak   997 spectrum    1 weight  0.11000E+01 volume  0.34662E-02 ppm1      7.775 ppm2      4.386 CV     1
 ASSI {  998}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 79   and name HA  ))
      4.200     2.200     1.800 peak   998 spectrum    1 weight  0.11000E+01 volume  0.15442E-02 ppm1      7.777 ppm2      4.483 CV     1
 ASSI { 1000}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 82   and name HA  ))
      3.800     1.800     1.800 peak  1000 spectrum    1 weight  0.11000E+01 volume  0.83704E-03 ppm1      7.775 ppm2      5.027 CV     1
 ASSI { 1001}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 73   and name HA  ))
      4.400     2.500     1.600 peak  1001 spectrum    1 weight  0.11000E+01 volume  0.69726E-03 ppm1      7.774 ppm2      5.522 CV     1
 ASSI { 1002}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 77   and name HN  ))
      2.200     0.600     0.600 peak  1002 spectrum    1 weight  0.11000E+01 volume  0.57827E-02 ppm1      7.769 ppm2      8.203 CV     1
 ASSI { 1004}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 79   and name HA  ))
      3.500     1.500     1.500 peak  1004 spectrum    1 weight  0.11000E+01 volume  0.17912E-02 ppm1      7.776 ppm2      4.488 CV     1
 ASSI { 1006}
   (( segid "    " and resid 89   and name HN  ))
   (  segid "    " and resid 88   and name HD% )
      3.500     1.500     1.500 peak  1006 spectrum    1 weight  0.11000E+01 volume  0.17980E-02 ppm1      9.141 ppm2      6.941 CV     1
 ASSI { 1009}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 88   and name HB2 ))
      2.600     0.900     0.900 peak  1009 spectrum    1 weight  0.11000E+01 volume  0.69359E-02 ppm1      9.140 ppm2      3.121 CV     1
 OR { 1009}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 88   and name HB1 ))
 ASSI { 1013}
   (( segid "    " and resid 111  and name HN  ))
   (  segid "    " and resid 143  and name HG2%)
      3.500     3.500     2.500 peak  1013 spectrum    1 weight  0.11000E+01 volume  0.20871E-02 ppm1      8.981 ppm2      1.043 CV     1
 ASSI { 1014}
   (( segid "    " and resid 111  and name HN  ))
   (  segid "    " and resid 51   and name HG2%)
      4.300     2.300     1.700 peak  1014 spectrum    1 weight  0.11000E+01 volume  0.11690E-02 ppm1      8.980 ppm2      0.895 CV     1
 ASSI { 1015}
   (( segid "    " and resid 111  and name HN  ))
   (  segid "    " and resid 50   and name HD2%)
      5.600     5.600     0.400 peak  1015 spectrum    1 weight  0.11000E+01 volume  0.47932E-03 ppm1      8.980 ppm2      0.782 CV     1
 ASSI { 1016}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 110  and name HB2 ))
      2.700     2.700     3.300 peak  1016 spectrum    1 weight  0.11000E+01 volume  0.36074E-02 ppm1      8.980 ppm2      2.046 CV     1
 ASSI { 1019}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 110  and name HG2 ))
      3.100     1.200     1.200 peak  1019 spectrum    1 weight  0.11000E+01 volume  0.17633E-02 ppm1      8.981 ppm2      2.705 CV     1
 OR { 1019}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 110  and name HG1 ))
 ASSI { 1020}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 49   and name HA  ))
      4.600     2.600     1.400 peak  1020 spectrum    1 weight  0.10000E+01 volume  0.32608E-03 ppm1      8.976 ppm2      3.981 CV     1
 ASSI { 1021}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 51   and name HA  ))
      4.200     2.200     1.800 peak  1021 spectrum    1 weight  0.11000E+01 volume  0.81200E-03 ppm1      8.981 ppm2      4.498 CV     1
 ASSI { 1030}
   (( segid "    " and resid 115  and name HN  ))
   (  segid "    " and resid 114  and name HG1%)
      2.800     2.800     3.200 peak  1030 spectrum    1 weight  0.11000E+01 volume  0.34978E-02 ppm1      9.294 ppm2      0.859 CV     1
 ASSI { 1031}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 46   and name HG1 ))
      2.400     2.400     3.600 peak  1031 spectrum    1 weight  0.11000E+01 volume  0.52182E-03 ppm1      9.299 ppm2      1.352 CV     1
 ASSI { 1035}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 46   and name HH21))
      3.600     1.700     1.700 peak  1035 spectrum    1 weight  0.11000E+01 volume  0.13431E-02 ppm1      9.295 ppm2      7.002 CV     1
 OR { 1035}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 46   and name HH22))
 ASSI { 1040}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 47   and name HN  ))
      2.400     2.400     3.600 peak  1040 spectrum    1 weight  0.11000E+01 volume  0.50269E-03 ppm1      9.293 ppm2      9.014 CV     1
 ASSI { 1046}
   (( segid "    " and resid 143  and name HN  ))
   (  segid "    " and resid 142  and name HG2%)
      3.400     3.400     2.600 peak  1046 spectrum    1 weight  0.11000E+01 volume  0.34345E-02 ppm1      9.169 ppm2      0.838 CV     1
 ASSI { 1047}
   (( segid "    " and resid 143  and name HN  ))
   (  segid "    " and resid 142  and name HG1%)
      3.900     1.900     1.900 peak  1047 spectrum    1 weight  0.11000E+01 volume  0.19683E-02 ppm1      9.169 ppm2      0.936 CV     1
 ASSI { 1049}
   (( segid "    " and resid 143  and name HN  ))
   (( segid "    " and resid 142  and name HB  ))
      3.500     1.500     1.500 peak  1049 spectrum    1 weight  0.11000E+01 volume  0.11044E-02 ppm1      9.172 ppm2      1.936 CV     1
 ASSI { 1054}
   (( segid "    " and resid 143  and name HN  ))
   (( segid "    " and resid 69   and name HA  ))
      3.900     1.900     1.900 peak  1054 spectrum    1 weight  0.11000E+01 volume  0.12732E-02 ppm1      9.169 ppm2      5.371 CV     1
 ASSI { 1057}
   (( segid "    " and resid 143  and name HN  ))
   (( segid "    " and resid 69   and name HN  ))
      2.500     0.800     0.800 peak  1057 spectrum    1 weight  0.11000E+01 volume  0.32044E-02 ppm1      9.168 ppm2      8.735 CV     1
 ASSI { 1060}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 145  and name HN  ))
      2.300     0.600     0.600 peak  1060 spectrum    1 weight  0.11000E+01 volume  0.53120E-02 ppm1      7.361 ppm2      8.963 CV     1
 ASSI { 1063}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 67   and name HA  ))
      4.500     4.500     1.500 peak  1063 spectrum    1 weight  0.11000E+01 volume  0.41675E-03 ppm1      7.361 ppm2      5.283 CV     1
 ASSI { 1065}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 145  and name HB1 ))
      3.800     1.800     1.800 peak  1065 spectrum    1 weight  0.11000E+01 volume  0.22417E-02 ppm1      7.362 ppm2      1.863 CV     1
 ASSI { 1066}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 145  and name HB2 ))
      2.900     1.000     1.000 peak  1066 spectrum    1 weight  0.11000E+01 volume  0.40697E-02 ppm1      7.361 ppm2      1.671 CV     1
 ASSI { 1068}
   (( segid "    " and resid 146  and name HN  ))
   (  segid "    " and resid 144  and name HD1%)
      2.700     2.700     3.300 peak  1068 spectrum    1 weight  0.11000E+01 volume  0.32438E-02 ppm1      7.362 ppm2      0.873 CV     1
 ASSI { 1069}
   (( segid "    " and resid 146  and name HN  ))
   (  segid "    " and resid 66   and name HG2%)
      2.400     2.400     3.600 peak  1069 spectrum    1 weight  0.11000E+01 volume  0.47153E-03 ppm1      7.358 ppm2      0.046 CV     1
 ASSI { 1072}
   (( segid "    " and resid 116  and name HN  ))
   (  segid "    " and resid 140  and name HD2%)
      4.400     2.400     1.600 peak  1072 spectrum    1 weight  0.10000E+01 volume  0.28617E-03 ppm1      8.636 ppm2      0.696 CV     1
 ASSI { 1079}
   (( segid "    " and resid 112  and name HN  ))
   (  segid "    " and resid 143  and name HG2%)
      5.200     5.200     0.800 peak  1079 spectrum    1 weight  0.11000E+01 volume  0.56644E-03 ppm1      9.969 ppm2      1.036 CV     1
 ASSI { 1080}
   (( segid "    " and resid 112  and name HN  ))
   (  segid "    " and resid 111  and name HG2%)
      3.500     1.500     1.500 peak  1080 spectrum    1 weight  0.11000E+01 volume  0.22556E-02 ppm1      9.968 ppm2      1.178 CV     1
 ASSI { 1082}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 50   and name HB2 ))
      4.500     2.600     1.500 peak  1082 spectrum    1 weight  0.11000E+01 volume  0.58273E-03 ppm1      9.965 ppm2      1.425 CV     1
 ASSI { 1083}
   (( segid "    " and resid 112  and name HN  ))
   (  segid "    " and resid 106  and name HE% )
      3.000     1.200     1.200 peak  1083 spectrum    1 weight  0.11000E+01 volume  0.24594E-02 ppm1      9.967 ppm2      1.954 CV     1
 ASSI { 1085}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 51   and name HN  ))
      5.000     3.100     1.000 peak  1085 spectrum    1 weight  0.11000E+01 volume  0.26374E-03 ppm1      9.968 ppm2      8.148 CV     1
 ASSI { 1090}
   (( segid "    " and resid 98   and name HN  ))
   (  segid "    " and resid 96   and name HD1%)
      3.900     1.900     1.900 peak  1090 spectrum    1 weight  0.11000E+01 volume  0.15933E-02 ppm1      8.965 ppm2      0.746 CV     1
 ASSI { 1093}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 97   and name HB1 ))
      3.000     1.100     1.100 peak  1093 spectrum    1 weight  0.11000E+01 volume  0.24338E-02 ppm1      8.965 ppm2      2.256 CV     1
 OR { 1093}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 97   and name HB2 ))
 ASSI { 1100}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 101  and name HN  ))
      4.500     2.500     1.500 peak  1100 spectrum    1 weight  0.11000E+01 volume  0.34544E-03 ppm1      8.959 ppm2      8.221 CV     1
 ASSI { 1102}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 31   and name HG1 ))
      2.000     2.000     4.000 peak  1102 spectrum    1 weight  0.11000E+01 volume  0.12346E-02 ppm1      8.385 ppm2      1.901 CV     1
 ASSI { 1103}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 31   and name HB1 ))
      4.400     2.400     1.600 peak  1103 spectrum    1 weight  0.11000E+01 volume  0.11081E-02 ppm1      8.383 ppm2      2.272 CV     1
 ASSI { 1110}
   (( segid "    " and resid 136  and name HN  ))
   (  segid "    " and resid 132  and name HG2%)
      4.300     2.300     1.700 peak  1110 spectrum    1 weight  0.10000E+01 volume  0.68309E-03 ppm1      7.406 ppm2      0.909 CV     1
 ASSI { 1111}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 135  and name HB2 ))
      4.000     4.000     2.000 peak  1111 spectrum    1 weight  0.11000E+01 volume  0.75133E-03 ppm1      7.404 ppm2      3.285 CV     1
 OR { 1111}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 135  and name HB1 ))
 ASSI { 1112}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 118  and name HB1 ))
      2.700     2.700     3.300 peak  1112 spectrum    1 weight  0.11000E+01 volume  0.16821E-02 ppm1      7.407 ppm2      3.578 CV     1
 OR { 1112}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 118  and name HB2 ))
 ASSI { 1114}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 135  and name HN  ))
      3.000     1.100     1.100 peak  1114 spectrum    1 weight  0.11000E+01 volume  0.24457E-02 ppm1      7.405 ppm2      7.663 CV     1
 ASSI { 1119}
   (( segid "    " and resid 137  and name HN  ))
   (  segid "    " and resid 136  and name HB% )
      3.400     1.400     1.400 peak  1119 spectrum    1 weight  0.11000E+01 volume  0.26677E-02 ppm1      8.405 ppm2      1.250 CV     1
 ASSI { 1123}
   (( segid "    " and resid 147  and name HN  ))
   (  segid "    " and resid 148  and name HG1%)
      3.100     1.200     1.200 peak  1123 spectrum    1 weight  0.11000E+01 volume  0.35196E-02 ppm1      8.283 ppm2      0.837 CV     1
 OR { 1123}
   (( segid "    " and resid 147  and name HN  ))
   (  segid "    " and resid 148  and name HG2%)
 ASSI { 1124}
   (( segid "    " and resid 147  and name HN  ))
   (( segid "    " and resid 146  and name HB  ))
      3.000     1.100     1.100 peak  1124 spectrum    1 weight  0.11000E+01 volume  0.60878E-02 ppm1      8.282 ppm2      4.051 CV     1
 ASSI { 1128}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 31   and name HD1 ))
      2.200     2.200     3.800 peak  1128 spectrum    1 weight  0.11000E+01 volume  0.78721E-03 ppm1      8.386 ppm2      3.792 CV     1
 ASSI { 1129}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 31   and name HD2 ))
      2.200     2.200     3.800 peak  1129 spectrum    1 weight  0.11000E+01 volume  0.73314E-03 ppm1      8.388 ppm2      3.668 CV     1
 ASSI { 1130}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 31   and name HB2 ))
      3.800     1.800     1.800 peak  1130 spectrum    1 weight  0.11000E+01 volume  0.11409E-02 ppm1      8.388 ppm2      2.023 CV     1
 ASSI { 1132}
   (( segid "    " and resid 32   and name HN  ))
   (  segid "    " and resid 30   and name HB% )
      2.100     2.100     3.900 peak  1132 spectrum    1 weight  0.11000E+01 volume  0.95581E-03 ppm1      8.387 ppm2      1.475 CV     1
 ASSI { 1134}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 37   and name HG  ))
      3.400     1.400     1.400 peak  1134 spectrum    1 weight  0.11000E+01 volume  0.10977E-02 ppm1      8.295 ppm2      1.496 CV     1
 ASSI { 1141}
   (( segid "    " and resid 96   and name HN  ))
   (  segid "    " and resid 95   and name HG2%)
      2.400     2.400     3.600 peak  1141 spectrum    1 weight  0.11000E+01 volume  0.13558E-02 ppm1      7.637 ppm2      0.054 CV     1
 ASSI { 1142}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 95   and name HB  ))
      2.100     0.500     0.500 peak  1142 spectrum    1 weight  0.11000E+01 volume  0.47693E-02 ppm1      7.639 ppm2      1.796 CV     1
 ASSI { 1156}
   (( segid "    " and resid 127  and name HN  ))
   (( segid "    " and resid 132  and name HN  ))
      1.900     0.400     0.400 peak  1156 spectrum    1 weight  0.11000E+01 volume  0.41736E-02 ppm1      8.487 ppm2      7.861 CV     1
 ASSI { 1157}
   (( segid "    " and resid 132  and name HN  ))
   (  segid "    " and resid 122  and name HE% )
      5.500     5.500     0.500 peak  1157 spectrum    1 weight  0.11000E+01 volume  0.36386E-03 ppm1      7.849 ppm2      6.601 CV     1
 ASSI { 1158}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 132  and name HN  ))
      6.000     4.500     0.000 peak  1158 spectrum    1 weight  0.11000E+01 volume  0.41840E-03 ppm1      8.089 ppm2      7.840 CV     1
 ASSI { 1160}
   (( segid "    " and resid 36   and name HE1 ))
   (( segid "    " and resid 36   and name HE3 ))
      3.700     3.700     2.300 peak  1160 spectrum    1 weight  0.11000E+01 volume  0.11414E-02 ppm1     10.071 ppm2      7.162 CV     1
 ASSI { 1162}
   (( segid "    " and resid 36   and name HE1 ))
   (( segid "    " and resid 34   and name HB2 ))
      4.400     2.400     1.600 peak  1162 spectrum    1 weight  0.11000E+01 volume  0.44980E-03 ppm1     10.070 ppm2      1.958 CV     1
 ASSI { 1164}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 66   and name HN  ))
      2.600     0.900     0.900 peak  1164 spectrum    1 weight  0.11000E+01 volume  0.38877E-02 ppm1      8.891 ppm2      9.139 CV     1
 ASSI { 1167}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 66   and name HB  ))
      4.500     2.500     1.500 peak  1167 spectrum    1 weight  0.11000E+01 volume  0.54284E-03 ppm1      8.893 ppm2      1.698 CV     1
 ASSI { 1168}
   (( segid "    " and resid 88   and name HN  ))
   (  segid "    " and resid 87   and name HG1%)
      3.300     1.400     1.400 peak  1168 spectrum    1 weight  0.11000E+01 volume  0.21435E-02 ppm1      8.889 ppm2      0.966 CV     1
 ASSI { 1174}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 119  and name HN  ))
      2.500     0.800     0.800 peak  1174 spectrum    1 weight  0.11000E+01 volume  0.43186E-02 ppm1      7.591 ppm2      9.147 CV     1
 ASSI { 1176}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 121  and name HN  ))
      2.200     0.600     0.600 peak  1176 spectrum    1 weight  0.11000E+01 volume  0.94493E-02 ppm1      7.590 ppm2      7.722 CV     1
 ASSI { 1181}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 97   and name HB1 ))
      5.200     5.200     0.800 peak  1181 spectrum    1 weight  0.11000E+01 volume  0.15711E-02 ppm1      7.591 ppm2      2.333 CV     1
 OR { 1181}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 97   and name HB2 ))
 ASSI { 1183}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 119  and name HD2 ))
      5.200     3.400     0.800 peak  1183 spectrum    1 weight  0.11000E+01 volume  0.47790E-03 ppm1      7.591 ppm2      1.359 CV     1
 OR { 1183}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 119  and name HD1 ))
 ASSI { 1192}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 138  and name HG  ))
      5.900     4.300     0.100 peak  1192 spectrum    1 weight  0.11000E+01 volume  0.28878E-03 ppm1      9.377 ppm2      1.909 CV     1
 ASSI { 1193}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 125  and name HB2 ))
      5.500     3.700     0.500 peak  1193 spectrum    1 weight  0.11000E+01 volume  0.21392E-03 ppm1      9.378 ppm2      2.122 CV     1
 ASSI { 1195}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 121  and name HB1 ))
      2.600     0.800     0.800 peak  1195 spectrum    1 weight  0.11000E+01 volume  0.24318E-02 ppm1      9.379 ppm2      3.249 CV     1
 ASSI { 1197}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 118  and name HA  ))
      3.300     1.400     1.400 peak  1197 spectrum    1 weight  0.11000E+01 volume  0.99573E-03 ppm1      9.380 ppm2      3.936 CV     1
 ASSI { 1198}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 120  and name HA  ))
      5.200     5.200     0.800 peak  1198 spectrum    1 weight  0.11000E+01 volume  0.36386E-03 ppm1      9.382 ppm2      4.760 CV     1
 ASSI { 1202}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 122  and name HN  ))
      2.700     0.900     0.900 peak  1202 spectrum    1 weight  0.11000E+01 volume  0.26459E-02 ppm1      7.989 ppm2      9.382 CV     1
 ASSI { 1206}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 132  and name HG11))
      4.500     2.500     1.500 peak  1206 spectrum    1 weight  0.11000E+01 volume  0.57305E-03 ppm1      9.386 ppm2      0.997 CV     1
 ASSI { 1207}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 130  and name HB2 ))
      3.400     1.500     1.500 peak  1207 spectrum    1 weight  0.11000E+01 volume  0.24818E-02 ppm1      8.659 ppm2      1.745 CV     1
 ASSI { 1209}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 130  and name HD2 ))
      4.100     4.100     1.900 peak  1209 spectrum    1 weight  0.11000E+01 volume  0.48522E-03 ppm1      8.655 ppm2      3.453 CV     1
 ASSI { 1210}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 127  and name HA  ))
      3.700     3.700     2.300 peak  1210 spectrum    1 weight  0.11000E+01 volume  0.26315E-02 ppm1      8.660 ppm2      4.493 CV     1
 ASSI { 1214}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 142  and name HA  ))
      4.700     2.700     1.300 peak  1214 spectrum    1 weight  0.11000E+01 volume  0.86206E-03 ppm1      8.728 ppm2      5.053 CV     1
 ASSI { 1215}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 143  and name HB  ))
      2.900     1.100     1.100 peak  1215 spectrum    1 weight  0.11000E+01 volume  0.13239E-02 ppm1      8.727 ppm2      4.076 CV     1
 ASSI { 1216}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 68   and name HB  ))
      3.000     1.100     1.100 peak  1216 spectrum    1 weight  0.11000E+01 volume  0.22587E-02 ppm1      8.728 ppm2      2.212 CV     1
 ASSI { 1217}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 145  and name HG1 ))
      4.200     2.200     1.800 peak  1217 spectrum    1 weight  0.11000E+01 volume  0.58817E-03 ppm1      8.728 ppm2      1.562 CV     1
 ASSI { 1218}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 145  and name HG2 ))
      4.000     2.000     2.000 peak  1218 spectrum    1 weight  0.11000E+01 volume  0.35772E-03 ppm1      8.727 ppm2      1.443 CV     1
 ASSI { 1222}
   (( segid "    " and resid 64   and name HN  ))
   (  segid "    " and resid 90   and name HD2%)
      3.700     1.700     1.700 peak  1222 spectrum    1 weight  0.11000E+01 volume  0.11409E-02 ppm1      8.060 ppm2      0.753 CV     1
 ASSI { 1223}
   (( segid "    " and resid 64   and name HN  ))
   (  segid "    " and resid 61   and name HG1%)
      4.600     2.600     1.400 peak  1223 spectrum    1 weight  0.11000E+01 volume  0.76597E-03 ppm1      8.063 ppm2      0.959 CV     1
 ASSI { 1224}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 90   and name HB2 ))
      4.400     4.400     1.600 peak  1224 spectrum    1 weight  0.11000E+01 volume  0.73314E-03 ppm1      8.057 ppm2      1.423 CV     1
 ASSI { 1225}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 90   and name HB1 ))
      3.000     1.100     1.100 peak  1225 spectrum    1 weight  0.11000E+01 volume  0.14481E-02 ppm1      8.060 ppm2      1.948 CV     1
 ASSI { 1230}
   (( segid "    " and resid 64   and name HE22))
   (  segid "    " and resid 61   and name HG2%)
      2.600     2.600     3.400 peak  1230 spectrum    1 weight  0.11000E+01 volume  0.31994E-03 ppm1      7.296 ppm2      0.769 CV     1
 ASSI { 1232}
   (( segid "    " and resid 64   and name HE22))
   (( segid "    " and resid 64   and name HB2 ))
      5.700     4.000     0.300 peak  1232 spectrum    1 weight  0.11000E+01 volume  0.60800E-03 ppm1      7.287 ppm2      1.604 CV     1
 ASSI { 1233}
   (( segid "    " and resid 64   and name HE22))
   (( segid "    " and resid 64   and name HA  ))
      4.700     2.700     1.300 peak  1233 spectrum    1 weight  0.10000E+01 volume  0.61910E-03 ppm1      7.296 ppm2      4.456 CV     1
 ASSI { 1234}
   (( segid "    " and resid 64   and name HE22))
   (( segid "    " and resid 149  and name HA  ))
      4.100     2.100     1.900 peak  1234 spectrum    1 weight  0.11000E+01 volume  0.55913E-03 ppm1      7.299 ppm2      4.819 CV     1
 ASSI { 1236}
   (( segid "    " and resid 149  and name HN  ))
   (( segid "    " and resid 64   and name HE22))
      4.600     2.600     1.400 peak  1236 spectrum    1 weight  0.11000E+01 volume  0.10656E-02 ppm1      8.508 ppm2      7.299 CV     1
 ASSI { 1237}
   (( segid "    " and resid 64   and name HE21))
   (  segid "    " and resid 61   and name HG2%)
      2.500     2.500     3.500 peak  1237 spectrum    1 weight  0.11000E+01 volume  0.36716E-03 ppm1      6.330 ppm2      0.768 CV     1
 ASSI { 1241}
   (( segid "    " and resid 64   and name HE21))
   (( segid "    " and resid 149  and name HA  ))
      3.900     1.900     1.900 peak  1241 spectrum    1 weight  0.11000E+01 volume  0.30601E-03 ppm1      6.330 ppm2      4.849 CV     1
 ASSI { 1242}
   (( segid "    " and resid 64   and name HE21))
   (( segid "    " and resid 150  and name HN  ))
      3.900     1.900     1.900 peak  1242 spectrum    1 weight  0.11000E+01 volume  0.40848E-03 ppm1      6.332 ppm2      8.712 CV     1
 ASSI { 1246}
   (( segid "    " and resid 64   and name HE21))
   (( segid "    " and resid 64   and name HB2 ))
      5.000     3.100     1.000 peak  1246 spectrum    1 weight  0.11000E+01 volume  0.31191E-03 ppm1      6.324 ppm2      1.600 CV     1
 ASSI { 1247}
   (( segid "    " and resid 97   and name HN  ))
   (  segid "    " and resid 96   and name HG2%)
      4.200     2.200     1.800 peak  1247 spectrum    1 weight  0.11000E+01 volume  0.17763E-02 ppm1      9.051 ppm2      0.262 CV     1
 ASSI { 1248}
   (( segid "    " and resid 97   and name HN  ))
   (  segid "    " and resid 96   and name HD1%)
      5.300     3.500     0.700 peak  1248 spectrum    1 weight  0.11000E+01 volume  0.50104E-03 ppm1      9.048 ppm2      0.733 CV     1
 ASSI { 1251}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 96   and name HB  ))
      2.900     1.100     1.100 peak  1251 spectrum    1 weight  0.11000E+01 volume  0.31536E-02 ppm1      9.049 ppm2      2.096 CV     1
 ASSI { 1254}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 100  and name HN  ))
      4.300     2.300     1.700 peak  1254 spectrum    1 weight  0.10000E+01 volume  0.66585E-03 ppm1      9.051 ppm2      7.221 CV     1
 ASSI { 1260}
   (( segid "    " and resid 97   and name HE21))
   (( segid "    " and resid 97   and name HB2 ))
      4.100     2.100     1.900 peak  1260 spectrum    1 weight  0.11000E+01 volume  0.10439E-02 ppm1      7.740 ppm2      2.246 CV     1
 OR { 1260}
   (( segid "    " and resid 97   and name HE21))
   (( segid "    " and resid 97   and name HB1 ))
 ASSI { 1262}
   (( segid "    " and resid 97   and name HE22))
   (( segid "    " and resid 101  and name HN  ))
      6.000     4.600     0.000 peak  1262 spectrum    1 weight  0.10000E+01 volume  0.45405E-03 ppm1      6.778 ppm2      8.201 CV     1
 ASSI { 1263}
   (( segid "    " and resid 97   and name HE22))
   (( segid "    " and resid 94   and name HN  ))
      5.000     3.100     1.000 peak  1263 spectrum    1 weight  0.10000E+01 volume  0.42831E-03 ppm1      6.777 ppm2      9.099 CV     1
 ASSI { 1265}
   (( segid "    " and resid 97   and name HE22))
   (( segid "    " and resid 100  and name HN  ))
      6.000     5.300     0.000 peak  1265 spectrum    1 weight  0.10000E+01 volume  0.40825E-03 ppm1      6.775 ppm2      7.224 CV     1
 ASSI { 1268}
   (( segid "    " and resid 97   and name HE22))
   (( segid "    " and resid 101  and name HG  ))
      5.200     3.400     0.800 peak  1268 spectrum    1 weight  0.10000E+01 volume  0.46255E-03 ppm1      6.771 ppm2      1.828 CV     1
 ASSI { 1272}
   (( segid "    " and resid 97   and name HE21))
   (  segid "    " and resid 101  and name HD1%)
      4.400     2.400     1.600 peak  1272 spectrum    1 weight  0.11000E+01 volume  0.62948E-03 ppm1      7.748 ppm2      0.689 CV     1
 ASSI { 1273}
   (( segid "    " and resid 97   and name HE22))
   (( segid "    " and resid 97   and name HB2 ))
      5.700     4.100     0.300 peak  1273 spectrum    1 weight  0.11000E+01 volume  0.25713E-03 ppm1      6.772 ppm2      2.261 CV     1
 OR { 1273}
   (( segid "    " and resid 97   and name HE22))
   (( segid "    " and resid 97   and name HB1 ))
 ASSI { 1276}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 124  and name HB2 ))
      3.300     1.300     1.300 peak  1276 spectrum    1 weight  0.11000E+01 volume  0.14830E-02 ppm1      8.075 ppm2      1.895 CV     1
 ASSI { 1282}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 126  and name HN  ))
      2.300     0.700     0.700 peak  1282 spectrum    1 weight  0.11000E+01 volume  0.56007E-02 ppm1      8.077 ppm2      7.070 CV     1
 ASSI { 1284}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 127  and name HN  ))
      6.000     6.000     0.000 peak  1284 spectrum    1 weight  0.11000E+01 volume  0.33032E-03 ppm1      8.072 ppm2      8.521 CV     1
 ASSI { 1287}
   (( segid "    " and resid 125  and name HE21))
   (( segid "    " and resid 125  and name HE22))
      1.300     0.200     0.900 peak  1287 spectrum    1 weight  0.11000E+01 volume  0.98599E-01 ppm1      7.521 ppm2      6.837 CV     1
 ASSI { 1295}
   (( segid "    " and resid 125  and name HE21))
   (( segid "    " and resid 122  and name HA  ))
      3.200     3.200     2.800 peak  1295 spectrum    1 weight  0.11000E+01 volume  0.89819E-03 ppm1      7.519 ppm2      4.590 CV     1
 ASSI { 1297}
   (( segid "    " and resid 125  and name HE21))
   (( segid "    " and resid 124  and name HD2 ))
      3.500     3.500     2.500 peak  1297 spectrum    1 weight  0.11000E+01 volume  0.79878E-03 ppm1      7.519 ppm2      3.609 CV     1
 ASSI { 1302}
   (( segid "    " and resid 125  and name HE22))
   (( segid "    " and resid 125  and name HN  ))
      4.600     2.600     1.400 peak  1302 spectrum    1 weight  0.10000E+01 volume  0.11860E-02 ppm1      6.828 ppm2      8.095 CV     1
 ASSI { 1310}
   (( segid "    " and resid 125  and name HE22))
   (( segid "    " and resid 125  and name HG1 ))
      4.700     4.700     1.300 peak  1310 spectrum    1 weight  0.11000E+01 volume  0.60399E-03 ppm1      6.834 ppm2      2.508 CV     1
 ASSI { 1311}
   (( segid "    " and resid 125  and name HE21))
   (( segid "    " and resid 120  and name HA  ))
      3.100     1.200     1.200 peak  1311 spectrum    1 weight  0.10000E+01 volume  0.38232E-02 ppm1      7.523 ppm2      4.720 CV     1
 ASSI { 1313}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 141  and name HN  ))
      3.000     1.100     1.100 peak  1313 spectrum    1 weight  0.11000E+01 volume  0.27191E-02 ppm1      9.067 ppm2      9.183 CV     1
 ASSI { 1314}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 70   and name HB1 ))
      4.200     2.200     1.800 peak  1314 spectrum    1 weight  0.11000E+01 volume  0.14261E-02 ppm1      9.062 ppm2      1.933 CV     1
 ASSI { 1316}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 70   and name HB2 ))
      3.600     1.700     1.700 peak  1316 spectrum    1 weight  0.11000E+01 volume  0.10609E-02 ppm1      9.061 ppm2      1.227 CV     1
 ASSI { 1318}
   (( segid "    " and resid 71   and name HN  ))
   (  segid "    " and resid 70   and name HD2%)
      4.000     2.000     2.000 peak  1318 spectrum    1 weight  0.11000E+01 volume  0.92889E-03 ppm1      9.072 ppm2      0.825 CV     1
 ASSI { 1323}
   (( segid "    " and resid 71   and name HE21))
   (( segid "    " and resid 71   and name HN  ))
      2.200     0.600     0.600 peak  1323 spectrum    1 weight  0.11000E+01 volume  0.59289E-03 ppm1      7.479 ppm2      9.057 CV     1
 ASSI { 1324}
   (( segid "    " and resid 71   and name HE21))
   (( segid "    " and resid 69   and name HE1 ))
      5.100     3.300     0.900 peak  1324 spectrum    1 weight  0.11000E+01 volume  0.63964E-03 ppm1      7.479 ppm2      7.768 CV     1
 ASSI { 1328}
   (( segid "    " and resid 71   and name HE21))
   (( segid "    " and resid 113  and name HA  ))
      6.000     5.000     0.000 peak  1328 spectrum    1 weight  0.10000E+01 volume  0.25336E-03 ppm1      7.479 ppm2      5.518 CV     1
 ASSI { 1329}
   (( segid "    " and resid 71   and name HE21))
   (( segid "    " and resid 141  and name HA  ))
      5.200     3.400     0.800 peak  1329 spectrum    1 weight  0.10000E+01 volume  0.32443E-03 ppm1      7.478 ppm2      5.217 CV     1
 ASSI { 1330}
   (( segid "    " and resid 71   and name HE21))
   (( segid "    " and resid 72   and name HA  ))
      4.300     2.400     1.700 peak  1330 spectrum    1 weight  0.10000E+01 volume  0.37566E-03 ppm1      7.474 ppm2      4.916 CV     1
 ASSI { 1332}
   (( segid "    " and resid 71   and name HE21))
   (( segid "    " and resid 71   and name HB2 ))
      2.300     2.300     3.700 peak  1332 spectrum    1 weight  0.11000E+01 volume  0.17380E-02 ppm1      7.481 ppm2      2.021 CV     1
 ASSI { 1338}
   (( segid "    " and resid 71   and name HE22))
   (( segid "    " and resid 142  and name HN  ))
      4.600     2.700     1.400 peak  1338 spectrum    1 weight  0.10000E+01 volume  0.72252E-03 ppm1      6.661 ppm2      9.388 CV     1
 ASSI { 1344}
   (( segid "    " and resid 71   and name HE22))
   (( segid "    " and resid 141  and name HB2 ))
      3.200     1.300     1.300 peak  1344 spectrum    1 weight  0.10000E+01 volume  0.12085E-02 ppm1      6.663 ppm2      1.948 CV     1
 OR { 1344}
   (( segid "    " and resid 71   and name HE22))
   (( segid "    " and resid 141  and name HG2 ))
 ASSI { 1348}
   (( segid "    " and resid 75   and name HN  ))
   (  segid "    " and resid 74   and name HD2%)
      3.500     1.600     1.600 peak  1348 spectrum    1 weight  0.11000E+01 volume  0.26996E-02 ppm1      8.660 ppm2      0.840 CV     1
 ASSI { 1350}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 74   and name HG  ))
      4.400     2.500     1.600 peak  1350 spectrum    1 weight  0.11000E+01 volume  0.12509E-02 ppm1      8.658 ppm2      1.745 CV     1
 ASSI { 1354}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 139  and name HN  ))
      4.500     2.500     1.500 peak  1354 spectrum    1 weight  0.11000E+01 volume  0.51238E-03 ppm1      8.658 ppm2      8.839 CV     1
 ASSI { 1360}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 69   and name HD2 ))
      4.300     2.300     1.700 peak  1360 spectrum    1 weight  0.11000E+01 volume  0.45523E-03 ppm1      9.064 ppm2      6.916 CV     1
 ASSI { 1364}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 86   and name HN  ))
      3.300     1.400     1.400 peak  1364 spectrum    1 weight  0.11000E+01 volume  0.28993E-02 ppm1      8.309 ppm2      8.810 CV     1
 ASSI { 1369}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 69   and name HD2 ))
      5.300     3.500     0.700 peak  1369 spectrum    1 weight  0.10000E+01 volume  0.37283E-03 ppm1      9.184 ppm2      6.933 CV     1
 ASSI { 1371}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 71   and name HG1 ))
      2.400     2.400     3.600 peak  1371 spectrum    1 weight  0.11000E+01 volume  0.53221E-03 ppm1      9.188 ppm2      2.322 CV     1
 ASSI { 1372}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 140  and name HB2 ))
      3.300     1.300     1.300 peak  1372 spectrum    1 weight  0.11000E+01 volume  0.14483E-02 ppm1      9.189 ppm2      1.281 CV     1
 ASSI { 1374}
   (( segid "    " and resid 141  and name HN  ))
   (  segid "    " and resid 114  and name HG2%)
      4.100     4.100     1.900 peak  1374 spectrum    1 weight  0.11000E+01 volume  0.12724E-02 ppm1      9.188 ppm2      0.831 CV     1
 ASSI { 1385}
   (( segid "    " and resid 151  and name HN  ))
   (( segid "    " and resid 149  and name HB2 ))
      4.500     2.500     1.500 peak  1385 spectrum    1 weight  0.11000E+01 volume  0.99779E-03 ppm1      8.514 ppm2      2.499 CV     1
 ASSI { 1387}
   (( segid "    " and resid 151  and name HN  ))
   (( segid "    " and resid 150  and name HB2 ))
      3.200     1.300     1.300 peak  1387 spectrum    1 weight  0.11000E+01 volume  0.43500E-02 ppm1      8.515 ppm2      1.574 CV     1
 OR { 1387}
   (( segid "    " and resid 151  and name HN  ))
   (( segid "    " and resid 150  and name HB1 ))
 ASSI { 1388}
   (( segid "    " and resid 151  and name HN  ))
   (  segid "    " and resid 150  and name HD1%)
      1.900     1.900     4.100 peak  1388 spectrum    1 weight  0.11000E+01 volume  0.20927E-02 ppm1      8.519 ppm2      0.858 CV     1
 OR { 1388}
   (( segid "    " and resid 151  and name HN  ))
   (  segid "    " and resid 150  and name HD2%)
 ASSI { 1390}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 43   and name HN  ))
      2.300     0.700     0.700 peak  1390 spectrum    1 weight  0.11000E+01 volume  0.79453E-02 ppm1      7.068 ppm2      9.886 CV     1
 ASSI { 1391}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 41   and name HN  ))
      2.400     0.700     0.700 peak  1391 spectrum    1 weight  0.11000E+01 volume  0.36046E-02 ppm1      7.069 ppm2      7.566 CV     1
 ASSI { 1398}
   (( segid "    " and resid 42   and name HN  ))
   (  segid "    " and resid 40   and name HD2%)
      4.800     2.900     1.200 peak  1398 spectrum    1 weight  0.11000E+01 volume  0.59879E-03 ppm1      7.072 ppm2      0.576 CV     1
 ASSI { 1401}
   (( segid "    " and resid 42   and name HN  ))
   (  segid "    " and resid 40   and name HD1%)
      5.500     3.800     0.500 peak  1401 spectrum    1 weight  0.11000E+01 volume  0.30671E-03 ppm1      7.071 ppm2      0.808 CV     1
 ASSI { 1404}
   (( segid "    " and resid 42   and name HD22))
   (( segid "    " and resid 38   and name HA  ))
      3.700     3.700     2.300 peak  1404 spectrum    1 weight  0.11000E+01 volume  0.85120E-03 ppm1      7.848 ppm2      4.729 CV     1
 ASSI { 1405}
   (( segid "    " and resid 42   and name HD22))
   (( segid "    " and resid 44   and name HB1 ))
      6.000     4.700     0.000 peak  1405 spectrum    1 weight  0.11000E+01 volume  0.22738E-03 ppm1      7.856 ppm2      1.970 CV     1
 ASSI { 1406}
   (( segid "    " and resid 42   and name HD22))
   (( segid "    " and resid 44   and name HG  ))
      5.800     4.200     0.200 peak  1406 spectrum    1 weight  0.11000E+01 volume  0.28617E-03 ppm1      7.853 ppm2      1.579 CV     1
 ASSI { 1408}
   (( segid "    " and resid 42   and name HD22))
   (  segid "    " and resid 44   and name HD1%)
      4.900     3.000     1.100 peak  1408 spectrum    1 weight  0.11000E+01 volume  0.41108E-03 ppm1      7.852 ppm2      0.945 CV     1
 ASSI { 1409}
   (( segid "    " and resid 42   and name HD22))
   (  segid "    " and resid 45   and name HD2%)
      5.100     3.200     0.900 peak  1409 spectrum    1 weight  0.11000E+01 volume  0.21038E-03 ppm1      7.849 ppm2      0.520 CV     1
 ASSI { 1411}
   (( segid "    " and resid 42   and name HD21))
   (( segid "    " and resid 38   and name HA  ))
      3.300     3.300     2.700 peak  1411 spectrum    1 weight  0.11000E+01 volume  0.17348E-02 ppm1      6.492 ppm2      4.727 CV     1
 ASSI { 1412}
   (( segid "    " and resid 42   and name HD21))
   (( segid "    " and resid 44   and name HG  ))
      5.200     3.400     0.800 peak  1412 spectrum    1 weight  0.11000E+01 volume  0.64767E-03 ppm1      6.488 ppm2      1.577 CV     1
 ASSI { 1414}
   (( segid "    " and resid 42   and name HD21))
   (  segid "    " and resid 44   and name HD1%)
      4.000     2.000     2.000 peak  1414 spectrum    1 weight  0.11000E+01 volume  0.83491E-03 ppm1      6.489 ppm2      0.945 CV     1
 ASSI { 1415}
   (( segid "    " and resid 42   and name HD21))
   (  segid "    " and resid 40   and name HD2%)
      5.200     3.400     0.800 peak  1415 spectrum    1 weight  0.11000E+01 volume  0.57305E-03 ppm1      6.491 ppm2      0.591 CV     1
 ASSI { 1420}
   (( segid "    " and resid 76   and name HD22))
   (( segid "    " and resid 74   and name HA  ))
      5.000     3.200     1.000 peak  1420 spectrum    1 weight  0.11000E+01 volume  0.10935E-02 ppm1      7.643 ppm2      4.724 CV     1
 ASSI { 1421}
   (( segid "    " and resid 76   and name HD22))
   (( segid "    " and resid 76   and name HB1 ))
      5.100     3.200     0.900 peak  1421 spectrum    1 weight  0.11000E+01 volume  0.49278E-03 ppm1      7.638 ppm2      3.323 CV     1
 ASSI { 1422}
   (( segid "    " and resid 76   and name HD22))
   (( segid "    " and resid 76   and name HB2 ))
      4.800     2.900     1.200 peak  1422 spectrum    1 weight  0.11000E+01 volume  0.55511E-03 ppm1      7.638 ppm2      2.864 CV     1
 ASSI { 1424}
   (( segid "    " and resid 76   and name HD21))
   (( segid "    " and resid 74   and name HA  ))
      3.700     1.700     1.700 peak  1424 spectrum    1 weight  0.11000E+01 volume  0.20381E-02 ppm1      6.851 ppm2      4.726 CV     1
 ASSI { 1425}
   (( segid "    " and resid 76   and name HD21))
   (( segid "    " and resid 76   and name HA  ))
      4.400     4.400     1.600 peak  1425 spectrum    1 weight  0.11000E+01 volume  0.59313E-03 ppm1      6.851 ppm2      4.523 CV     1
 ASSI { 1427}
   (( segid "    " and resid 76   and name HD21))
   (( segid "    " and resid 76   and name HB1 ))
      4.100     2.100     1.900 peak  1427 spectrum    1 weight  0.11000E+01 volume  0.68214E-03 ppm1      6.846 ppm2      3.337 CV     1
 ASSI { 1428}
   (( segid "    " and resid 76   and name HD21))
   (( segid "    " and resid 76   and name HB2 ))
      3.500     1.500     1.500 peak  1428 spectrum    1 weight  0.11000E+01 volume  0.61319E-03 ppm1      6.852 ppm2      2.854 CV     1
 ASSI { 1437}
   (( segid "    " and resid 38   and name HN  ))
   (  segid "    " and resid 37   and name HD1%)
      3.900     1.900     1.900 peak  1437 spectrum    1 weight  0.11000E+01 volume  0.21992E-02 ppm1      8.982 ppm2      0.984 CV     1
 ASSI { 1445}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 93   and name HN  ))
      2.600     0.800     0.800 peak  1445 spectrum    1 weight  0.11000E+01 volume  0.39528E-02 ppm1      7.803 ppm2      8.955 CV     1
 ASSI { 1447}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 91   and name HN  ))
      2.400     0.700     0.700 peak  1447 spectrum    1 weight  0.11000E+01 volume  0.57226E-02 ppm1      7.803 ppm2     10.638 CV     1
 ASSI { 1458}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 94   and name HN  ))
      2.900     1.000     1.000 peak  1458 spectrum    1 weight  0.11000E+01 volume  0.25883E-02 ppm1      8.946 ppm2      9.097 CV     1
 ASSI { 1460}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 101  and name HN  ))
      2.600     0.900     0.900 peak  1460 spectrum    1 weight  0.11000E+01 volume  0.31462E-02 ppm1      7.200 ppm2      8.233 CV     1
 ASSI { 1461}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 103  and name HN  ))
      4.400     2.400     1.600 peak  1461 spectrum    1 weight  0.11000E+01 volume  0.41297E-03 ppm1      7.207 ppm2      7.955 CV     1
 ASSI { 1465}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 97   and name HA  ))
      3.300     1.400     1.400 peak  1465 spectrum    1 weight  0.11000E+01 volume  0.23267E-02 ppm1      7.200 ppm2      4.016 CV     1
 ASSI { 1467}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 99   and name HB1 ))
      2.700     0.900     0.900 peak  1467 spectrum    1 weight  0.11000E+01 volume  0.20813E-02 ppm1      7.202 ppm2      1.481 CV     1
 ASSI { 1468}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 101  and name HB2 ))
      4.500     4.500     1.500 peak  1468 spectrum    1 weight  0.11000E+01 volume  0.68144E-03 ppm1      7.200 ppm2      1.174 CV     1
 ASSI { 1470}
   (( segid "    " and resid 100  and name HN  ))
   (  segid "    " and resid 99   and name HD2%)
      4.300     2.300     1.700 peak  1470 spectrum    1 weight  0.11000E+01 volume  0.10132E-02 ppm1      7.199 ppm2      0.747 CV     1
 ASSI { 1478}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 59   and name HA  ))
      4.800     2.900     1.200 peak  1478 spectrum    1 weight  0.11000E+01 volume  0.49018E-03 ppm1      7.638 ppm2      5.190 CV     1
 ASSI { 1479}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 53   and name HA2 ))
      5.100     3.300     0.900 peak  1479 spectrum    1 weight  0.11000E+01 volume  0.54590E-03 ppm1      7.652 ppm2      3.426 CV     1
 ASSI { 1480}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 117  and name HB2 ))
      4.200     4.200     1.800 peak  1480 spectrum    1 weight  0.11000E+01 volume  0.18757E-02 ppm1      7.651 ppm2      2.422 CV     1
 ASSI { 1494}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 44   and name HB1 ))
      5.100     3.200     0.900 peak  1494 spectrum    1 weight  0.11000E+01 volume  0.57400E-03 ppm1      8.162 ppm2      1.955 CV     1
 ASSI { 1495}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 44   and name HB2 ))
      3.100     1.200     1.200 peak  1495 spectrum    1 weight  0.11000E+01 volume  0.11454E-02 ppm1      8.164 ppm2      1.677 CV     1
 ASSI { 1496}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 138  and name HB2 ))
      4.800     2.900     1.200 peak  1496 spectrum    1 weight  0.11000E+01 volume  0.35724E-03 ppm1      8.158 ppm2      1.430 CV     1
 ASSI { 1497}
   (( segid "    " and resid 117  and name HN  ))
   (  segid "    " and resid 116  and name HB% )
      3.200     1.300     1.300 peak  1497 spectrum    1 weight  0.11000E+01 volume  0.27784E-02 ppm1      8.160 ppm2      1.096 CV     1
 ASSI { 1498}
   (( segid "    " and resid 117  and name HN  ))
   (  segid "    " and resid 45   and name HD1%)
      4.100     2.100     1.900 peak  1498 spectrum    1 weight  0.11000E+01 volume  0.18783E-02 ppm1      8.161 ppm2      0.804 CV     1
 ASSI { 1503}
   (( segid "    " and resid 149  and name HN  ))
   (( segid "    " and resid 148  and name HB  ))
      3.000     1.200     1.200 peak  1503 spectrum    1 weight  0.11000E+01 volume  0.64453E-02 ppm1      8.505 ppm2      2.112 CV     1
 ASSI { 1504}
   (( segid "    " and resid 149  and name HN  ))
   (( segid "    " and resid 64   and name HB1 ))
      3.400     1.400     1.400 peak  1504 spectrum    1 weight  0.11000E+01 volume  0.98439E-03 ppm1      8.505 ppm2      2.208 CV     1
 ASSI { 1505}
   (( segid "    " and resid 149  and name HN  ))
   (( segid "    " and resid 150  and name HB1 ))
      4.500     2.500     1.500 peak  1505 spectrum    1 weight  0.11000E+01 volume  0.42690E-03 ppm1      8.503 ppm2      1.584 CV     1
 OR { 1505}
   (( segid "    " and resid 149  and name HN  ))
   (( segid "    " and resid 150  and name HB2 ))
 ASSI { 1506}
   (( segid "    " and resid 149  and name HN  ))
   (  segid "    " and resid 148  and name HG1%)
      3.600     1.600     1.600 peak  1506 spectrum    1 weight  0.11000E+01 volume  0.30790E-02 ppm1      8.506 ppm2      0.868 CV     1
 ASSI { 1511}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 38   and name HA  ))
      4.600     2.600     1.400 peak  1511 spectrum    1 weight  0.11000E+01 volume  0.92510E-03 ppm1      9.007 ppm2      4.739 CV     1
 ASSI { 1513}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 37   and name HB1 ))
      2.900     1.000     1.000 peak  1513 spectrum    1 weight  0.11000E+01 volume  0.18479E-02 ppm1      9.009 ppm2      1.906 CV     1
 ASSI { 1515}
   (( segid "    " and resid 47   and name HN  ))
   (  segid "    " and resid 39   and name HD1%)
      3.900     1.900     1.900 peak  1515 spectrum    1 weight  0.11000E+01 volume  0.10028E-02 ppm1      9.014 ppm2      0.743 CV     1
 ASSI { 1517}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 102  and name HN  ))
      4.200     2.300     1.800 peak  1517 spectrum    1 weight  0.10000E+01 volume  0.50010E-03 ppm1      7.379 ppm2      7.183 CV     1
 ASSI { 1519}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 20   and name HA  ))
      4.200     2.200     1.800 peak  1519 spectrum    1 weight  0.11000E+01 volume  0.40919E-03 ppm1      7.964 ppm2      4.255 CV     1
 ASSI { 1520}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 19   and name HA  ))
      2.800     1.000     1.000 peak  1520 spectrum    1 weight  0.11000E+01 volume  0.43053E-02 ppm1      7.965 ppm2      4.594 CV     1
 ASSI { 1521}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 20   and name HB1 ))
      3.300     1.300     1.300 peak  1521 spectrum    1 weight  0.11000E+01 volume  0.20655E-02 ppm1      7.966 ppm2      1.590 CV     1
 OR { 1521}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 20   and name HB2 ))
 ASSI { 1522}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 20   and name HG  ))
      4.200     2.200     1.800 peak  1522 spectrum    1 weight  0.11000E+01 volume  0.42997E-03 ppm1      7.966 ppm2      1.842 CV     1
 ASSI { 1524}
   (( segid "    " and resid 20   and name HN  ))
   (  segid "    " and resid 20   and name HD1%)
      5.400     3.600     0.600 peak  1524 spectrum    1 weight  0.11000E+01 volume  0.33954E-03 ppm1      7.972 ppm2      0.710 CV     1
 ASSI { 1525}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 19   and name HB1 ))
      4.200     2.200     1.800 peak  1525 spectrum    1 weight  0.11000E+01 volume  0.67057E-03 ppm1      7.968 ppm2      3.174 CV     1
 ASSI { 1529}
   (( segid "    " and resid 20   and name HN  ))
   (  segid "    " and resid 19   and name HD% )
      4.400     4.400     1.600 peak  1529 spectrum    1 weight  0.11000E+01 volume  0.36433E-03 ppm1      7.968 ppm2      7.304 CV     1
 ASSI { 1532}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 123  and name HN  ))
      3.100     1.200     1.200 peak  1532 spectrum    1 weight  0.11000E+01 volume  0.20105E-02 ppm1      7.718 ppm2      7.989 CV     1
 ASSI { 1535}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 19   and name HB2 ))
      4.800     2.900     1.200 peak  1535 spectrum    1 weight  0.11000E+01 volume  0.30152E-03 ppm1      7.957 ppm2      3.037 CV     1
 ASSI { 1539}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 20   and name HN  ))
      3.600     1.600     1.600 peak  1539 spectrum    1 weight  0.11000E+01 volume  0.11910E-02 ppm1      8.101 ppm2      7.961 CV     1
 ASSI { 1569}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 57   and name HB1 ))
      2.500     0.800     0.800 peak  1569 spectrum    1 weight  0.11000E+01 volume  0.36081E-02 ppm1      8.203 ppm2      4.040 CV     1
 ASSI { 1573}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 108  and name HB  ))
      2.500     0.800     0.800 peak  1573 spectrum    1 weight  0.11000E+01 volume  0.20963E-02 ppm1      8.205 ppm2      2.050 CV     1
 ASSI { 1574}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 59   and name HG2 ))
      4.600     2.600     1.400 peak  1574 spectrum    1 weight  0.11000E+01 volume  0.29703E-03 ppm1      8.207 ppm2      1.607 CV     1
 ASSI { 1581}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 58   and name HB2 ))
      3.300     1.400     1.400 peak  1581 spectrum    1 weight  0.11000E+01 volume  0.63093E-02 ppm1      8.023 ppm2      3.796 CV     1
 ASSI { 1585}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 60   and name HA  ))
      3.300     3.300     2.700 peak  1585 spectrum    1 weight  0.11000E+01 volume  0.18308E-02 ppm1      8.022 ppm2      4.652 CV     1
 ASSI { 1592}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 109  and name HA2 ))
      4.400     2.500     1.600 peak  1592 spectrum    1 weight  0.11000E+01 volume  0.10621E-02 ppm1      9.203 ppm2      3.736 CV     1
 ASSI { 1594}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 110  and name HG1 ))
      4.500     4.500     1.500 peak  1594 spectrum    1 weight  0.11000E+01 volume  0.73503E-03 ppm1      9.206 ppm2      2.698 CV     1
 ASSI { 1598}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 110  and name HB2 ))
      2.300     0.700     0.700 peak  1598 spectrum    1 weight  0.11000E+01 volume  0.31694E-02 ppm1      9.204 ppm2      2.021 CV     1
 ASSI { 1599}
   (( segid "    " and resid 53   and name HN  ))
   (  segid "    " and resid 51   and name HG1%)
      3.300     3.300     2.700 peak  1599 spectrum    1 weight  0.11000E+01 volume  0.13369E-02 ppm1      9.204 ppm2      1.032 CV     1
 ASSI { 1603}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 40   and name HB2 ))
      3.900     1.900     1.900 peak  1603 spectrum    1 weight  0.11000E+01 volume  0.11081E-02 ppm1      7.561 ppm2      1.600 CV     1
 ASSI { 1604}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 45   and name HB1 ))
      5.100     3.200     0.900 peak  1604 spectrum    1 weight  0.11000E+01 volume  0.50198E-03 ppm1      7.558 ppm2      1.702 CV     1
 ASSI { 1613}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 41   and name HN  ))
      4.500     2.500     1.500 peak  1613 spectrum    1 weight  0.11000E+01 volume  0.11964E-02 ppm1      9.877 ppm2      7.565 CV     1
 ASSI { 1615}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 43   and name HA1 ))
      5.700     5.700     0.300 peak  1615 spectrum    1 weight  0.11000E+01 volume  0.68190E-03 ppm1      7.561 ppm2      4.041 CV     1
 ASSI { 1616}
   (( segid "    " and resid 43   and name HN  ))
   (  segid "    " and resid 45   and name HD2%)
      6.000     6.000     0.000 peak  1616 spectrum    1 weight  0.11000E+01 volume  0.17520E-03 ppm1      9.880 ppm2      0.534 CV     1
 ASSI { 1617}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 45   and name HB2 ))
      6.000     6.000     0.000 peak  1617 spectrum    1 weight  0.11000E+01 volume  0.44579E-03 ppm1      9.881 ppm2      0.818 CV     1
 ASSI { 1620}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 41   and name HA2 ))
      3.900     1.900     1.900 peak  1620 spectrum    1 weight  0.11000E+01 volume  0.12342E-02 ppm1      9.876 ppm2      3.580 CV     1
 ASSI { 1626}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 90   and name HB1 ))
      2.400     0.700     0.700 peak  1626 spectrum    1 weight  0.11000E+01 volume  0.19158E-02 ppm1      8.736 ppm2      1.937 CV     1
 ASSI { 1629}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 62   and name HG1 ))
      4.400     2.500     1.600 peak  1629 spectrum    1 weight  0.11000E+01 volume  0.10613E-02 ppm1      8.735 ppm2      1.537 CV     1
 ASSI { 1632}
   (( segid "    " and resid 63   and name HN  ))
   (  segid "    " and resid 89   and name HG2%)
      3.600     1.600     1.600 peak  1632 spectrum    1 weight  0.11000E+01 volume  0.11162E-02 ppm1      8.737 ppm2      0.968 CV     1
 ASSI { 1636}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 139  and name HN  ))
      2.600     2.600     3.400 peak  1636 spectrum    1 weight  0.10000E+01 volume  0.29137E-03 ppm1      8.195 ppm2      8.840 CV     1
 ASSI { 1637}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 78   and name HB  ))
      4.600     2.600     1.400 peak  1637 spectrum    1 weight  0.11000E+01 volume  0.11636E-02 ppm1      8.198 ppm2      4.049 CV     1
 ASSI { 1640}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 74   and name HB2 ))
      3.600     1.600     1.600 peak  1640 spectrum    1 weight  0.11000E+01 volume  0.14124E-02 ppm1      8.195 ppm2      1.965 CV     1
 OR { 1640}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 74   and name HB1 ))
 ASSI { 1641}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 74   and name HG  ))
      6.000     4.400     0.000 peak  1641 spectrum    1 weight  0.11000E+01 volume  0.33316E-03 ppm1      8.197 ppm2      1.714 CV     1
 ASSI { 1648}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 62   and name HA  ))
      4.500     2.500     1.500 peak  1648 spectrum    1 weight  0.11000E+01 volume  0.28475E-03 ppm1     10.626 ppm2      3.596 CV     1
 ASSI { 1651}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 90   and name HG  ))
      3.600     1.600     1.600 peak  1651 spectrum    1 weight  0.11000E+01 volume  0.55605E-03 ppm1     10.629 ppm2      1.573 CV     1
 ASSI { 1656}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 110  and name HN  ))
      2.400     0.700     0.700 peak  1656 spectrum    1 weight  0.11000E+01 volume  0.44090E-02 ppm1      8.830 ppm2      8.482 CV     1
 ASSI { 1658}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 57   and name HB2 ))
      2.400     2.400     3.600 peak  1658 spectrum    1 weight  0.11000E+01 volume  0.51521E-03 ppm1      8.828 ppm2      3.981 CV     1
 ASSI { 1661}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 144  and name HB1 ))
      3.000     1.100     1.100 peak  1661 spectrum    1 weight  0.11000E+01 volume  0.14691E-02 ppm1      8.829 ppm2      2.351 CV     1
 ASSI { 1662}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 110  and name HB1 ))
      4.600     4.600     1.400 peak  1662 spectrum    1 weight  0.11000E+01 volume  0.67152E-03 ppm1      8.831 ppm2      2.264 CV     1
 ASSI { 1665}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 144  and name HG  ))
      3.000     1.100     1.100 peak  1665 spectrum    1 weight  0.11000E+01 volume  0.16479E-02 ppm1      8.827 ppm2      1.439 CV     1
 ASSI { 1668}
   (( segid "    " and resid 109  and name HN  ))
   (  segid "    " and resid 108  and name HG1%)
      3.100     1.200     1.200 peak  1668 spectrum    1 weight  0.11000E+01 volume  0.21432E-02 ppm1      8.830 ppm2      0.916 CV     1
 ASSI { 1669}
   (( segid "    " and resid 109  and name HN  ))
   (  segid "    " and resid 144  and name HD2%)
      3.300     1.400     1.400 peak  1669 spectrum    1 weight  0.11000E+01 volume  0.41554E-02 ppm1      8.829 ppm2      0.825 CV     1
 OR { 1669}
   (( segid "    " and resid 109  and name HN  ))
   (  segid "    " and resid 144  and name HD1%)
 ASSI { 1672}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 124  and name HD1 ))
      3.700     1.700     1.700 peak  1672 spectrum    1 weight  0.11000E+01 volume  0.18835E-02 ppm1      7.988 ppm2      3.934 CV     1
 ASSI { 1673}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 121  and name HB1 ))
      4.600     2.700     1.400 peak  1673 spectrum    1 weight  0.11000E+01 volume  0.86348E-03 ppm1      7.988 ppm2      3.254 CV     1
 ASSI { 1675}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 121  and name HB2 ))
      4.300     2.300     1.700 peak  1675 spectrum    1 weight  0.11000E+01 volume  0.84530E-03 ppm1      7.990 ppm2      2.645 CV     1
 ASSI { 1677}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 119  and name HG1 ))
      5.700     5.700     0.300 peak  1677 spectrum    1 weight  0.11000E+01 volume  0.23517E-03 ppm1      7.984 ppm2      0.926 CV     1
 ASSI { 1683}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 122  and name HA  ))
      3.600     1.600     1.600 peak  1683 spectrum    1 weight  0.11000E+01 volume  0.79004E-03 ppm1      7.065 ppm2      4.517 CV     1
 ASSI { 1688}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 125  and name HB1 ))
      3.900     1.900     1.900 peak  1688 spectrum    1 weight  0.11000E+01 volume  0.20589E-02 ppm1      7.066 ppm2      2.256 CV     1
 ASSI { 1699}
   (( segid "    " and resid 121  and name HN  ))
   (  segid "    " and resid 120  and name HD% )
      2.200     2.200     3.800 peak  1699 spectrum    1 weight  0.11000E+01 volume  0.72110E-03 ppm1      7.716 ppm2      6.913 CV     1
 ASSI { 1701}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 118  and name HB2 ))
      4.500     2.500     1.500 peak  1701 spectrum    1 weight  0.11000E+01 volume  0.60304E-03 ppm1      7.718 ppm2      3.551 CV     1
 OR { 1701}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 118  and name HB1 ))
 ASSI { 1704}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 73   and name HN  ))
      3.000     1.100     1.100 peak  1704 spectrum    1 weight  0.11000E+01 volume  0.19721E-02 ppm1      8.826 ppm2      9.185 CV     1
 ASSI { 1709}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 138  and name HG  ))
      3.000     1.100     1.100 peak  1709 spectrum    1 weight  0.11000E+01 volume  0.30606E-02 ppm1      8.828 ppm2      1.883 CV     1
 OR { 1709}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 138  and name HB1 ))
 ASSI { 1710}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 138  and name HB2 ))
      3.500     1.500     1.500 peak  1710 spectrum    1 weight  0.11000E+01 volume  0.37625E-02 ppm1      8.828 ppm2      1.401 CV     1
 ASSI { 1712}
   (( segid "    " and resid 139  and name HN  ))
   (  segid "    " and resid 138  and name HD2%)
      3.400     1.500     1.500 peak  1712 spectrum    1 weight  0.11000E+01 volume  0.29057E-02 ppm1      8.828 ppm2      0.845 CV     1
 ASSI { 1715}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 79   and name HH11))
      5.600     3.900     0.400 peak  1715 spectrum    1 weight  0.10000E+01 volume  0.19054E-03 ppm1      9.176 ppm2      6.817 CV     1
 OR { 1715}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 79   and name HH12))
 ASSI { 1717}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 140  and name HA  ))
      3.500     1.500     1.500 peak  1717 spectrum    1 weight  0.11000E+01 volume  0.16065E-02 ppm1      9.176 ppm2      5.279 CV     1
 ASSI { 1718}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 139  and name HA  ))
      4.600     2.700     1.400 peak  1718 spectrum    1 weight  0.11000E+01 volume  0.28995E-03 ppm1      9.175 ppm2      5.081 CV     1
 ASSI { 1724}
   (( segid "    " and resid 73   and name HN  ))
   (  segid "    " and resid 72   and name HG2%)
      2.700     0.900     0.900 peak  1724 spectrum    1 weight  0.11000E+01 volume  0.35096E-02 ppm1      9.175 ppm2      1.161 CV     1
 ASSI { 1726}
   (( segid "    " and resid 73   and name HN  ))
   (  segid "    " and resid 80   and name HG2%)
      4.100     4.100     1.900 peak  1726 spectrum    1 weight  0.11000E+01 volume  0.11015E-02 ppm1      9.174 ppm2      0.831 CV     1
 ASSI { 1727}
   (( segid "    " and resid 73   and name HN  ))
   (  segid "    " and resid 80   and name HG1%)
      4.000     4.000     2.000 peak  1727 spectrum    1 weight  0.11000E+01 volume  0.17718E-02 ppm1      9.175 ppm2      0.925 CV     1
 ASSI { 1735}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 99   and name HA  ))
      3.000     1.100     1.100 peak  1735 spectrum    1 weight  0.11000E+01 volume  0.18765E-02 ppm1      7.168 ppm2      4.180 CV     1
 ASSI { 1736}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 98   and name HA  ))
      3.800     1.800     1.800 peak  1736 spectrum    1 weight  0.11000E+01 volume  0.57541E-03 ppm1      7.164 ppm2      3.826 CV     1
 ASSI { 1738}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 100  and name HB2 ))
      2.400     2.400     3.600 peak  1738 spectrum    1 weight  0.11000E+01 volume  0.47506E-03 ppm1      7.162 ppm2      2.380 CV     1
 ASSI { 1740}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 104  and name HG2 ))
      4.200     2.200     1.800 peak  1740 spectrum    1 weight  0.11000E+01 volume  0.81177E-03 ppm1      7.160 ppm2      1.796 CV     1
 ASSI { 1741}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 101  and name HB1 ))
      3.700     1.700     1.700 peak  1741 spectrum    1 weight  0.11000E+01 volume  0.17222E-02 ppm1      7.161 ppm2      1.582 CV     1
 ASSI { 1742}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 47   and name HD2 ))
      5.300     3.500     0.700 peak  1742 spectrum    1 weight  0.10000E+01 volume  0.54354E-03 ppm1      7.161 ppm2      1.466 CV     1
 ASSI { 1745}
   (( segid "    " and resid 102  and name HN  ))
   (  segid "    " and resid 105  and name HD1%)
      4.300     2.300     1.700 peak  1745 spectrum    1 weight  0.11000E+01 volume  0.79217E-03 ppm1      7.161 ppm2      0.969 CV     1
 ASSI { 1747}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 119  and name HN  ))
      2.700     0.900     0.900 peak  1747 spectrum    1 weight  0.11000E+01 volume  0.22507E-02 ppm1      8.616 ppm2      9.146 CV     1
 ASSI { 1752}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 117  and name HA  ))
      2.200     0.600     0.600 peak  1752 spectrum    1 weight  0.11000E+01 volume  0.95796E-02 ppm1      8.616 ppm2      4.461 CV     1
 ASSI { 1753}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 121  and name HB1 ))
      5.600     4.000     0.400 peak  1753 spectrum    1 weight  0.11000E+01 volume  0.43139E-03 ppm1      8.618 ppm2      3.235 CV     1
 ASSI { 1754}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 117  and name HB1 ))
      3.200     1.300     1.300 peak  1754 spectrum    1 weight  0.11000E+01 volume  0.82381E-03 ppm1      8.615 ppm2      2.976 CV     1
 ASSI { 1755}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 117  and name HB2 ))
      4.600     2.600     1.400 peak  1755 spectrum    1 weight  0.11000E+01 volume  0.50954E-03 ppm1      8.613 ppm2      2.462 CV     1
 ASSI { 1756}
   (( segid "    " and resid 118  and name HN  ))
   (  segid "    " and resid 137  and name HB% )
      4.000     2.000     2.000 peak  1756 spectrum    1 weight  0.11000E+01 volume  0.21971E-02 ppm1      8.614 ppm2      1.440 CV     1
 ASSI { 1758}
   (( segid "    " and resid 127  and name HN  ))
   (( segid "    " and resid 132  and name HG12))
      4.600     2.600     1.400 peak  1758 spectrum    1 weight  0.11000E+01 volume  0.45995E-03 ppm1      8.481 ppm2      0.697 CV     1
 ASSI { 1759}
   (( segid "    " and resid 127  and name HN  ))
   (  segid "    " and resid 132  and name HG2%)
      4.400     2.400     1.600 peak  1759 spectrum    1 weight  0.11000E+01 volume  0.17111E-02 ppm1      8.488 ppm2      0.930 CV     1
 ASSI { 1760}
   (( segid "    " and resid 127  and name HN  ))
   (( segid "    " and resid 132  and name HB  ))
      3.100     1.200     1.200 peak  1760 spectrum    1 weight  0.11000E+01 volume  0.45606E-02 ppm1      8.488 ppm2      1.124 CV     1
 ASSI { 1771}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 103  and name HA  ))
      3.100     1.200     1.200 peak  1771 spectrum    1 weight  0.11000E+01 volume  0.15957E-02 ppm1      7.864 ppm2      3.962 CV     1
 ASSI { 1773}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 59   and name HD1 ))
      4.700     4.700     1.300 peak  1773 spectrum    1 weight  0.11000E+01 volume  0.52253E-03 ppm1      7.865 ppm2      3.162 CV     1
 ASSI { 1774}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 104  and name HB1 ))
      1.800     1.800     4.200 peak  1774 spectrum    1 weight  0.11000E+01 volume  0.26043E-02 ppm1      7.864 ppm2      2.457 CV     1
 ASSI { 1776}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 106  and name HB1 ))
      2.600     0.800     0.800 peak  1776 spectrum    1 weight  0.10000E+01 volume  0.24024E-02 ppm1      7.863 ppm2      2.158 CV     1
 ASSI { 1778}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 60   and name HG2 ))
      3.200     3.200     2.800 peak  1778 spectrum    1 weight  0.10000E+01 volume  0.26601E-02 ppm1      7.865 ppm2      1.856 CV     1
 ASSI { 1779}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 105  and name HB2 ))
      3.000     1.100     1.100 peak  1779 spectrum    1 weight  0.11000E+01 volume  0.19045E-02 ppm1      7.864 ppm2      1.676 CV     1
 ASSI { 1781}
   (( segid "    " and resid 106  and name HN  ))
   (  segid "    " and resid 103  and name HG2%)
      4.000     2.000     2.000 peak  1781 spectrum    1 weight  0.10000E+01 volume  0.71355E-03 ppm1      7.865 ppm2      0.994 CV     1
 ASSI { 1788}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 48   and name HN  ))
      2.900     1.000     1.000 peak  1788 spectrum    1 weight  0.11000E+01 volume  0.21572E-02 ppm1      9.103 ppm2      9.528 CV     1
 ASSI { 1791}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 112  and name HA  ))
      2.200     0.600     0.600 peak  1791 spectrum    1 weight  0.11000E+01 volume  0.57272E-02 ppm1      9.103 ppm2      5.169 CV     1
 ASSI { 1795}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 113  and name HB1 ))
      2.400     0.700     0.700 peak  1795 spectrum    1 weight  0.11000E+01 volume  0.31671E-02 ppm1      9.103 ppm2      1.997 CV     1
 ASSI { 1796}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 113  and name HB2 ))
      3.300     1.400     1.400 peak  1796 spectrum    1 weight  0.11000E+01 volume  0.22471E-02 ppm1      9.101 ppm2      1.909 CV     1
 ASSI { 1797}
   (( segid "    " and resid 113  and name HN  ))
   (  segid "    " and resid 112  and name HB% )
      2.800     1.000     1.000 peak  1797 spectrum    1 weight  0.11000E+01 volume  0.53861E-02 ppm1      9.102 ppm2      1.526 CV     1
 ASSI { 1799}
   (( segid "    " and resid 113  and name HN  ))
   (  segid "    " and resid 50   and name HD2%)
      3.600     1.600     1.600 peak  1799 spectrum    1 weight  0.11000E+01 volume  0.10651E-02 ppm1      9.104 ppm2      0.733 CV     1
 ASSI { 1804}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 61   and name HB  ))
      2.700     0.900     0.900 peak  1804 spectrum    1 weight  0.11000E+01 volume  0.60410E-02 ppm1      8.254 ppm2      1.971 CV     1
 ASSI { 1806}
   (( segid "    " and resid 62   and name HN  ))
   (  segid "    " and resid 61   and name HG1%)
      3.200     1.300     1.300 peak  1806 spectrum    1 weight  0.11000E+01 volume  0.28171E-02 ppm1      8.252 ppm2      0.922 CV     1
 ASSI { 1807}
   (( segid "    " and resid 62   and name HN  ))
   (  segid "    " and resid 61   and name HG2%)
      3.800     1.800     1.800 peak  1807 spectrum    1 weight  0.11000E+01 volume  0.15525E-02 ppm1      8.253 ppm2      0.791 CV     1
 ASSI { 1811}
   (( segid "    " and resid 62   and name HN  ))
   (  segid "    " and resid 90   and name HD2%)
      3.200     1.300     1.300 peak  1811 spectrum    1 weight  0.11000E+01 volume  0.17349E-02 ppm1      8.251 ppm2      0.755 CV     1
 ASSI { 1814}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 117  and name HB2 ))
      4.500     2.500     1.500 peak  1814 spectrum    1 weight  0.11000E+01 volume  0.12374E-02 ppm1      9.141 ppm2      2.467 CV     1
 ASSI { 1818}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 117  and name HA  ))
      4.100     2.100     1.900 peak  1818 spectrum    1 weight  0.11000E+01 volume  0.92959E-03 ppm1      9.135 ppm2      4.451 CV     1
 ASSI { 1819}
   (( segid "    " and resid 145  and name HN  ))
   (  segid "    " and resid 144  and name HD1%)
      3.100     3.100     2.900 peak  1819 spectrum    1 weight  0.11000E+01 volume  0.25754E-02 ppm1      8.958 ppm2      0.892 CV     1
 ASSI { 1823}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 68   and name HA  ))
      2.800     1.000     1.000 peak  1823 spectrum    1 weight  0.11000E+01 volume  0.27984E-02 ppm1      8.958 ppm2      5.586 CV     1
 ASSI { 1826}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 143  and name HN  ))
      2.600     2.600     3.400 peak  1826 spectrum    1 weight  0.10000E+01 volume  0.30766E-03 ppm1      8.957 ppm2      9.190 CV     1
 ASSI { 1830}
   (( segid "    " and resid 46   and name HN  ))
   (  segid "    " and resid 45   and name HD1%)
      2.900     1.100     1.100 peak  1830 spectrum    1 weight  0.11000E+01 volume  0.32572E-02 ppm1      8.816 ppm2      0.791 CV     1
 OR { 1830}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 45   and name HB2 ))
 ASSI { 1831}
   (( segid "    " and resid 46   and name HN  ))
   (  segid "    " and resid 116  and name HB% )
      4.300     2.300     1.700 peak  1831 spectrum    1 weight  0.11000E+01 volume  0.97352E-03 ppm1      8.814 ppm2      1.101 CV     1
 ASSI { 1833}
   (( segid "    " and resid 79   and name HN  ))
   (  segid "    " and resid 78   and name HG2%)
      3.200     1.300     1.300 peak  1833 spectrum    1 weight  0.11000E+01 volume  0.33267E-02 ppm1      8.931 ppm2      1.227 CV     1
 ASSI { 1837}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 36   and name HZ2 ))
      5.400     3.700     0.600 peak  1837 spectrum    1 weight  0.11000E+01 volume  0.20400E-03 ppm1      9.521 ppm2      7.440 CV     1
 ASSI { 1839}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 36   and name HZ3 ))
      3.600     1.600     1.600 peak  1839 spectrum    1 weight  0.11000E+01 volume  0.10760E-02 ppm1      9.520 ppm2      6.999 CV     1
 ASSI { 1842}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 48   and name HE2 ))
      5.100     3.300     0.900 peak  1842 spectrum    1 weight  0.11000E+01 volume  0.40707E-03 ppm1      9.519 ppm2      2.338 CV     1
 ASSI { 1844}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 113  and name HB2 ))
      4.700     2.700     1.300 peak  1844 spectrum    1 weight  0.11000E+01 volume  0.68946E-03 ppm1      9.521 ppm2      1.922 CV     1
 ASSI { 1845}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 47   and name HB2 ))
      4.000     2.000     2.000 peak  1845 spectrum    1 weight  0.11000E+01 volume  0.14750E-02 ppm1      9.521 ppm2      1.767 CV     1
 OR { 1845}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 47   and name HB1 ))
 ASSI { 1846}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 47   and name HD2 ))
      4.400     2.500     1.600 peak  1846 spectrum    1 weight  0.11000E+01 volume  0.11284E-02 ppm1      9.522 ppm2      1.495 CV     1
 ASSI { 1847}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 47   and name HG1 ))
      2.800     1.000     1.000 peak  1847 spectrum    1 weight  0.11000E+01 volume  0.26682E-02 ppm1      9.521 ppm2      1.362 CV     1
 OR { 1847}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 47   and name HG2 ))
 ASSI { 1848}
   (( segid "    " and resid 48   and name HN  ))
   (  segid "    " and resid 114  and name HG1%)
      4.700     2.700     1.300 peak  1848 spectrum    1 weight  0.11000E+01 volume  0.10658E-02 ppm1      9.523 ppm2      0.913 CV     1
 ASSI { 1855}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 111  and name HA  ))
      4.300     2.300     1.700 peak  1855 spectrum    1 weight  0.11000E+01 volume  0.47861E-03 ppm1      8.481 ppm2      5.602 CV     1
 ASSI { 1859}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 144  and name HB1 ))
      2.500     0.800     0.800 peak  1859 spectrum    1 weight  0.10000E+01 volume  0.42817E-02 ppm1      8.478 ppm2      2.406 CV     1
 ASSI { 1862}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 110  and name HB2 ))
      3.600     1.600     1.600 peak  1862 spectrum    1 weight  0.11000E+01 volume  0.16042E-02 ppm1      8.478 ppm2      1.974 CV     1
 ASSI { 1863}
   (( segid "    " and resid 110  and name HN  ))
   (  segid "    " and resid 144  and name HD1%)
      4.900     3.000     1.100 peak  1863 spectrum    1 weight  0.10000E+01 volume  0.84246E-03 ppm1      8.478 ppm2      0.800 CV     1
 ASSI { 1865}
   (( segid "    " and resid 106  and name HN  ))
   (  segid "    " and resid 105  and name HD2%)
      2.300     2.300     3.700 peak  1865 spectrum    1 weight  0.11000E+01 volume  0.61887E-03 ppm1      7.864 ppm2      0.870 CV     1
 ASSI { 1866}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 81   and name HB2 ))
      3.300     1.400     1.400 peak  1866 spectrum    1 weight  0.11000E+01 volume  0.42241E-02 ppm1      7.773 ppm2      1.974 CV     1
 ASSI { 1871}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 125  and name HN  ))
      2.500     2.500     3.500 peak  1871 spectrum    1 weight  0.10000E+01 volume  0.34048E-03 ppm1      7.666 ppm2      8.068 CV     1
 ASSI { 1874}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 123  and name HA1 ))
      3.300     1.400     1.400 peak  1874 spectrum    1 weight  0.11000E+01 volume  0.33528E-03 ppm1      7.661 ppm2      4.133 CV     1
 ASSI { 1875}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 135  and name HA  ))
      2.100     0.600     0.600 peak  1875 spectrum    1 weight  0.11000E+01 volume  0.64094E-02 ppm1      7.662 ppm2      3.856 CV     1
 ASSI { 1876}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 118  and name HB2 ))
      2.100     0.600     0.600 peak  1876 spectrum    1 weight  0.11000E+01 volume  0.66563E-02 ppm1      7.662 ppm2      3.583 CV     1
 OR { 1876}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 118  and name HB1 ))
 ASSI { 1885}
   (( segid "    " and resid 144  and name HN  ))
   (( segid "    " and resid 143  and name HA  ))
      2.300     0.700     0.700 peak  1885 spectrum    1 weight  0.11000E+01 volume  0.66951E-02 ppm1      8.416 ppm2      5.605 CV     1
 ASSI { 1886}
   (( segid "    " and resid 144  and name HN  ))
   (( segid "    " and resid 144  and name HB1 ))
      2.700     0.900     0.900 peak  1886 spectrum    1 weight  0.11000E+01 volume  0.23583E-02 ppm1      8.416 ppm2      2.354 CV     1
 ASSI { 1887}
   (( segid "    " and resid 144  and name HN  ))
   (( segid "    " and resid 142  and name HB  ))
      3.100     3.100     2.900 peak  1887 spectrum    1 weight  0.11000E+01 volume  0.21909E-02 ppm1      8.414 ppm2      1.955 CV     1
 ASSI { 1888}
   (( segid "    " and resid 144  and name HN  ))
   (( segid "    " and resid 144  and name HG  ))
      4.600     2.600     1.400 peak  1888 spectrum    1 weight  0.11000E+01 volume  0.69773E-03 ppm1      8.416 ppm2      1.423 CV     1
 ASSI { 1889}
   (( segid "    " and resid 144  and name HN  ))
   (( segid "    " and resid 144  and name HB2 ))
      3.100     1.200     1.200 peak  1889 spectrum    1 weight  0.11000E+01 volume  0.17048E-02 ppm1      8.414 ppm2      1.305 CV     1
 ASSI { 1891}
   (( segid "    " and resid 144  and name HN  ))
   (  segid "    " and resid 143  and name HG2%)
      3.400     1.500     1.500 peak  1891 spectrum    1 weight  0.11000E+01 volume  0.21142E-02 ppm1      8.417 ppm2      1.033 CV     1
 ASSI { 1892}
   (( segid "    " and resid 144  and name HN  ))
   (  segid "    " and resid 144  and name HD1%)
      4.600     2.600     1.400 peak  1892 spectrum    1 weight  0.11000E+01 volume  0.10205E-02 ppm1      8.414 ppm2      0.853 CV     1
 OR { 1892}
   (( segid "    " and resid 144  and name HN  ))
   (  segid "    " and resid 144  and name HD2%)
 ASSI { 1895}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 84   and name HB2 ))
      3.100     1.200     1.200 peak  1895 spectrum    1 weight  0.11000E+01 volume  0.32395E-02 ppm1      8.310 ppm2      1.889 CV     1
 ASSI {    1}
   (( segid "    " and resid 36   and name HD1 ))
   (( segid "    " and resid 36   and name HB1 ))
      3.200     1.300     1.300 peak     1 spectrum    1 weight  0.11000E+01 volume  0.65772E-03 ppm1      7.282 ppm2      3.059 CV     1
 ASSI {    2}
   (( segid "    " and resid 36   and name HD1 ))
   (( segid "    " and resid 36   and name HB2 ))
      3.700     1.700     1.700 peak     2 spectrum    1 weight  0.11000E+01 volume  0.49346E-03 ppm1      7.292 ppm2      2.868 CV     1
 ASSI {    5}
   (( segid "    " and resid 36   and name HE3 ))
   (( segid "    " and resid 36   and name HB2 ))
      2.900     1.000     1.000 peak     5 spectrum    1 weight  0.11000E+01 volume  0.48800E-03 ppm1      7.206 ppm2      2.866 CV     1
 ASSI {    6}
   (( segid "    " and resid 36   and name HE3 ))
   (( segid "    " and resid 36   and name HB1 ))
      4.300     2.300     1.700 peak     6 spectrum    1 weight  0.11000E+01 volume  0.22871E-03 ppm1      7.223 ppm2      3.096 CV     1
 ASSI {    8}
   (( segid "    " and resid 36   and name HZ2 ))
   (( segid "    " and resid 36   and name HH2 ))
      2.200     0.600     0.600 peak     8 spectrum    1 weight  0.11000E+01 volume  0.43033E-02 ppm1      7.446 ppm2      7.014 CV     1
 ASSI {    9}
   (( segid "    " and resid 36   and name HZ2 ))
   (( segid "    " and resid 36   and name HD1 ))
      4.700     2.800     1.300 peak     9 spectrum    1 weight  0.11000E+01 volume  0.19421E-03 ppm1      7.436 ppm2      7.229 CV     1
 OR {    9}
   (( segid "    " and resid 36   and name HZ2 ))
   (( segid "    " and resid 36   and name HE3 ))
 ASSI {   10}
   (( segid "    " and resid 36   and name HE3 ))
   (( segid "    " and resid 36   and name HZ2 ))
      4.300     2.300     1.700 peak    10 spectrum    1 weight  0.11000E+01 volume  0.19174E-03 ppm1      7.190 ppm2      7.461 CV     1
 ASSI {   11}
   (( segid "    " and resid 36   and name HZ3 ))
   (( segid "    " and resid 36   and name HH2 ))
      1.700     0.400     0.500 peak    11 spectrum    1 weight  0.11000E+01 volume  0.10059E-01 ppm1      7.003 ppm2      7.015 CV     1
 OR {   11}
   (( segid "    " and resid 36   and name HH2 ))
   (( segid "    " and resid 36   and name HZ3 ))
 ASSI {   12}
   (( segid "    " and resid 36   and name HZ3 ))
   (( segid "    " and resid 36   and name HE3 ))
      2.700     0.900     0.900 peak    12 spectrum    1 weight  0.11000E+01 volume  0.69161E-03 ppm1      7.001 ppm2      7.222 CV     1
 ASSI {   14}
   (( segid "    " and resid 36   and name HD1 ))
   (( segid "    " and resid 36   and name HZ2 ))
      4.700     2.800     1.300 peak    14 spectrum    1 weight  0.11000E+01 volume  0.27834E-03 ppm1      7.284 ppm2      7.479 CV     1
 ASSI {   17}
   (( segid "    " and resid 36   and name HE3 ))
   (( segid "    " and resid 36   and name HD1 ))
      4.300     2.300     1.700 peak    17 spectrum    1 weight  0.11000E+01 volume  0.25064E-03 ppm1      7.224 ppm2      7.308 CV     1
 ASSI {   19}
   (  segid "    " and resid 120  and name HD% )
   (  segid "    " and resid 120  and name HE% )
      1.800     0.400     0.400 peak    19 spectrum    1 weight  0.11000E+01 volume  0.87625E-02 ppm1      6.911 ppm2      6.704 CV     1
 ASSI {   24}
   (  segid "    " and resid 120  and name HE% )
   (( segid "    " and resid 120  and name HB1 ))
      4.100     2.100     1.900 peak    24 spectrum    1 weight  0.11000E+01 volume  0.42333E-03 ppm1      6.687 ppm2      3.273 CV     1
 ASSI {   28}
   (  segid "    " and resid 122  and name HD% )
   (  segid "    " and resid 122  and name HE% )
      2.200     0.600     0.600 peak    28 spectrum    1 weight  0.11000E+01 volume  0.41854E-02 ppm1      7.089 ppm2      6.631 CV     1
 ASSI {   29}
   (  segid "    " and resid 122  and name HD% )
   (( segid "    " and resid 122  and name HA  ))
      3.100     1.200     1.200 peak    29 spectrum    1 weight  0.11000E+01 volume  0.10239E-02 ppm1      7.089 ppm2      4.519 CV     1
 ASSI {   34}
   (  segid "    " and resid 122  and name HE% )
   (( segid "    " and resid 122  and name HB2 ))
      4.600     2.600     1.400 peak    34 spectrum    1 weight  0.11000E+01 volume  0.30462E-03 ppm1      6.606 ppm2      2.694 CV     1
 ASSI {   36}
   (  segid "    " and resid 122  and name HE% )
   (( segid "    " and resid 122  and name HA  ))
      4.700     2.800     1.300 peak    36 spectrum    1 weight  0.11000E+01 volume  0.21466E-03 ppm1      6.593 ppm2      4.514 CV     1
 ASSI {   38}
   (  segid "    " and resid 131  and name HD% )
   (  segid "    " and resid 131  and name HE% )
      2.000     0.500     0.500 peak    38 spectrum    1 weight  0.11000E+01 volume  0.89292E-02 ppm1      7.176 ppm2      6.796 CV     1
 ASSI {   44}
   (  segid "    " and resid 131  and name HE% )
   (( segid "    " and resid 131  and name HA  ))
      4.800     2.800     1.200 peak    44 spectrum    1 weight  0.11000E+01 volume  0.26992E-03 ppm1      6.802 ppm2      4.389 CV     1
 ASSI {   49}
   (( segid "    " and resid 69   and name HD2 ))
   (( segid "    " and resid 69   and name HB2 ))
      3.900     1.900     1.900 peak    49 spectrum    1 weight  0.11000E+01 volume  0.26503E-03 ppm1      6.911 ppm2      3.086 CV     1
 ASSI {   50}
   (( segid "    " and resid 69   and name HD2 ))
   (( segid "    " and resid 69   and name HB1 ))
      3.600     1.600     1.600 peak    50 spectrum    1 weight  0.11000E+01 volume  0.16995E-03 ppm1      6.918 ppm2      3.194 CV     1
 ASSI {   53}
   (( segid "    " and resid 69   and name HE1 ))
   (( segid "    " and resid 69   and name HD2 ))
      3.900     1.900     1.900 peak    53 spectrum    1 weight  0.11000E+01 volume  0.51631E-03 ppm1      7.782 ppm2      6.942 CV     1
 ASSI {   56}
   (  segid "    " and resid 88   and name HD% )
   (  segid "    " and resid 88   and name HE% )
      1.900     0.500     0.500 peak    56 spectrum    1 weight  0.11000E+01 volume  0.59935E-02 ppm1      6.958 ppm2      7.177 CV     1
 ASSI {   58}
   (  segid "    " and resid 88   and name HD% )
   (( segid "    " and resid 88   and name HB2 ))
      2.400     0.700     0.700 peak    58 spectrum    1 weight  0.11000E+01 volume  0.22787E-02 ppm1      6.952 ppm2      3.140 CV     1
 OR {   58}
   (  segid "    " and resid 88   and name HD% )
   (( segid "    " and resid 88   and name HB1 ))
 ASSI {   61}
   (  segid "    " and resid 88   and name HE% )
   (( segid "    " and resid 88   and name HA  ))
      5.200     3.400     0.800 peak    61 spectrum    1 weight  0.11000E+01 volume  0.15424E-03 ppm1      7.145 ppm2      4.970 CV     1
 ASSI {   62}
   (  segid "    " and resid 88   and name HE% )
   (( segid "    " and resid 88   and name HB2 ))
      4.200     2.200     1.800 peak    62 spectrum    1 weight  0.11000E+01 volume  0.41559E-03 ppm1      7.166 ppm2      3.160 CV     1
 OR {   62}
   (  segid "    " and resid 88   and name HE% )
   (( segid "    " and resid 88   and name HB1 ))
 ASSI {   63}
   (  segid "    " and resid 88   and name HE% )
   (( segid "    " and resid 88   and name HZ  ))
      2.100     0.500     0.500 peak    63 spectrum    1 weight  0.11000E+01 volume  0.23584E-02 ppm1      7.164 ppm2      6.849 CV     1
 ASSI {   67}
   (  segid "    " and resid 88   and name HD% )
   (( segid "    " and resid 88   and name HZ  ))
      3.300     1.400     1.400 peak    67 spectrum    1 weight  0.11000E+01 volume  0.94943E-03 ppm1      6.954 ppm2      6.849 CV     1
 ASSI {   68}
   (( segid "    " and resid 88   and name HZ  ))
   (( segid "    " and resid 88   and name HB2 ))
      5.200     3.400     0.800 peak    68 spectrum    1 weight  0.11000E+01 volume  0.78904E-04 ppm1      6.818 ppm2      3.131 CV     1
 OR {   68}
   (( segid "    " and resid 88   and name HZ  ))
   (( segid "    " and resid 88   and name HB1 ))
 ASSI {   71}
   (  segid "    " and resid 19   and name HD% )
   (( segid "    " and resid 19   and name HB2 ))
      3.700     1.700     1.700 peak    71 spectrum    1 weight  0.11000E+01 volume  0.29239E-03 ppm1      7.247 ppm2      3.054 CV     1
 ASSI {   72}
   (  segid "    " and resid 19   and name HD% )
   (( segid "    " and resid 19   and name HB1 ))
      3.500     1.600     1.600 peak    72 spectrum    1 weight  0.11000E+01 volume  0.37429E-03 ppm1      7.232 ppm2      3.180 CV     1
 ASSI {   73}
   (  segid "    " and resid 19   and name HD% )
   (( segid "    " and resid 19   and name HA  ))
      4.700     4.700     1.300 peak    73 spectrum    1 weight  0.11000E+01 volume  0.14156E-03 ppm1      7.283 ppm2      4.597 CV     1
 ASSI {   74}
   (  segid "    " and resid 19   and name HD% )
   (  segid "    " and resid 19   and name HE% )
      2.000     0.500     0.500 peak    74 spectrum    1 weight  0.11000E+01 volume  0.11473E-01 ppm1      7.238 ppm2      7.354 CV     1
 ASSI {   76}
   (  segid "    " and resid 19   and name HD% )
   (( segid "    " and resid 19   and name HZ  ))
      5.000     3.100     1.000 peak    76 spectrum    1 weight  0.11000E+01 volume  0.19621E-03 ppm1      7.236 ppm2      7.566 CV     1
 ASSI {   82}
   (  segid "    " and resid 120  and name HE% )
   (( segid "    " and resid 44   and name HG  ))
      3.000     1.200     1.200 peak    82 spectrum    1 weight  0.11000E+01 volume  0.52357E-03 ppm1      6.693 ppm2      1.577 CV     1
 ASSI {   84}
   (  segid "    " and resid 120  and name HE% )
   (  segid "    " and resid 44   and name HD1%)
      3.100     1.200     1.200 peak    84 spectrum    1 weight  0.11000E+01 volume  0.18837E-02 ppm1      6.683 ppm2      0.942 CV     1
 ASSI {   88}
   (  segid "    " and resid 120  and name HD% )
   (( segid "    " and resid 44   and name HB2 ))
      3.700     1.700     1.700 peak    88 spectrum    1 weight  0.11000E+01 volume  0.33911E-03 ppm1      6.899 ppm2      1.692 CV     1
 ASSI {   89}
   (  segid "    " and resid 120  and name HD% )
   (  segid "    " and resid 44   and name HD1%)
      4.500     2.600     1.500 peak    89 spectrum    1 weight  0.11000E+01 volume  0.42253E-03 ppm1      6.924 ppm2      0.937 CV     1
 ASSI {   92}
   (  segid "    " and resid 88   and name HE% )
   (  segid "    " and resid 90   and name HD2%)
      3.900     1.900     1.900 peak    92 spectrum    1 weight  0.11000E+01 volume  0.95187E-03 ppm1      7.170 ppm2      0.758 CV     1
 ASSI {   97}
   (  segid "    " and resid 88   and name HD% )
   (( segid "    " and resid 86   and name HB1 ))
      4.400     2.400     1.600 peak    97 spectrum    1 weight  0.11000E+01 volume  0.77993E-04 ppm1      6.974 ppm2      2.074 CV     1
 ASSI {  100}
   (  segid "    " and resid 88   and name HD% )
   (( segid "    " and resid 90   and name HA  ))
      2.900     1.100     1.100 peak   100 spectrum    1 weight  0.11000E+01 volume  0.77178E-03 ppm1      6.957 ppm2      4.350 CV     1
 ASSI {  101}
   (  segid "    " and resid 88   and name HD% )
   (  segid "    " and resid 90   and name HD1%)
      3.900     1.900     1.900 peak   101 spectrum    1 weight  0.11000E+01 volume  0.62357E-03 ppm1      6.961 ppm2      1.079 CV     1
 ASSI {  102}
   (  segid "    " and resid 88   and name HD% )
   (  segid "    " and resid 99   and name HD2%)
      3.600     1.600     1.600 peak   102 spectrum    1 weight  0.11000E+01 volume  0.80126E-03 ppm1      6.946 ppm2      0.770 CV     1
 ASSI {  104}
   (  segid "    " and resid 88   and name HE% )
   (  segid "    " and resid 90   and name HD1%)
      2.400     0.700     0.700 peak   104 spectrum    1 weight  0.11000E+01 volume  0.14639E-02 ppm1      7.167 ppm2      1.074 CV     1
 ASSI {  105}
   (( segid "    " and resid 88   and name HZ  ))
   (  segid "    " and resid 90   and name HD1%)
      3.000     1.200     1.200 peak   105 spectrum    1 weight  0.11000E+01 volume  0.54792E-03 ppm1      6.843 ppm2      1.044 CV     1
 ASSI {  107}
   (( segid "    " and resid 88   and name HZ  ))
   (( segid "    " and resid 99   and name HB2 ))
      3.800     1.800     1.800 peak   107 spectrum    1 weight  0.11000E+01 volume  0.16026E-02 ppm1      6.840 ppm2      1.306 CV     1
 ASSI {  113}
   (( segid "    " and resid 36   and name HH2 ))
   (  segid "    " and resid 115  and name HG2%)
      3.800     1.800     1.800 peak   113 spectrum    1 weight  0.11000E+01 volume  0.10896E-02 ppm1      7.003 ppm2      1.123 CV     1
 OR {  113}
   (( segid "    " and resid 36   and name HZ3 ))
   (  segid "    " and resid 115  and name HG2%)
 ASSI {  114}
   (( segid "    " and resid 36   and name HZ2 ))
   (  segid "    " and resid 115  and name HG2%)
      4.300     2.300     1.700 peak   114 spectrum    1 weight  0.11000E+01 volume  0.43392E-03 ppm1      7.448 ppm2      1.123 CV     1
 ASSI {  115}
   (( segid "    " and resid 36   and name HZ2 ))
   (( segid "    " and resid 115  and name HB  ))
      4.600     2.600     1.400 peak   115 spectrum    1 weight  0.11000E+01 volume  0.19876E-03 ppm1      7.451 ppm2      4.128 CV     1
 ASSI {  121}
   (  segid "    " and resid 122  and name HE% )
   (  segid "    " and resid 96   and name HG2%)
      3.000     1.100     1.100 peak   121 spectrum    1 weight  0.11000E+01 volume  0.81204E-03 ppm1      6.610 ppm2      0.274 CV     1
 ASSI {  122}
   (  segid "    " and resid 122  and name HD% )
   (  segid "    " and resid 96   and name HD1%)
      4.700     2.800     1.300 peak   122 spectrum    1 weight  0.11000E+01 volume  0.18324E-03 ppm1      7.100 ppm2      0.749 CV     1
 ASSI {  123}
   (  segid "    " and resid 122  and name HD% )
   (  segid "    " and resid 96   and name HG2%)
      3.800     1.800     1.800 peak   123 spectrum    1 weight  0.11000E+01 volume  0.29569E-03 ppm1      7.126 ppm2      0.271 CV     1
 ASSI {  125}
   (  segid "    " and resid 122  and name HE% )
   (  segid "    " and resid 132  and name HD1%)
      3.200     1.300     1.300 peak   125 spectrum    1 weight  0.11000E+01 volume  0.12107E-02 ppm1      6.616 ppm2      0.448 CV     1
 ASSI {  127}
   (  segid "    " and resid 122  and name HE% )
   (( segid "    " and resid 132  and name HG11))
      3.100     1.200     1.200 peak   127 spectrum    1 weight  0.11000E+01 volume  0.18141E-02 ppm1      6.621 ppm2      1.026 CV     1
 ASSI {  128}
   (  segid "    " and resid 122  and name HE% )
   (( segid "    " and resid 132  and name HB  ))
      4.800     2.900     1.200 peak   128 spectrum    1 weight  0.11000E+01 volume  0.22073E-03 ppm1      6.597 ppm2      1.171 CV     1
 ASSI {  129}
   (  segid "    " and resid 122  and name HD% )
   (  segid "    " and resid 132  and name HD1%)
      3.000     1.100     1.100 peak   129 spectrum    1 weight  0.11000E+01 volume  0.72491E-03 ppm1      7.084 ppm2      0.449 CV     1
 ASSI {  131}
   (  segid "    " and resid 122  and name HD% )
   (  segid "    " and resid 132  and name HG2%)
      3.300     1.400     1.400 peak   131 spectrum    1 weight  0.11000E+01 volume  0.83080E-03 ppm1      7.092 ppm2      0.934 CV     1
 ASSI {  132}
   (  segid "    " and resid 122  and name HD% )
   (( segid "    " and resid 132  and name HG11))
      2.900     1.100     1.100 peak   132 spectrum    1 weight  0.11000E+01 volume  0.12584E-02 ppm1      7.088 ppm2      1.024 CV     1
 ASSI {  134}
   (( segid "    " and resid 36   and name HD1 ))
   (( segid "    " and resid 34   and name HB2 ))
      4.100     4.100     1.900 peak   134 spectrum    1 weight  0.11000E+01 volume  0.25265E-03 ppm1      7.279 ppm2      1.982 CV     1
 ASSI {  153}
   (( segid "    " and resid 36   and name HH2 ))
   (( segid "    " and resid 113  and name HG2 ))
      3.000     1.100     1.100 peak   153 spectrum    1 weight  0.10000E+01 volume  0.36496E-03 ppm1      7.006 ppm2      2.534 CV     1
 OR {  153}
   (( segid "    " and resid 36   and name HH2 ))
   (( segid "    " and resid 113  and name HG2 ))
 ASSI {  155}
   (( segid "    " and resid 36   and name HE3 ))
   (( segid "    " and resid 46   and name HB1 ))
      2.800     1.000     1.000 peak   155 spectrum    1 weight  0.11000E+01 volume  0.52133E-03 ppm1      7.217 ppm2      1.808 CV     1
 OR {  155}
   (( segid "    " and resid 36   and name HE3 ))
   (( segid "    " and resid 46   and name HB2 ))
 ASSI {  156}
   (( segid "    " and resid 36   and name HE3 ))
   (( segid "    " and resid 114  and name HA  ))
      4.000     2.000     2.000 peak   156 spectrum    1 weight  0.11000E+01 volume  0.20639E-03 ppm1      7.212 ppm2      5.604 CV     1
 ASSI {  159}
   (  segid "    " and resid 88   and name HD% )
   (  segid "    " and resid 66   and name HG2%)
      3.400     1.400     1.400 peak   159 spectrum    1 weight  0.11000E+01 volume  0.60531E-03 ppm1      6.958 ppm2      0.032 CV     1
 ASSI {  161}
   (  segid "    " and resid 88   and name HD% )
   (  segid "    " and resid 95   and name HG1%)
      3.200     1.300     1.300 peak   161 spectrum    1 weight  0.11000E+01 volume  0.67078E-03 ppm1      6.952 ppm2      0.315 CV     1
 ASSI {  164}
   (  segid "    " and resid 88   and name HE% )
   (  segid "    " and resid 66   and name HG2%)
      2.800     1.000     1.000 peak   164 spectrum    1 weight  0.11000E+01 volume  0.72870E-03 ppm1      7.164 ppm2      0.023 CV     1
 ASSI {  167}
   (( segid "    " and resid 88   and name HZ  ))
   (  segid "    " and resid 66   and name HG2%)
      3.100     1.200     1.200 peak   167 spectrum    1 weight  0.11000E+01 volume  0.62015E-03 ppm1      6.845 ppm2      0.022 CV     1
 ASSI {  169}
   (( segid "    " and resid 88   and name HZ  ))
   (( segid "    " and resid 103  and name HB  ))
      3.900     1.900     1.900 peak   169 spectrum    1 weight  0.11000E+01 volume  0.23595E-03 ppm1      6.840 ppm2      2.297 CV     1
 ASSI {  175}
   (  segid "    " and resid 120  and name HD% )
   (( segid "    " and resid 117  and name HB1 ))
      3.700     1.700     1.700 peak   175 spectrum    1 weight  0.11000E+01 volume  0.39555E-03 ppm1      6.915 ppm2      2.967 CV     1
 ASSI {  178}
   (  segid "    " and resid 120  and name HD% )
   (( segid "    " and resid 42   and name HD21))
      2.900     2.900     3.100 peak   178 spectrum    1 weight  0.10000E+01 volume  0.55374E-04 ppm1      6.909 ppm2      6.460 CV     1
 ASSI {  183}
   (  segid "    " and resid 120  and name HE% )
   (( segid "    " and resid 117  and name HB1 ))
      4.700     2.700     1.300 peak   183 spectrum    1 weight  0.11000E+01 volume  0.27607E-03 ppm1      6.691 ppm2      2.987 CV     1
 ASSI {  187}
   (  segid "    " and resid 120  and name HE% )
   (( segid "    " and resid 116  and name HA  ))
      2.300     2.300     3.700 peak   187 spectrum    1 weight  0.11000E+01 volume  0.23193E-03 ppm1      6.694 ppm2      5.353 CV     1
 ASSI {  190}
   (  segid "    " and resid 122  and name HD% )
   (( segid "    " and resid 81   and name HG2 ))
      2.600     2.600     3.400 peak   190 spectrum    1 weight  0.10000E+01 volume  0.10467E-03 ppm1      7.062 ppm2      2.197 CV     1
 ASSI {  196}
   (  segid "    " and resid 122  and name HD% )
   (( segid "    " and resid 125  and name HE21))
      4.900     3.100     1.100 peak   196 spectrum    1 weight  0.10000E+01 volume  0.12942E-03 ppm1      7.068 ppm2      7.517 CV     1
 ASSI {  206}
   (  segid "    " and resid 131  and name HD% )
   (( segid "    " and resid 130  and name HB2 ))
      4.600     2.600     1.400 peak   206 spectrum    1 weight  0.11000E+01 volume  0.11856E-03 ppm1      7.193 ppm2      1.771 CV     1
 ASSI {  214}
   (  segid "    " and resid 131  and name HE% )
   (( segid "    " and resid 134  and name HB2 ))
      4.500     2.500     1.500 peak   214 spectrum    1 weight  0.10000E+01 volume  0.48340E-03 ppm1      6.780 ppm2      2.007 CV     1
 ASSI {  224}
   (( segid "    " and resid 69   and name HD2 ))
   (( segid "    " and resid 145  and name HD1 ))
      6.000     4.900     0.000 peak   224 spectrum    1 weight  0.11000E+01 volume  0.55942E-04 ppm1      6.907 ppm2      1.770 CV     1
 ASSI {  226}
   (( segid "    " and resid 69   and name HD2 ))
   (( segid "    " and resid 71   and name HB2 ))
      4.700     2.700     1.300 peak   226 spectrum    1 weight  0.11000E+01 volume  0.37532E-03 ppm1      6.911 ppm2      2.086 CV     1
 OR {  226}
   (( segid "    " and resid 69   and name HD2 ))
   (( segid "    " and resid 71   and name HB1 ))
 ASSI {  227}
   (( segid "    " and resid 69   and name HD2 ))
   (( segid "    " and resid 71   and name HG2 ))
      4.600     2.700     1.400 peak   227 spectrum    1 weight  0.11000E+01 volume  0.45278E-03 ppm1      6.906 ppm2      2.201 CV     1
 ASSI {  230}
   (( segid "    " and resid 69   and name HD2 ))
   (( segid "    " and resid 71   and name HA  ))
      4.600     2.700     1.400 peak   230 spectrum    1 weight  0.11000E+01 volume  0.21610E-03 ppm1      6.904 ppm2      5.057 CV     1
 ASSI {  244}
   (( segid "    " and resid 69   and name HE1 ))
   (( segid "    " and resid 71   and name HG2 ))
      4.800     2.900     1.200 peak   244 spectrum    1 weight  0.11000E+01 volume  0.24932E-03 ppm1      7.786 ppm2      2.205 CV     1
 ASSI {  245}
   (( segid "    " and resid 69   and name HE1 ))
   (( segid "    " and resid 71   and name HB1 ))
      4.900     3.000     1.100 peak   245 spectrum    1 weight  0.11000E+01 volume  0.47950E-03 ppm1      7.776 ppm2      2.096 CV     1
 OR {  245}
   (( segid "    " and resid 69   and name HE1 ))
   (( segid "    " and resid 71   and name HB2 ))
 ASSI {  247}
   (( segid "    " and resid 69   and name HE1 ))
   (( segid "    " and resid 84   and name HB2 ))
      4.500     2.600     1.500 peak   247 spectrum    1 weight  0.11000E+01 volume  0.36196E-03 ppm1      7.783 ppm2      1.873 CV     1
 ASSI {  251}
   (  segid "    " and resid 120  and name HE% )
   (( segid "    " and resid 97   and name HB1 ))
      4.300     2.300     1.700 peak   251 spectrum    1 weight  0.11000E+01 volume  0.15523E-03 ppm1      6.689 ppm2      2.263 CV     1
 OR {  251}
   (  segid "    " and resid 120  and name HE% )
   (( segid "    " and resid 97   and name HB2 ))
 ASSI {  256}
   (  segid "    " and resid 120  and name HD% )
   (( segid "    " and resid 99   and name HN  ))
      2.100     2.100     3.900 peak   256 spectrum    1 weight  0.11000E+01 volume  0.39729E-03 ppm1      6.923 ppm2      7.259 CV     1
 ASSI {  259}
   (( segid "    " and resid 36   and name HZ3 ))
   (( segid "    " and resid 47   and name HA  ))
      4.600     4.600     1.400 peak   259 spectrum    1 weight  0.11000E+01 volume  0.12858E-03 ppm1      7.018 ppm2      5.947 CV     1
 ASSI {    1}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 36   and name HA  ))
      3.500     1.500     1.500 peak     1 spectrum    1 weight  0.10000E+01 volume  0.25025E-02 ppm1      4.261 ppm2      4.754 CV     1
 ASSI {    1}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 35   and name HB1 ))
      2.600     0.800     0.800 peak     1 spectrum    1 weight  0.10000E+01 volume  0.37252E-02 ppm1      4.282 ppm2      2.064 CV     1
 ASSI {    2}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 34   and name HB1 ))
      2.800     1.000     1.000 peak     2 spectrum    1 weight  0.10000E+01 volume  0.36106E-02 ppm1      4.275 ppm2      1.946 CV     1
 ASSI {    7}
   (( segid "    " and resid 108  and name HB  ))
   (( segid "    " and resid 57   and name HB1 ))
      2.800     1.000     1.000 peak     7 spectrum    1 weight  0.10000E+01 volume  0.39926E-02 ppm1      2.038 ppm2      3.991 CV     1
 OR {    7}
   (( segid "    " and resid 108  and name HB  ))
   (( segid "    " and resid 57   and name HB2 ))
 ASSI {    9}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 35   and name HG2 ))
      3.100     1.200     1.200 peak     9 spectrum    1 weight  0.10000E+01 volume  0.28846E-02 ppm1      2.067 ppm2      2.262 CV     1
 ASSI {   11}
   (( segid "    " and resid 35   and name HG1 ))
   (( segid "    " and resid 35   and name HA  ))
      3.000     1.100     1.100 peak    11 spectrum    1 weight  0.10000E+01 volume  0.34959E-02 ppm1      2.254 ppm2      4.290 CV     1
 ASSI {   12}
   (( segid "    " and resid 75   and name HG2 ))
   (( segid "    " and resid 75   and name HA  ))
      3.300     1.300     1.300 peak    12 spectrum    1 weight  0.10000E+01 volume  0.37633E-02 ppm1      2.249 ppm2      3.995 CV     1
 OR {   12}
   (( segid "    " and resid 75   and name HG1 ))
   (( segid "    " and resid 75   and name HA  ))
 ASSI {   13}
   (( segid "    " and resid 75   and name HG1 ))
   (  segid "    " and resid 137  and name HB% )
      3.700     1.700     1.700 peak    13 spectrum    1 weight  0.10000E+01 volume  0.38207E-02 ppm1      2.263 ppm2      1.464 CV     1
 OR {   13}
   (( segid "    " and resid 75   and name HG2 ))
   (  segid "    " and resid 137  and name HB% )
 ASSI {   16}
   (( segid "    " and resid 36   and name HA  ))
   (  segid "    " and resid 37   and name HD1%)
      3.200     3.200     2.800 peak    16 spectrum    1 weight  0.10000E+01 volume  0.56355E-02 ppm1      4.770 ppm2      1.017 CV     1
 ASSI {   17}
   (( segid "    " and resid 36   and name HB1 ))
   (( segid "    " and resid 37   and name HA  ))
      3.600     1.600     1.600 peak    17 spectrum    1 weight  0.10000E+01 volume  0.30947E-02 ppm1      3.005 ppm2      4.557 CV     1
 ASSI {   20}
   (( segid "    " and resid 36   and name HB1 ))
   (( segid "    " and resid 36   and name HA  ))
      2.500     0.800     0.800 peak    20 spectrum    1 weight  0.10000E+01 volume  0.40881E-02 ppm1      3.010 ppm2      4.715 CV     1
 ASSI {   23}
   (( segid "    " and resid 37   and name HG  ))
   (  segid "    " and resid 37   and name HD1%)
      2.700     0.900     0.900 peak    23 spectrum    1 weight  0.10000E+01 volume  0.33431E-02 ppm1      1.494 ppm2      0.967 CV     1
 ASSI {   26}
   (  segid "    " and resid 105  and name HD1%)
   (( segid "    " and resid 39   and name HA  ))
      2.800     1.000     1.000 peak    26 spectrum    1 weight  0.10000E+01 volume  0.38780E-02 ppm1      0.970 ppm2      3.472 CV     1
 ASSI {   29}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 106  and name HA  ))
      2.800     2.800     3.200 peak    29 spectrum    1 weight  0.10000E+01 volume  0.47758E-02 ppm1      4.766 ppm2      4.424 CV     1
 ASSI {   30}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 40   and name HG  ))
      2.800     1.000     1.000 peak    30 spectrum    1 weight  0.10000E+01 volume  0.51961E-02 ppm1      4.616 ppm2      1.386 CV     1
 ASSI {   31}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 40   and name HB2 ))
      2.600     0.900     0.900 peak    31 spectrum    1 weight  0.10000E+01 volume  0.52725E-02 ppm1      4.612 ppm2      1.597 CV     1
 ASSI {   32}
   (( segid "    " and resid 40   and name HB2 ))
   (( segid "    " and resid 40   and name HB1 ))
      2.000     0.500     0.500 peak    32 spectrum    1 weight  0.10000E+01 volume  0.40881E-02 ppm1      1.610 ppm2      1.839 CV     1
 ASSI {   33}
   (( segid "    " and resid 150  and name HB1 ))
   (( segid "    " and resid 150  and name HA  ))
      2.800     1.000     1.000 peak    33 spectrum    1 weight  0.10000E+01 volume  0.37442E-02 ppm1      1.595 ppm2      4.171 CV     1
 OR {   33}
   (( segid "    " and resid 150  and name HB2 ))
   (( segid "    " and resid 150  and name HA  ))
 ASSI {   34}
   (( segid "    " and resid 20   and name HB2 ))
   (( segid "    " and resid 20   and name HA  ))
      2.700     0.900     0.900 peak    34 spectrum    1 weight  0.10000E+01 volume  0.39735E-02 ppm1      1.593 ppm2      4.309 CV     1
 OR {   34}
   (( segid "    " and resid 20   and name HB1 ))
   (( segid "    " and resid 20   and name HA  ))
 ASSI {   35}
   (( segid "    " and resid 150  and name HB1 ))
   (( segid "    " and resid 149  and name HA  ))
      3.100     1.200     1.200 peak    35 spectrum    1 weight  0.10000E+01 volume  0.41263E-02 ppm1      1.594 ppm2      4.841 CV     1
 OR {   35}
   (( segid "    " and resid 150  and name HB2 ))
   (( segid "    " and resid 149  and name HA  ))
 ASSI {   36}
   (( segid "    " and resid 40   and name HB2 ))
   (( segid "    " and resid 40   and name HG  ))
      2.400     0.700     0.700 peak    36 spectrum    1 weight  0.10000E+01 volume  0.38971E-02 ppm1      1.615 ppm2      1.384 CV     1
 ASSI {   37}
   (( segid "    " and resid 40   and name HB2 ))
   (  segid "    " and resid 40   and name HD2%)
      3.000     1.100     1.100 peak    37 spectrum    1 weight  0.10000E+01 volume  0.39735E-02 ppm1      1.611 ppm2      0.593 CV     1
 ASSI {   39}
   (( segid "    " and resid 40   and name HB1 ))
   (( segid "    " and resid 40   and name HG  ))
      2.800     1.000     1.000 peak    39 spectrum    1 weight  0.10000E+01 volume  0.34959E-02 ppm1      1.847 ppm2      1.387 CV     1
 ASSI {   40}
   (( segid "    " and resid 40   and name HB1 ))
   (  segid "    " and resid 40   and name HD2%)
      2.800     1.000     1.000 peak    40 spectrum    1 weight  0.10000E+01 volume  0.38971E-02 ppm1      1.827 ppm2      0.593 CV     1
 ASSI {   41}
   (( segid "    " and resid 40   and name HB1 ))
   (( segid "    " and resid 40   and name HA  ))
      2.400     0.700     0.700 peak    41 spectrum    1 weight  0.10000E+01 volume  0.52343E-02 ppm1      1.819 ppm2      4.603 CV     1
 ASSI {   42}
   (( segid "    " and resid 40   and name HG  ))
   (  segid "    " and resid 45   and name HD1%)
      3.300     1.400     1.400 peak    42 spectrum    1 weight  0.10000E+01 volume  0.31712E-02 ppm1      1.374 ppm2      0.782 CV     1
 ASSI {   46}
   (  segid "    " and resid 70   and name HD2%)
   (( segid "    " and resid 86   and name HG  ))
      3.600     3.600     2.400 peak    46 spectrum    1 weight  0.10000E+01 volume  0.31329E-02 ppm1      0.779 ppm2      1.599 CV     1
 ASSI {   47}
   (  segid "    " and resid 70   and name HD2%)
   (( segid "    " and resid 68   and name HB  ))
      3.300     3.300     2.700 peak    47 spectrum    1 weight  0.10000E+01 volume  0.37442E-02 ppm1      0.789 ppm2      2.184 CV     1
 ASSI {   48}
   (  segid "    " and resid 70   and name HD2%)
   (( segid "    " and resid 81   and name HA  ))
      3.300     3.300     2.700 peak    48 spectrum    1 weight  0.10000E+01 volume  0.42027E-02 ppm1      0.791 ppm2      4.681 CV     1
 ASSI {   50}
   (  segid "    " and resid 70   and name HD2%)
   (( segid "    " and resid 70   and name HA  ))
      3.200     1.300     1.300 peak    50 spectrum    1 weight  0.10000E+01 volume  0.38780E-02 ppm1      0.796 ppm2      5.377 CV     1
 ASSI {   56}
   (( segid "    " and resid 41   and name HA1 ))
   (( segid "    " and resid 41   and name HA2 ))
      2.100     0.600     0.600 peak    56 spectrum    1 weight  0.10000E+01 volume  0.39735E-02 ppm1      4.143 ppm2      3.593 CV     1
 ASSI {   58}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 42   and name HB1 ))
      2.500     0.800     0.800 peak    58 spectrum    1 weight  0.10000E+01 volume  0.50241E-02 ppm1      4.879 ppm2      3.297 CV     1
 ASSI {   61}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 42   and name HN  ))
      2.300     0.700     0.700 peak    61 spectrum    1 weight  0.10000E+01 volume  0.63041E-02 ppm1      4.869 ppm2      7.072 CV     1
 ASSI {   63}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 42   and name HD22))
      3.400     1.500     1.500 peak    63 spectrum    1 weight  0.10000E+01 volume  0.60558E-02 ppm1      4.886 ppm2      7.860 CV     1
 ASSI {   64}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 42   and name HB1 ))
      2.100     0.600     0.600 peak    64 spectrum    1 weight  0.10000E+01 volume  0.39926E-02 ppm1      2.765 ppm2      3.300 CV     1
 ASSI {   65}
   (( segid "    " and resid 43   and name HA1 ))
   (( segid "    " and resid 43   and name HA2 ))
      2.300     0.700     0.700 peak    65 spectrum    1 weight  0.10000E+01 volume  0.39543E-02 ppm1      4.047 ppm2      3.489 CV     1
 ASSI {   66}
   (( segid "    " and resid 43   and name HA1 ))
   (( segid "    " and resid 46   and name HD1 ))
      3.100     1.200     1.200 peak    66 spectrum    1 weight  0.10000E+01 volume  0.61321E-02 ppm1      4.059 ppm2      2.763 CV     1
 ASSI {   70}
   (( segid "    " and resid 44   and name HA  ))
   (  segid "    " and resid 44   and name HD1%)
      3.100     1.200     1.200 peak    70 spectrum    1 weight  0.10000E+01 volume  0.48905E-02 ppm1      4.378 ppm2      0.951 CV     1
 ASSI {   72}
   (( segid "    " and resid 44   and name HA  ))
   (  segid "    " and resid 116  and name HB% )
      3.400     3.400     2.600 peak    72 spectrum    1 weight  0.10000E+01 volume  0.41072E-02 ppm1      4.357 ppm2      1.062 CV     1
 ASSI {   74}
   (( segid "    " and resid 90   and name HA  ))
   (  segid "    " and resid 88   and name HE% )
      2.200     0.600     0.600 peak    74 spectrum    1 weight  0.10000E+01 volume  0.49669E-02 ppm1      4.360 ppm2      7.178 CV     1
 ASSI {   75}
   (  segid "    " and resid 44   and name HD1%)
   (  segid "    " and resid 44   and name HD2%)
      2.800     1.000     1.000 peak    75 spectrum    1 weight  0.10000E+01 volume  0.27318E-02 ppm1      0.967 ppm2      0.848 CV     1
 ASSI {   82}
   (  segid "    " and resid 45   and name HD1%)
   (( segid "    " and resid 45   and name HA  ))
      2.600     0.800     0.800 peak    82 spectrum    1 weight  0.10000E+01 volume  0.34577E-02 ppm1      0.795 ppm2      5.223 CV     1
 ASSI {   85}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 116  and name HA  ))
      2.100     0.600     0.600 peak    85 spectrum    1 weight  0.10000E+01 volume  0.38971E-02 ppm1      5.224 ppm2      5.356 CV     1
 ASSI {   86}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 45   and name HB1 ))
      2.600     0.900     0.900 peak    86 spectrum    1 weight  0.10000E+01 volume  0.44892E-02 ppm1      5.221 ppm2      1.702 CV     1
 ASSI {   88}
   (( segid "    " and resid 45   and name HA  ))
   (  segid "    " and resid 116  and name HB% )
      2.900     1.000     1.000 peak    88 spectrum    1 weight  0.10000E+01 volume  0.45657E-02 ppm1      5.223 ppm2      1.115 CV     1
 ASSI {   90}
   (( segid "    " and resid 45   and name HA  ))
   (  segid "    " and resid 45   and name HD2%)
      3.000     1.100     1.100 peak    90 spectrum    1 weight  0.10000E+01 volume  0.50815E-02 ppm1      5.225 ppm2      0.519 CV     1
 ASSI {   91}
   (( segid "    " and resid 45   and name HG  ))
   (  segid "    " and resid 45   and name HD1%)
      2.400     0.700     0.700 peak    91 spectrum    1 weight  0.10000E+01 volume  0.33622E-02 ppm1      1.287 ppm2      0.795 CV     1
 ASSI {   92}
   (( segid "    " and resid 45   and name HG  ))
   (  segid "    " and resid 45   and name HD2%)
      2.400     0.700     0.700 peak    92 spectrum    1 weight  0.10000E+01 volume  0.36869E-02 ppm1      1.275 ppm2      0.519 CV     1
 ASSI {   93}
   (  segid "    " and resid 45   and name HD1%)
   (  segid "    " and resid 116  and name HB% )
      2.800     1.000     1.000 peak    93 spectrum    1 weight  0.10000E+01 volume  0.30183E-02 ppm1      0.788 ppm2      1.108 CV     1
 ASSI {   98}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 36   and name HE3 ))
      3.000     1.200     1.200 peak    98 spectrum    1 weight  0.10000E+01 volume  0.44892E-02 ppm1      5.943 ppm2      7.227 CV     1
 ASSI {   99}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 114  and name HA  ))
      3.200     3.200     2.800 peak    99 spectrum    1 weight  0.10000E+01 volume  0.36487E-02 ppm1      5.944 ppm2      5.619 CV     1
 ASSI {  101}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 46   and name HD1 ))
      3.400     1.500     1.500 peak   101 spectrum    1 weight  0.10000E+01 volume  0.52916E-02 ppm1      5.931 ppm2      2.784 CV     1
 ASSI {  104}
   (( segid "    " and resid 46   and name HA  ))
   (  segid "    " and resid 114  and name HG2%)
      3.400     3.400     2.600 peak   104 spectrum    1 weight  0.10000E+01 volume  0.40308E-02 ppm1      5.941 ppm2      0.868 CV     1
 ASSI {  107}
   (( segid "    " and resid 46   and name HB1 ))
   (( segid "    " and resid 46   and name HA  ))
      2.300     0.600     0.600 peak   107 spectrum    1 weight  0.10000E+01 volume  0.45466E-02 ppm1      1.800 ppm2      5.937 CV     1
 ASSI {  108}
   (( segid "    " and resid 46   and name HB1 ))
   (( segid "    " and resid 36   and name HE3 ))
      2.100     0.600     0.600 peak   108 spectrum    1 weight  0.10000E+01 volume  0.43173E-02 ppm1      1.799 ppm2      7.231 CV     1
 ASSI {  109}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 46   and name HG2 ))
      2.700     0.900     0.900 peak   109 spectrum    1 weight  0.10000E+01 volume  0.44892E-02 ppm1      1.807 ppm2      1.321 CV     1
 ASSI {  112}
   (( segid "    " and resid 17   and name HG2 ))
   (  segid "    " and resid 15   and name HD2%)
      1.600     1.600     4.400 peak   112 spectrum    1 weight  0.10000E+01 volume  0.38971E-02 ppm1      1.277 ppm2      0.424 CV     1
 ASSI {  113}
   (( segid "    " and resid 46   and name HG1 ))
   (( segid "    " and resid 46   and name HB1 ))
      2.800     1.000     1.000 peak   113 spectrum    1 weight  0.10000E+01 volume  0.38207E-02 ppm1      1.351 ppm2      1.815 CV     1
 ASSI {  114}
   (( segid "    " and resid 46   and name HG1 ))
   (( segid "    " and resid 46   and name HD1 ))
      2.400     0.700     0.700 peak   114 spectrum    1 weight  0.10000E+01 volume  0.37442E-02 ppm1      1.342 ppm2      2.785 CV     1
 ASSI {  115}
   (( segid "    " and resid 46   and name HG1 ))
   (( segid "    " and resid 38   and name HA  ))
      2.100     0.500     0.500 peak   115 spectrum    1 weight  0.10000E+01 volume  0.43556E-02 ppm1      1.347 ppm2      4.781 CV     1
 OR {  115}
   (( segid "    " and resid 46   and name HG2 ))
   (( segid "    " and resid 38   and name HA  ))
 ASSI {  116}
   (( segid "    " and resid 46   and name HG1 ))
   (( segid "    " and resid 46   and name HA  ))
      2.700     0.900     0.900 peak   116 spectrum    1 weight  0.10000E+01 volume  0.40117E-02 ppm1      1.340 ppm2      5.938 CV     1
 ASSI {  117}
   (( segid "    " and resid 46   and name HG1 ))
   (  segid "    " and resid 45   and name HD1%)
      3.200     3.200     2.800 peak   117 spectrum    1 weight  0.10000E+01 volume  0.31902E-02 ppm1      1.373 ppm2      0.784 CV     1
 ASSI {  118}
   (( segid "    " and resid 40   and name HG  ))
   (  segid "    " and resid 40   and name HD2%)
      2.600     0.800     0.800 peak   118 spectrum    1 weight  0.10000E+01 volume  0.36869E-02 ppm1      1.363 ppm2      0.594 CV     1
 ASSI {  121}
   (( segid "    " and resid 99   and name HG  ))
   (  segid "    " and resid 95   and name HG2%)
      2.300     0.700     0.700 peak   121 spectrum    1 weight  0.10000E+01 volume  0.46803E-02 ppm1      1.373 ppm2      0.093 CV     1
 ASSI {  122}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 36   and name HH2 ))
      3.500     3.500     2.500 peak   122 spectrum    1 weight  0.10000E+01 volume  0.47376E-02 ppm1      5.944 ppm2      7.016 CV     1
 ASSI {  123}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 36   and name HE3 ))
      2.400     0.700     0.700 peak   123 spectrum    1 weight  0.10000E+01 volume  0.47376E-02 ppm1      5.944 ppm2      7.226 CV     1
 ASSI {  124}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 114  and name HA  ))
      2.100     0.600     0.600 peak   124 spectrum    1 weight  0.10000E+01 volume  0.41645E-02 ppm1      5.944 ppm2      5.620 CV     1
 ASSI {  125}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 38   and name HA  ))
      2.500     0.800     0.800 peak   125 spectrum    1 weight  0.10000E+01 volume  0.56928E-02 ppm1      5.939 ppm2      4.782 CV     1
 ASSI {  126}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 47   and name HB1 ))
      2.600     0.800     0.800 peak   126 spectrum    1 weight  0.10000E+01 volume  0.41072E-02 ppm1      5.941 ppm2      1.792 CV     1
 ASSI {  127}
   (( segid "    " and resid 47   and name HA  ))
   (  segid "    " and resid 112  and name HB% )
      3.100     1.200     1.200 peak   127 spectrum    1 weight  0.10000E+01 volume  0.56164E-02 ppm1      5.938 ppm2      1.534 CV     1
 ASSI {  128}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 47   and name HG2 ))
      2.200     0.600     0.600 peak   128 spectrum    1 weight  0.10000E+01 volume  0.59794E-02 ppm1      5.940 ppm2      1.378 CV     1
 ASSI {  129}
   (( segid "    " and resid 47   and name HA  ))
   (  segid "    " and resid 114  and name HG2%)
      2.400     0.700     0.700 peak   129 spectrum    1 weight  0.10000E+01 volume  0.43937E-02 ppm1      5.944 ppm2      0.876 CV     1
 ASSI {  131}
   (( segid "    " and resid 47   and name HB1 ))
   (( segid "    " and resid 114  and name HA  ))
      3.500     1.500     1.500 peak   131 spectrum    1 weight  0.10000E+01 volume  0.50815E-02 ppm1      1.790 ppm2      5.619 CV     1
 ASSI {  133}
   (( segid "    " and resid 47   and name HB1 ))
   (( segid "    " and resid 105  and name HG  ))
      3.300     3.300     2.700 peak   133 spectrum    1 weight  0.10000E+01 volume  0.44511E-02 ppm1      1.794 ppm2      1.647 CV     1
 ASSI {  135}
   (( segid "    " and resid 47   and name HB1 ))
   (( segid "    " and resid 47   and name HG2 ))
      2.400     0.700     0.700 peak   135 spectrum    1 weight  0.10000E+01 volume  0.38588E-02 ppm1      1.791 ppm2      1.390 CV     1
 ASSI {  136}
   (( segid "    " and resid 47   and name HB1 ))
   (  segid "    " and resid 37   and name HD2%)
      2.700     2.700     3.300 peak   136 spectrum    1 weight  0.10000E+01 volume  0.47758E-02 ppm1      1.781 ppm2      0.943 CV     1
 ASSI {  137}
   (( segid "    " and resid 47   and name HB2 ))
   (  segid "    " and resid 39   and name HD1%)
      2.400     0.700     0.700 peak   137 spectrum    1 weight  0.10000E+01 volume  0.41836E-02 ppm1      1.786 ppm2      0.764 CV     1
 OR {  137}
   (( segid "    " and resid 47   and name HB1 ))
   (  segid "    " and resid 39   and name HD1%)
 ASSI {  138}
   (( segid "    " and resid 47   and name HG1 ))
   (( segid "    " and resid 47   and name HB1 ))
      2.800     1.000     1.000 peak   138 spectrum    1 weight  0.10000E+01 volume  0.33431E-02 ppm1      1.398 ppm2      1.778 CV     1
 ASSI {  139}
   (( segid "    " and resid 47   and name HG1 ))
   (( segid "    " and resid 47   and name HE2 ))
      2.600     0.800     0.800 peak   139 spectrum    1 weight  0.10000E+01 volume  0.44702E-02 ppm1      1.386 ppm2      2.583 CV     1
 OR {  139}
   (( segid "    " and resid 47   and name HG1 ))
   (( segid "    " and resid 47   and name HE1 ))
 OR {  139}
   (( segid "    " and resid 47   and name HG2 ))
   (( segid "    " and resid 47   and name HE2 ))
 OR {  139}
   (( segid "    " and resid 47   and name HG2 ))
   (( segid "    " and resid 47   and name HE1 ))
 ASSI {  141}
   (( segid "    " and resid 47   and name HG2 ))
   (( segid "    " and resid 114  and name HA  ))
      3.100     1.200     1.200 peak   141 spectrum    1 weight  0.10000E+01 volume  0.47376E-02 ppm1      1.399 ppm2      5.612 CV     1
 OR {  141}
   (( segid "    " and resid 47   and name HG1 ))
   (( segid "    " and resid 114  and name HA  ))
 ASSI {  142}
   (( segid "    " and resid 94   and name HB2 ))
   (( segid "    " and resid 88   and name HB2 ))
      3.700     1.700     1.700 peak   142 spectrum    1 weight  0.10000E+01 volume  0.44320E-02 ppm1      2.714 ppm2      3.152 CV     1
 OR {  142}
   (( segid "    " and resid 94   and name HB2 ))
   (( segid "    " and resid 88   and name HB1 ))
 ASSI {  144}
   (( segid "    " and resid 149  and name HB1 ))
   (( segid "    " and resid 149  and name HA  ))
      2.600     0.800     0.800 peak   144 spectrum    1 weight  0.10000E+01 volume  0.45084E-02 ppm1      2.710 ppm2      4.849 CV     1
 ASSI {  145}
   (( segid "    " and resid 94   and name HB2 ))
   (  segid "    " and resid 88   and name HD% )
      3.500     1.500     1.500 peak   145 spectrum    1 weight  0.10000E+01 volume  0.50051E-02 ppm1      2.717 ppm2      6.965 CV     1
 ASSI {  146}
   (( segid "    " and resid 94   and name HB2 ))
   (  segid "    " and resid 95   and name HG1%)
      3.700     1.700     1.700 peak   146 spectrum    1 weight  0.10000E+01 volume  0.50432E-02 ppm1      2.720 ppm2      0.324 CV     1
 ASSI {  147}
   (( segid "    " and resid 94   and name HB2 ))
   (  segid "    " and resid 95   and name HG2%)
      3.300     1.400     1.400 peak   147 spectrum    1 weight  0.10000E+01 volume  0.53871E-02 ppm1      2.721 ppm2      0.092 CV     1
 ASSI {  148}
   (( segid "    " and resid 94   and name HB1 ))
   (( segid "    " and resid 88   and name HB2 ))
      2.200     0.600     0.600 peak   148 spectrum    1 weight  0.10000E+01 volume  0.49286E-02 ppm1      2.812 ppm2      3.126 CV     1
 OR {  148}
   (( segid "    " and resid 94   and name HB1 ))
   (( segid "    " and resid 88   and name HB1 ))
 ASSI {  149}
   (( segid "    " and resid 94   and name HB1 ))
   (  segid "    " and resid 88   and name HD% )
      2.500     0.800     0.800 peak   149 spectrum    1 weight  0.10000E+01 volume  0.51387E-02 ppm1      2.797 ppm2      6.966 CV     1
 ASSI {  150}
   (( segid "    " and resid 94   and name HB1 ))
   (  segid "    " and resid 95   and name HG1%)
      2.800     1.000     1.000 peak   150 spectrum    1 weight  0.10000E+01 volume  0.48713E-02 ppm1      2.812 ppm2      0.326 CV     1
 ASSI {  151}
   (( segid "    " and resid 94   and name HB1 ))
   (  segid "    " and resid 95   and name HG2%)
      2.600     0.800     0.800 peak   151 spectrum    1 weight  0.10000E+01 volume  0.56355E-02 ppm1      2.807 ppm2      0.091 CV     1
 ASSI {  152}
   (( segid "    " and resid 48   and name HE2 ))
   (( segid "    " and resid 113  and name HG2 ))
      2.700     0.900     0.900 peak   152 spectrum    1 weight  0.10000E+01 volume  0.33240E-02 ppm1      2.308 ppm2      2.473 CV     1
 ASSI {  153}
   (( segid "    " and resid 107  and name HB2 ))
   (( segid "    " and resid 107  and name HB1 ))
      2.000     0.500     0.500 peak   153 spectrum    1 weight  0.10000E+01 volume  0.39543E-02 ppm1      2.310 ppm2      2.578 CV     1
 ASSI {  156}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 112  and name HA  ))
      2.600     0.800     0.800 peak   156 spectrum    1 weight  0.10000E+01 volume  0.48905E-02 ppm1      3.978 ppm2      5.190 CV     1
 ASSI {  157}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 49   and name HB  ))
      2.500     0.800     0.800 peak   157 spectrum    1 weight  0.10000E+01 volume  0.44511E-02 ppm1      3.988 ppm2      3.799 CV     1
 ASSI {  158}
   (( segid "    " and resid 49   and name HA  ))
   (  segid "    " and resid 112  and name HB% )
      2.400     0.700     0.700 peak   158 spectrum    1 weight  0.10000E+01 volume  0.45848E-02 ppm1      3.975 ppm2      1.542 CV     1
 ASSI {  159}
   (( segid "    " and resid 49   and name HA  ))
   (  segid "    " and resid 49   and name HG2%)
      2.500     0.800     0.800 peak   159 spectrum    1 weight  0.10000E+01 volume  0.44892E-02 ppm1      3.976 ppm2      1.049 CV     1
 ASSI {  160}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 23   and name HB1 ))
      2.600     0.900     0.900 peak   160 spectrum    1 weight  0.10000E+01 volume  0.49860E-02 ppm1      4.448 ppm2      2.095 CV     1
 ASSI {  162}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 44   and name HG  ))
      3.400     1.500     1.500 peak   162 spectrum    1 weight  0.10000E+01 volume  0.43365E-02 ppm1      4.436 ppm2      1.571 CV     1
 ASSI {  168}
   (( segid "    " and resid 50   and name HB1 ))
   (  segid "    " and resid 111  and name HG2%)
      3.900     1.900     1.900 peak   168 spectrum    1 weight  0.10000E+01 volume  0.39926E-02 ppm1      1.576 ppm2      1.180 CV     1
 ASSI {  169}
   (( segid "    " and resid 50   and name HB1 ))
   (  segid "    " and resid 50   and name HD1%)
      3.000     1.100     1.100 peak   169 spectrum    1 weight  0.10000E+01 volume  0.28846E-02 ppm1      1.596 ppm2      0.860 CV     1
 ASSI {  172}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 113  and name HB2 ))
      2.600     0.900     0.900 peak   172 spectrum    1 weight  0.10000E+01 volume  0.35150E-02 ppm1      0.830 ppm2      1.936 CV     1
 ASSI {  173}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 51   and name HB  ))
      3.500     1.600     1.600 peak   173 spectrum    1 weight  0.10000E+01 volume  0.35150E-02 ppm1      0.832 ppm2      2.027 CV     1
 ASSI {  175}
   (( segid "    " and resid 146  and name HA  ))
   (( segid "    " and resid 146  and name HB  ))
      2.700     0.900     0.900 peak   175 spectrum    1 weight  0.10000E+01 volume  0.43746E-02 ppm1      4.513 ppm2      4.058 CV     1
 ASSI {  176}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 52   and name HD1 ))
      2.200     0.600     0.600 peak   176 spectrum    1 weight  0.10000E+01 volume  0.48713E-02 ppm1      4.507 ppm2      3.784 CV     1
 ASSI {  177}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 52   and name HD2 ))
      3.100     1.200     1.200 peak   177 spectrum    1 weight  0.10000E+01 volume  0.44702E-02 ppm1      4.499 ppm2      3.633 CV     1
 ASSI {  179}
   (( segid "    " and resid 51   and name HA  ))
   (  segid "    " and resid 51   and name HG1%)
      2.600     0.800     0.800 peak   179 spectrum    1 weight  0.10000E+01 volume  0.45657E-02 ppm1      4.524 ppm2      1.110 CV     1
 ASSI {  185}
   (( segid "    " and resid 52   and name HA  ))
   (  segid "    " and resid 49   and name HG2%)
      2.800     1.000     1.000 peak   185 spectrum    1 weight  0.10000E+01 volume  0.41455E-02 ppm1      4.388 ppm2      1.051 CV     1
 ASSI {  186}
   (( segid "    " and resid 80   and name HA  ))
   (  segid "    " and resid 80   and name HG1%)
      2.700     0.900     0.900 peak   186 spectrum    1 weight  0.10000E+01 volume  0.40690E-02 ppm1      4.398 ppm2      0.908 CV     1
 ASSI {  187}
   (( segid "    " and resid 80   and name HA  ))
   (  segid "    " and resid 80   and name HG2%)
      3.100     1.200     1.200 peak   187 spectrum    1 weight  0.10000E+01 volume  0.40881E-02 ppm1      4.400 ppm2      0.827 CV     1
 ASSI {  188}
   (( segid "    " and resid 84   and name HB1 ))
   (( segid "    " and resid 69   and name HB2 ))
      3.200     3.200     2.800 peak   188 spectrum    1 weight  0.10000E+01 volume  0.51387E-02 ppm1      2.281 ppm2      3.118 CV     1
 ASSI {  189}
   (( segid "    " and resid 106  and name HG1 ))
   (( segid "    " and resid 108  and name HA  ))
      3.000     3.000     3.000 peak   189 spectrum    1 weight  0.10000E+01 volume  0.36106E-02 ppm1      2.294 ppm2      3.317 CV     1
 ASSI {  191}
   (( segid "    " and resid 84   and name HB1 ))
   (( segid "    " and resid 69   and name HE1 ))
      2.700     0.900     0.900 peak   191 spectrum    1 weight  0.10000E+01 volume  0.45275E-02 ppm1      2.297 ppm2      7.747 CV     1
 ASSI {  193}
   (( segid "    " and resid 52   and name HB1 ))
   (( segid "    " and resid 52   and name HG2 ))
      2.900     1.100     1.100 peak   193 spectrum    1 weight  0.10000E+01 volume  0.51579E-02 ppm1      2.285 ppm2      1.711 CV     1
 ASSI {  194}
   (( segid "    " and resid 53   and name HA1 ))
   (( segid "    " and resid 110  and name HA  ))
      3.400     1.500     1.500 peak   194 spectrum    1 weight  0.10000E+01 volume  0.46230E-02 ppm1      3.989 ppm2      4.659 CV     1
 ASSI {  195}
   (( segid "    " and resid 53   and name HA1 ))
   (( segid "    " and resid 53   and name HA2 ))
      2.100     0.600     0.600 peak   195 spectrum    1 weight  0.10000E+01 volume  0.42218E-02 ppm1      4.023 ppm2      3.423 CV     1
 ASSI {  199}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 55   and name HB1 ))
      2.600     0.800     0.800 peak   199 spectrum    1 weight  0.10000E+01 volume  0.41263E-02 ppm1      4.405 ppm2      2.323 CV     1
 ASSI {  200}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 12   and name HB2 ))
      2.900     1.100     1.100 peak   200 spectrum    1 weight  0.10000E+01 volume  0.51006E-02 ppm1      4.396 ppm2      2.117 CV     1
 ASSI {  202}
   (( segid "    " and resid 106  and name HG1 ))
   (( segid "    " and resid 47   and name HD2 ))
      3.200     3.200     2.800 peak   202 spectrum    1 weight  0.10000E+01 volume  0.46612E-02 ppm1      2.310 ppm2      1.393 CV     1
 OR {  202}
   (( segid "    " and resid 106  and name HG1 ))
   (( segid "    " and resid 47   and name HG2 ))
 ASSI {  204}
   (( segid "    " and resid 141  and name HB1 ))
   (( segid "    " and resid 142  and name HA  ))
      3.000     3.000     3.000 peak   204 spectrum    1 weight  0.10000E+01 volume  0.38780E-02 ppm1      2.040 ppm2      5.060 CV     1
 ASSI {  205}
   (( segid "    " and resid 56   and name HA1 ))
   (( segid "    " and resid 56   and name HA2 ))
      2.400     0.700     0.700 peak   205 spectrum    1 weight  0.10000E+01 volume  0.36869E-02 ppm1      4.174 ppm2      3.744 CV     1
 ASSI {  207}
   (( segid "    " and resid 57   and name HB1 ))
   (( segid "    " and resid 57   and name HA  ))
      2.500     0.800     0.800 peak   207 spectrum    1 weight  0.10000E+01 volume  0.38207E-02 ppm1      4.039 ppm2      4.355 CV     1
 ASSI {  208}
   (( segid "    " and resid 57   and name HB1 ))
   (( segid "    " and resid 58   and name HA  ))
      3.400     3.400     2.600 peak   208 spectrum    1 weight  0.10000E+01 volume  0.39926E-02 ppm1      4.047 ppm2      4.751 CV     1
 ASSI {  209}
   (( segid "    " and resid 57   and name HB2 ))
   (( segid "    " and resid 107  and name HB1 ))
      2.100     0.500     0.500 peak   209 spectrum    1 weight  0.10000E+01 volume  0.50624E-02 ppm1      4.034 ppm2      2.574 CV     1
 OR {  209}
   (( segid "    " and resid 57   and name HB1 ))
   (( segid "    " and resid 107  and name HB1 ))
 ASSI {  210}
   (( segid "    " and resid 57   and name HB1 ))
   (  segid "    " and resid 108  and name HG1%)
      2.700     0.900     0.900 peak   210 spectrum    1 weight  0.10000E+01 volume  0.50624E-02 ppm1      4.056 ppm2      0.974 CV     1
 ASSI {  211}
   (( segid "    " and resid 57   and name HB1 ))
   (( segid "    " and resid 107  and name HB2 ))
      3.800     1.800     1.800 peak   211 spectrum    1 weight  0.10000E+01 volume  0.53871E-02 ppm1      4.054 ppm2      2.289 CV     1
 ASSI {  212}
   (( segid "    " and resid 57   and name HB2 ))
   (( segid "    " and resid 57   and name HA  ))
      2.900     1.000     1.000 peak   212 spectrum    1 weight  0.10000E+01 volume  0.38780E-02 ppm1      3.967 ppm2      4.355 CV     1
 ASSI {  213}
   (( segid "    " and resid 57   and name HB2 ))
   (( segid "    " and resid 107  and name HA  ))
      3.300     1.400     1.400 peak   213 spectrum    1 weight  0.10000E+01 volume  0.39926E-02 ppm1      3.971 ppm2      4.747 CV     1
 ASSI {  222}
   (( segid "    " and resid 58   and name HB2 ))
   (( segid "    " and resid 108  and name HB  ))
      2.700     0.900     0.900 peak   222 spectrum    1 weight  0.10000E+01 volume  0.55972E-02 ppm1      3.811 ppm2      2.076 CV     1
 OR {  222}
   (( segid "    " and resid 58   and name HB1 ))
   (( segid "    " and resid 108  and name HB  ))
 ASSI {  223}
   (( segid "    " and resid 58   and name HB2 ))
   (  segid "    " and resid 108  and name HG1%)
      3.000     1.100     1.100 peak   223 spectrum    1 weight  0.10000E+01 volume  0.54445E-02 ppm1      3.809 ppm2      0.952 CV     1
 OR {  223}
   (( segid "    " and resid 58   and name HB1 ))
   (  segid "    " and resid 108  and name HG1%)
 ASSI {  225}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 107  and name HA  ))
      2.300     0.700     0.700 peak   225 spectrum    1 weight  0.10000E+01 volume  0.45657E-02 ppm1      5.217 ppm2      4.737 CV     1
 ASSI {  228}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 45   and name HB2 ))
      2.300     0.700     0.700 peak   228 spectrum    1 weight  0.10000E+01 volume  0.36487E-02 ppm1      5.224 ppm2      0.803 CV     1
 OR {  228}
   (( segid "    " and resid 45   and name HA  ))
   (  segid "    " and resid 45   and name HD1%)
 ASSI {  231}
   (( segid "    " and resid 128  and name HB2 ))
   (( segid "    " and resid 128  and name HA  ))
      2.900     1.100     1.100 peak   231 spectrum    1 weight  0.10000E+01 volume  0.35723E-02 ppm1      1.828 ppm2      4.451 CV     1
 ASSI {  233}
   (( segid "    " and resid 17   and name HB1 ))
   (( segid "    " and resid 17   and name HB2 ))
      2.300     0.700     0.700 peak   233 spectrum    1 weight  0.10000E+01 volume  0.29801E-02 ppm1      1.790 ppm2      1.627 CV     1
 ASSI {  237}
   (( segid "    " and resid 131  and name HA  ))
   (( segid "    " and resid 130  and name HA  ))
      3.200     1.300     1.300 peak   237 spectrum    1 weight  0.10000E+01 volume  0.38397E-02 ppm1      4.400 ppm2      4.769 CV     1
 ASSI {  238}
   (( segid "    " and resid 131  and name HA  ))
   (  segid "    " and resid 131  and name HD% )
      2.600     0.900     0.900 peak   238 spectrum    1 weight  0.10000E+01 volume  0.50241E-02 ppm1      4.388 ppm2      7.185 CV     1
 ASSI {  239}
   (( segid "    " and resid 131  and name HA  ))
   (( segid "    " and resid 131  and name HB1 ))
      2.800     1.000     1.000 peak   239 spectrum    1 weight  0.10000E+01 volume  0.48713E-02 ppm1      4.374 ppm2      2.996 CV     1
 ASSI {  240}
   (( segid "    " and resid 131  and name HA  ))
   (( segid "    " and resid 131  and name HB2 ))
      2.200     0.600     0.600 peak   240 spectrum    1 weight  0.10000E+01 volume  0.53489E-02 ppm1      4.395 ppm2      2.865 CV     1
 ASSI {  242}
   (( segid "    " and resid 61   and name HA  ))
   (  segid "    " and resid 61   and name HG2%)
      2.800     1.000     1.000 peak   242 spectrum    1 weight  0.10000E+01 volume  0.43173E-02 ppm1      4.410 ppm2      0.777 CV     1
 ASSI {  247}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 90   and name HB2 ))
      2.200     0.600     0.600 peak   247 spectrum    1 weight  0.10000E+01 volume  0.44892E-02 ppm1      3.612 ppm2      1.964 CV     1
 ASSI {  248}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 62   and name HB1 ))
      2.300     0.600     0.600 peak   248 spectrum    1 weight  0.10000E+01 volume  0.43556E-02 ppm1      3.611 ppm2      1.833 CV     1
 ASSI {  249}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 62   and name HB2 ))
      2.600     0.900     0.900 peak   249 spectrum    1 weight  0.10000E+01 volume  0.45657E-02 ppm1      3.610 ppm2      1.706 CV     1
 ASSI {  251}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 90   and name HB2 ))
      3.400     1.400     1.400 peak   251 spectrum    1 weight  0.10000E+01 volume  0.47567E-02 ppm1      3.613 ppm2      1.438 CV     1
 ASSI {  253}
   (( segid "    " and resid 62   and name HA  ))
   (  segid "    " and resid 90   and name HD1%)
      3.100     1.200     1.200 peak   253 spectrum    1 weight  0.10000E+01 volume  0.55591E-02 ppm1      3.606 ppm2      1.060 CV     1
 ASSI {  254}
   (( segid "    " and resid 62   and name HA  ))
   (  segid "    " and resid 90   and name HD2%)
      2.700     0.900     0.900 peak   254 spectrum    1 weight  0.10000E+01 volume  0.52534E-02 ppm1      3.612 ppm2      0.750 CV     1
 ASSI {  258}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 62   and name HG2 ))
      2.800     1.000     1.000 peak   258 spectrum    1 weight  0.10000E+01 volume  0.38016E-02 ppm1      1.694 ppm2      1.338 CV     1
 ASSI {  261}
   (( segid "    " and resid 47   and name HG1 ))
   (( segid "    " and resid 47   and name HA  ))
      2.400     0.700     0.700 peak   261 spectrum    1 weight  0.10000E+01 volume  0.38780E-02 ppm1      1.383 ppm2      5.949 CV     1
 OR {  261}
   (( segid "    " and resid 47   and name HG2 ))
   (( segid "    " and resid 47   and name HA  ))
 ASSI {  262}
   (( segid "    " and resid 62   and name HG2 ))
   (  segid "    " and resid 61   and name HG1%)
      3.800     1.800     1.800 peak   262 spectrum    1 weight  0.10000E+01 volume  0.30757E-02 ppm1      1.307 ppm2      0.942 CV     1
 ASSI {  263}
   (( segid "    " and resid 62   and name HG2 ))
   (  segid "    " and resid 90   and name HD2%)
      3.500     1.500     1.500 peak   263 spectrum    1 weight  0.10000E+01 volume  0.31138E-02 ppm1      1.292 ppm2      0.755 CV     1
 ASSI {  264}
   (( segid "    " and resid 62   and name HG2 ))
   (( segid "    " and resid 90   and name HB1 ))
      3.400     1.400     1.400 peak   264 spectrum    1 weight  0.10000E+01 volume  0.44320E-02 ppm1      1.310 ppm2      1.971 CV     1
 ASSI {  266}
   (  segid "    " and resid 99   and name HD1%)
   (( segid "    " and resid 99   and name HA  ))
      2.300     0.700     0.700 peak   266 spectrum    1 weight  0.10000E+01 volume  0.43937E-02 ppm1      1.298 ppm2      4.191 CV     1
 ASSI {  269}
   (( segid "    " and resid 62   and name HD2 ))
   (( segid "    " and resid 62   and name HG1 ))
      2.600     0.800     0.800 peak   269 spectrum    1 weight  0.10000E+01 volume  0.33240E-02 ppm1      1.722 ppm2      1.522 CV     1
 OR {  269}
   (( segid "    " and resid 62   and name HD1 ))
   (( segid "    " and resid 62   and name HG1 ))
 ASSI {  271}
   (( segid "    " and resid 47   and name HD2 ))
   (( segid "    " and resid 47   and name HE2 ))
      2.500     0.800     0.800 peak   271 spectrum    1 weight  0.10000E+01 volume  0.38780E-02 ppm1      1.471 ppm2      2.582 CV     1
 OR {  271}
   (( segid "    " and resid 47   and name HD2 ))
   (( segid "    " and resid 47   and name HE1 ))
 ASSI {  274}
   (( segid "    " and resid 63   and name HA1 ))
   (( segid "    " and resid 63   and name HA2 ))
      2.200     0.600     0.600 peak   274 spectrum    1 weight  0.10000E+01 volume  0.43937E-02 ppm1      4.426 ppm2      3.519 CV     1
 ASSI {  275}
   (( segid "    " and resid 126  and name HA2 ))
   (( segid "    " and resid 126  and name HA1 ))
      2.000     0.500     0.500 peak   275 spectrum    1 weight  0.10000E+01 volume  0.40881E-02 ppm1      3.512 ppm2      3.816 CV     1
 ASSI {  278}
   (( segid "    " and resid 63   and name HA2 ))
   (  segid "    " and resid 89   and name HG2%)
      2.400     0.700     0.700 peak   278 spectrum    1 weight  0.10000E+01 volume  0.51387E-02 ppm1      3.512 ppm2      0.983 CV     1
 ASSI {  281}
   (( segid "    " and resid 64   and name HG1 ))
   (( segid "    " and resid 149  and name HB1 ))
      2.900     1.100     1.100 peak   281 spectrum    1 weight  0.10000E+01 volume  0.48140E-02 ppm1      2.454 ppm2      2.669 CV     1
 ASSI {  282}
   (( segid "    " and resid 64   and name HG1 ))
   (( segid "    " and resid 64   and name HA  ))
      3.200     1.300     1.300 peak   282 spectrum    1 weight  0.10000E+01 volume  0.45466E-02 ppm1      2.484 ppm2      4.472 CV     1
 ASSI {  283}
   (( segid "    " and resid 64   and name HG1 ))
   (( segid "    " and resid 149  and name HA  ))
      2.900     1.100     1.100 peak   283 spectrum    1 weight  0.10000E+01 volume  0.54062E-02 ppm1      2.486 ppm2      4.846 CV     1
 ASSI {  287}
   (( segid "    " and resid 64   and name HG1 ))
   (  segid "    " and resid 61   and name HG2%)
      2.900     1.000     1.000 peak   287 spectrum    1 weight  0.10000E+01 volume  0.43937E-02 ppm1      2.484 ppm2      0.780 CV     1
 ASSI {  289}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 65   and name HB  ))
      2.300     0.700     0.700 peak   289 spectrum    1 weight  0.10000E+01 volume  0.50815E-02 ppm1      4.269 ppm2      1.723 CV     1
 ASSI {  290}
   (( segid "    " and resid 65   and name HA  ))
   (  segid "    " and resid 89   and name HG2%)
      3.200     1.300     1.300 peak   290 spectrum    1 weight  0.10000E+01 volume  0.51197E-02 ppm1      4.270 ppm2      0.988 CV     1
 ASSI {  292}
   (( segid "    " and resid 65   and name HA  ))
   (  segid "    " and resid 65   and name HG2%)
      2.800     1.000     1.000 peak   292 spectrum    1 weight  0.10000E+01 volume  0.41836E-02 ppm1      4.266 ppm2      0.464 CV     1
 ASSI {  293}
   (( segid "    " and resid 65   and name HA  ))
   (  segid "    " and resid 66   and name HG2%)
      3.200     1.300     1.300 peak   293 spectrum    1 weight  0.10000E+01 volume  0.54445E-02 ppm1      4.275 ppm2      0.033 CV     1
 ASSI {  295}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 85   and name HG1 ))
      2.700     0.900     0.900 peak   295 spectrum    1 weight  0.10000E+01 volume  0.34768E-02 ppm1      1.749 ppm2      2.046 CV     1
 OR {  295}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 85   and name HG2 ))
 ASSI {  296}
   (( segid "    " and resid 85   and name HB2 ))
   (( segid "    " and resid 85   and name HA  ))
      2.800     1.000     1.000 peak   296 spectrum    1 weight  0.10000E+01 volume  0.37633E-02 ppm1      1.743 ppm2      4.399 CV     1
 ASSI {  298}
   (( segid "    " and resid 65   and name HB  ))
   (  segid "    " and resid 65   and name HG2%)
      2.600     0.800     0.800 peak   298 spectrum    1 weight  0.10000E+01 volume  0.37252E-02 ppm1      1.731 ppm2      0.465 CV     1
 ASSI {  303}
   (  segid "    " and resid 142  and name HG1%)
   (( segid "    " and resid 142  and name HA  ))
      2.600     0.800     0.800 peak   303 spectrum    1 weight  0.10000E+01 volume  0.32858E-02 ppm1      0.851 ppm2      5.069 CV     1
 OR {  303}
   (  segid "    " and resid 142  and name HG2%)
   (( segid "    " and resid 142  and name HA  ))
 ASSI {  308}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 66   and name HB  ))
      2.400     0.700     0.700 peak   308 spectrum    1 weight  0.10000E+01 volume  0.42410E-02 ppm1      5.066 ppm2      1.692 CV     1
 ASSI {  311}
   (( segid "    " and resid 66   and name HA  ))
   (  segid "    " and resid 66   and name HG2%)
      2.900     1.000     1.000 peak   311 spectrum    1 weight  0.10000E+01 volume  0.49096E-02 ppm1      5.067 ppm2      0.021 CV     1
 ASSI {  317}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 85   and name HA  ))
      3.300     1.300     1.300 peak   317 spectrum    1 weight  0.10000E+01 volume  0.59220E-02 ppm1      5.318 ppm2      4.351 CV     1
 ASSI {  318}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 67   and name HB  ))
      2.300     0.600     0.600 peak   318 spectrum    1 weight  0.10000E+01 volume  0.48331E-02 ppm1      5.318 ppm2      3.993 CV     1
 ASSI {  319}
   (( segid "    " and resid 67   and name HA  ))
   (  segid "    " and resid 67   and name HG2%)
      2.600     0.900     0.900 peak   319 spectrum    1 weight  0.10000E+01 volume  0.39926E-02 ppm1      5.315 ppm2      1.070 CV     1
 ASSI {  320}
   (( segid "    " and resid 67   and name HA  ))
   (  segid "    " and resid 87   and name HG2%)
      2.600     0.900     0.900 peak   320 spectrum    1 weight  0.10000E+01 volume  0.48713E-02 ppm1      5.326 ppm2      0.729 CV     1
 ASSI {  321}
   (( segid "    " and resid 87   and name HA  ))
   (  segid "    " and resid 65   and name HG2%)
      3.300     1.300     1.300 peak   321 spectrum    1 weight  0.10000E+01 volume  0.56546E-02 ppm1      5.323 ppm2      0.470 CV     1
 ASSI {  323}
   (( segid "    " and resid 67   and name HB  ))
   (( segid "    " and resid 145  and name HB1 ))
      3.600     3.600     2.400 peak   323 spectrum    1 weight  0.10000E+01 volume  0.50051E-02 ppm1      3.989 ppm2      1.889 CV     1
 ASSI {  328}
   (  segid "    " and resid 67   and name HG2%)
   (( segid "    " and resid 66   and name HB  ))
      3.500     1.500     1.500 peak   328 spectrum    1 weight  0.10000E+01 volume  0.35723E-02 ppm1      1.070 ppm2      1.689 CV     1
 ASSI {  332}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 144  and name HA  ))
      2.300     0.700     0.700 peak   332 spectrum    1 weight  0.10000E+01 volume  0.51006E-02 ppm1      5.593 ppm2      4.644 CV     1
 ASSI {  333}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 68   and name HB  ))
      2.500     0.800     0.800 peak   333 spectrum    1 weight  0.10000E+01 volume  0.39353E-02 ppm1      5.599 ppm2      2.229 CV     1
 ASSI {  336}
   (( segid "    " and resid 68   and name HA  ))
   (  segid "    " and resid 68   and name HG1%)
      2.500     0.800     0.800 peak   336 spectrum    1 weight  0.10000E+01 volume  0.43173E-02 ppm1      5.595 ppm2      1.089 CV     1
 ASSI {  337}
   (( segid "    " and resid 68   and name HA  ))
   (  segid "    " and resid 68   and name HG2%)
      2.800     1.000     1.000 peak   337 spectrum    1 weight  0.10000E+01 volume  0.45275E-02 ppm1      5.595 ppm2      0.961 CV     1
 ASSI {  338}
   (( segid "    " and resid 68   and name HA  ))
   (  segid "    " and resid 142  and name HG1%)
      3.400     1.500     1.500 peak   338 spectrum    1 weight  0.10000E+01 volume  0.47950E-02 ppm1      5.596 ppm2      0.883 CV     1
 ASSI {  341}
   (( segid "    " and resid 68   and name HB  ))
   (  segid "    " and resid 68   and name HG1%)
      2.500     0.800     0.800 peak   341 spectrum    1 weight  0.10000E+01 volume  0.35914E-02 ppm1      2.226 ppm2      1.097 CV     1
 ASSI {  342}
   (( segid "    " and resid 68   and name HB  ))
   (  segid "    " and resid 68   and name HG2%)
      2.400     0.700     0.700 peak   342 spectrum    1 weight  0.10000E+01 volume  0.34768E-02 ppm1      2.219 ppm2      0.958 CV     1
 ASSI {  347}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 143  and name HB  ))
      3.300     1.400     1.400 peak   347 spectrum    1 weight  0.10000E+01 volume  0.59220E-02 ppm1      5.388 ppm2      4.081 CV     1
 ASSI {  348}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 69   and name HB1 ))
      2.600     0.900     0.900 peak   348 spectrum    1 weight  0.10000E+01 volume  0.48331E-02 ppm1      5.386 ppm2      3.183 CV     1
 ASSI {  349}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 69   and name HB2 ))
      2.200     0.600     0.600 peak   349 spectrum    1 weight  0.10000E+01 volume  0.45657E-02 ppm1      5.389 ppm2      3.093 CV     1
 ASSI {  354}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 69   and name HD2 ))
      2.700     0.900     0.900 peak   354 spectrum    1 weight  0.10000E+01 volume  0.45848E-02 ppm1      5.386 ppm2      6.917 CV     1
 ASSI {  357}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 84   and name HA  ))
      2.600     0.800     0.800 peak   357 spectrum    1 weight  0.10000E+01 volume  0.47758E-02 ppm1      5.390 ppm2      4.394 CV     1
 ASSI {  361}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 145  and name HE2 ))
      3.500     1.500     1.500 peak   361 spectrum    1 weight  0.10000E+01 volume  0.57692E-02 ppm1      5.401 ppm2      3.007 CV     1
 ASSI {  365}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 70   and name HB2 ))
      3.300     3.300     2.700 peak   365 spectrum    1 weight  0.10000E+01 volume  0.47376E-02 ppm1      5.373 ppm2      1.228 CV     1
 ASSI {  369}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 79   and name HA  ))
      3.200     3.200     2.800 peak   369 spectrum    1 weight  0.10000E+01 volume  0.41645E-02 ppm1      5.053 ppm2      4.508 CV     1
 ASSI {  370}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 65   and name HA  ))
      2.800     2.800     3.200 peak   370 spectrum    1 weight  0.10000E+01 volume  0.55591E-02 ppm1      5.045 ppm2      4.273 CV     1
 ASSI {  371}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 71   and name HG1 ))
      2.300     0.700     0.700 peak   371 spectrum    1 weight  0.10000E+01 volume  0.52916E-02 ppm1      5.054 ppm2      2.334 CV     1
 ASSI {  372}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 71   and name HB1 ))
      2.200     0.600     0.600 peak   372 spectrum    1 weight  0.10000E+01 volume  0.37442E-02 ppm1      5.057 ppm2      2.198 CV     1
 ASSI {  373}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 82   and name HB2 ))
      2.500     0.800     0.800 peak   373 spectrum    1 weight  0.10000E+01 volume  0.38207E-02 ppm1      5.065 ppm2      2.050 CV     1
 ASSI {  375}
   (( segid "    " and resid 29   and name HB1 ))
   (( segid "    " and resid 30   and name HA  ))
      3.200     1.300     1.300 peak   375 spectrum    1 weight  0.10000E+01 volume  0.48905E-02 ppm1      2.344 ppm2      4.515 CV     1
 ASSI {  377}
   (( segid "    " and resid 71   and name HG1 ))
   (( segid "    " and resid 69   and name HD2 ))
      2.600     0.900     0.900 peak   377 spectrum    1 weight  0.10000E+01 volume  0.49860E-02 ppm1      2.335 ppm2      6.914 CV     1
 ASSI {  379}
   (( segid "    " and resid 71   and name HG2 ))
   (( segid "    " and resid 71   and name HA  ))
      3.200     1.300     1.300 peak   379 spectrum    1 weight  0.10000E+01 volume  0.36678E-02 ppm1      2.188 ppm2      5.043 CV     1
 ASSI {  384}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 61   and name HA  ))
      2.900     2.900     3.100 peak   384 spectrum    1 weight  0.10000E+01 volume  0.53489E-02 ppm1      4.911 ppm2      4.405 CV     1
 ASSI {  386}
   (( segid "    " and resid 72   and name HA  ))
   (  segid "    " and resid 72   and name HG2%)
      2.500     0.800     0.800 peak   386 spectrum    1 weight  0.10000E+01 volume  0.42982E-02 ppm1      4.904 ppm2      1.178 CV     1
 ASSI {  387}
   (( segid "    " and resid 72   and name HA  ))
   (  segid "    " and resid 140  and name HD1%)
      3.600     1.700     1.700 peak   387 spectrum    1 weight  0.10000E+01 volume  0.45466E-02 ppm1      4.906 ppm2      0.941 CV     1
 ASSI {  388}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 140  and name HA  ))
      2.300     0.600     0.600 peak   388 spectrum    1 weight  0.10000E+01 volume  0.46994E-02 ppm1      4.909 ppm2      5.297 CV     1
 ASSI {  389}
   (( segid "    " and resid 72   and name HB  ))
   (( segid "    " and resid 81   and name HB1 ))
      3.600     1.600     1.600 peak   389 spectrum    1 weight  0.10000E+01 volume  0.47376E-02 ppm1      4.014 ppm2      2.073 CV     1
 ASSI {  391}
   (( segid "    " and resid 72   and name HB  ))
   (( segid "    " and resid 81   and name HA  ))
      3.700     1.700     1.700 peak   391 spectrum    1 weight  0.10000E+01 volume  0.43556E-02 ppm1      4.025 ppm2      4.660 CV     1
 ASSI {  393}
   (  segid "    " and resid 72   and name HG2%)
   (( segid "    " and resid 72   and name HB  ))
      2.400     0.700     0.700 peak   393 spectrum    1 weight  0.10000E+01 volume  0.33813E-02 ppm1      1.179 ppm2      4.025 CV     1
 ASSI {  396}
   (  segid "    " and resid 72   and name HG2%)
   (( segid "    " and resid 81   and name HB1 ))
      3.500     1.600     1.600 peak   396 spectrum    1 weight  0.10000E+01 volume  0.49096E-02 ppm1      1.176 ppm2      2.094 CV     1
 ASSI {  397}
   (  segid "    " and resid 72   and name HG2%)
   (( segid "    " and resid 140  and name HA  ))
      3.200     1.200     1.200 peak   397 spectrum    1 weight  0.10000E+01 volume  0.46421E-02 ppm1      1.173 ppm2      5.287 CV     1
 ASSI {  398}
   (  segid "    " and resid 72   and name HG2%)
   (( segid "    " and resid 73   and name HA  ))
      2.600     2.600     3.400 peak   398 spectrum    1 weight  0.10000E+01 volume  0.50815E-02 ppm1      1.176 ppm2      5.547 CV     1
 ASSI {  399}
   (  segid "    " and resid 72   and name HG2%)
   (  segid "    " and resid 122  and name HE% )
      2.600     0.900     0.900 peak   399 spectrum    1 weight  0.10000E+01 volume  0.47567E-02 ppm1      1.179 ppm2      6.630 CV     1
 ASSI {  401}
   (  segid "    " and resid 72   and name HG2%)
   (  segid "    " and resid 96   and name HG2%)
      3.100     3.100     2.900 peak   401 spectrum    1 weight  0.10000E+01 volume  0.50624E-02 ppm1      1.165 ppm2      0.276 CV     1
 ASSI {  408}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 79   and name HA  ))
      3.300     1.400     1.400 peak   408 spectrum    1 weight  0.10000E+01 volume  0.46612E-02 ppm1      3.722 ppm2      4.513 CV     1
 ASSI {  410}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 74   and name HA  ))
      2.800     2.800     3.200 peak   410 spectrum    1 weight  0.10000E+01 volume  0.46230E-02 ppm1      3.725 ppm2      4.738 CV     1
 OR {  410}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 74   and name HA  ))
 ASSI {  411}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 73   and name HA  ))
      2.400     0.700     0.700 peak   411 spectrum    1 weight  0.10000E+01 volume  0.41455E-02 ppm1      3.722 ppm2      5.545 CV     1
 ASSI {  412}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 139  and name HB1 ))
      2.600     2.600     3.400 peak   412 spectrum    1 weight  0.10000E+01 volume  0.46039E-02 ppm1      3.721 ppm2      2.893 CV     1
 ASSI {  414}
   (( segid "    " and resid 73   and name HB1 ))
   (  segid "    " and resid 74   and name HD2%)
      3.000     3.000     3.000 peak   414 spectrum    1 weight  0.10000E+01 volume  0.56164E-02 ppm1      3.719 ppm2      0.834 CV     1
 ASSI {  415}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 47   and name HA  ))
      2.900     2.900     3.100 peak   415 spectrum    1 weight  0.10000E+01 volume  0.61130E-02 ppm1      4.724 ppm2      5.914 CV     1
 ASSI {  416}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 36   and name HE3 ))
      2.600     2.600     3.400 peak   416 spectrum    1 weight  0.10000E+01 volume  0.64760E-02 ppm1      4.719 ppm2      7.283 CV     1
 OR {  416}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 36   and name HD1 ))
 ASSI {  419}
   (( segid "    " and resid 74   and name HB2 ))
   (( segid "    " and resid 78   and name HB  ))
      2.500     0.800     0.800 peak   419 spectrum    1 weight  0.10000E+01 volume  0.44128E-02 ppm1      1.959 ppm2      4.066 CV     1
 OR {  419}
   (( segid "    " and resid 74   and name HB1 ))
   (( segid "    " and resid 78   and name HB  ))
 ASSI {  420}
   (( segid "    " and resid 74   and name HB1 ))
   (( segid "    " and resid 74   and name HA  ))
      2.300     0.600     0.600 peak   420 spectrum    1 weight  0.10000E+01 volume  0.54254E-02 ppm1      1.954 ppm2      4.757 CV     1
 OR {  420}
   (( segid "    " and resid 74   and name HB2 ))
   (( segid "    " and resid 74   and name HA  ))
 ASSI {  422}
   (( segid "    " and resid 90   and name HB1 ))
   (( segid "    " and resid 90   and name HG  ))
      2.300     0.700     0.700 peak   422 spectrum    1 weight  0.10000E+01 volume  0.36869E-02 ppm1      1.955 ppm2      1.602 CV     1
 ASSI {  423}
   (( segid "    " and resid 90   and name HB1 ))
   (  segid "    " and resid 90   and name HD1%)
      2.900     1.100     1.100 peak   423 spectrum    1 weight  0.10000E+01 volume  0.43937E-02 ppm1      1.971 ppm2      1.064 CV     1
 ASSI {  425}
   (( segid "    " and resid 90   and name HB1 ))
   (  segid "    " and resid 90   and name HD2%)
      2.400     0.700     0.700 peak   425 spectrum    1 weight  0.10000E+01 volume  0.37252E-02 ppm1      1.958 ppm2      0.750 CV     1
 ASSI {  426}
   (( segid "    " and resid 90   and name HB1 ))
   (  segid "    " and resid 66   and name HG2%)
      3.100     1.200     1.200 peak   426 spectrum    1 weight  0.10000E+01 volume  0.50241E-02 ppm1      1.967 ppm2      0.029 CV     1
 ASSI {  428}
   (( segid "    " and resid 74   and name HB2 ))
   (  segid "    " and resid 74   and name HD2%)
      2.900     1.100     1.100 peak   428 spectrum    1 weight  0.10000E+01 volume  0.38397E-02 ppm1      1.929 ppm2      0.855 CV     1
 ASSI {  436}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 70   and name HA  ))
      3.500     1.500     1.500 peak   436 spectrum    1 weight  0.10000E+01 volume  0.32667E-02 ppm1      0.944 ppm2      5.378 CV     1
 ASSI {  442}
   (  segid "    " and resid 74   and name HD2%)
   (( segid "    " and resid 74   and name HA  ))
      2.400     0.700     0.700 peak   442 spectrum    1 weight  0.10000E+01 volume  0.31329E-02 ppm1      0.863 ppm2      4.758 CV     1
 ASSI {  443}
   (  segid "    " and resid 74   and name HD2%)
   (( segid "    " and resid 138  and name HA  ))
      3.400     1.400     1.400 peak   443 spectrum    1 weight  0.10000E+01 volume  0.35914E-02 ppm1      0.861 ppm2      5.247 CV     1
 ASSI {  444}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 75   and name HB1 ))
      2.700     0.900     0.900 peak   444 spectrum    1 weight  0.10000E+01 volume  0.37252E-02 ppm1      3.989 ppm2      2.038 CV     1
 ASSI {  445}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 75   and name HG1 ))
      3.100     1.200     1.200 peak   445 spectrum    1 weight  0.10000E+01 volume  0.43365E-02 ppm1      3.985 ppm2      2.211 CV     1
 ASSI {  446}
   (( segid "    " and resid 75   and name HB1 ))
   (( segid "    " and resid 75   and name HG1 ))
      3.100     1.200     1.200 peak   446 spectrum    1 weight  0.10000E+01 volume  0.25598E-02 ppm1      2.066 ppm2      2.266 CV     1
 ASSI {  448}
   (( segid "    " and resid 108  and name HB  ))
   (( segid "    " and resid 108  and name HA  ))
      2.400     0.700     0.700 peak   448 spectrum    1 weight  0.10000E+01 volume  0.45657E-02 ppm1      2.054 ppm2      3.332 CV     1
 ASSI {  450}
   (( segid "    " and resid 75   and name HB1 ))
   (  segid "    " and resid 137  and name HB% )
      2.800     1.000     1.000 peak   450 spectrum    1 weight  0.10000E+01 volume  0.38780E-02 ppm1      2.044 ppm2      1.459 CV     1
 ASSI {  453}
   (( segid "    " and resid 75   and name HB1 ))
   (  segid "    " and resid 74   and name HD2%)
      3.500     3.500     2.500 peak   453 spectrum    1 weight  0.10000E+01 volume  0.37061E-02 ppm1      2.048 ppm2      0.838 CV     1
 ASSI {  456}
   (( segid "    " and resid 77   and name HA1 ))
   (( segid "    " and resid 74   and name HA  ))
      3.500     3.500     2.500 peak   456 spectrum    1 weight  0.10000E+01 volume  0.49286E-02 ppm1      4.400 ppm2      4.750 CV     1
 ASSI {  457}
   (( segid "    " and resid 77   and name HA1 ))
   (( segid "    " and resid 77   and name HA2 ))
      2.300     0.700     0.700 peak   457 spectrum    1 weight  0.10000E+01 volume  0.43173E-02 ppm1      4.403 ppm2      3.765 CV     1
 ASSI {  461}
   (( segid "    " and resid 57   and name HB1 ))
   (( segid "    " and resid 57   and name HA  ))
      2.600     0.800     0.800 peak   461 spectrum    1 weight  0.10000E+01 volume  0.38016E-02 ppm1      4.035 ppm2      4.355 CV     1
 OR {  461}
   (( segid "    " and resid 57   and name HB2 ))
   (( segid "    " and resid 57   and name HA  ))
 ASSI {  464}
   (( segid "    " and resid 78   and name HA  ))
   (  segid "    " and resid 78   and name HG2%)
      2.800     1.000     1.000 peak   464 spectrum    1 weight  0.10000E+01 volume  0.36869E-02 ppm1      4.062 ppm2      1.239 CV     1
 ASSI {  467}
   (( segid "    " and resid 78   and name HA  ))
   (( segid "    " and resid 79   and name HG1 ))
      3.300     1.300     1.300 peak   467 spectrum    1 weight  0.10000E+01 volume  0.53680E-02 ppm1      4.057 ppm2      1.724 CV     1
 ASSI {  470}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 73   and name HA  ))
      1.600     0.300     0.600 peak   470 spectrum    1 weight  0.10000E+01 volume  0.42982E-02 ppm1      4.513 ppm2      5.545 CV     1
 ASSI {  471}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 79   and name HB1 ))
      2.300     0.600     0.600 peak   471 spectrum    1 weight  0.10000E+01 volume  0.44702E-02 ppm1      4.507 ppm2      1.885 CV     1
 ASSI {  473}
   (( segid "    " and resid 18   and name HB1 ))
   (( segid "    " and resid 18   and name HA  ))
      2.800     1.000     1.000 peak   473 spectrum    1 weight  0.10000E+01 volume  0.37442E-02 ppm1      1.874 ppm2      4.152 CV     1
 OR {  473}
   (( segid "    " and resid 18   and name HB2 ))
   (( segid "    " and resid 18   and name HA  ))
 ASSI {  474}
   (( segid "    " and resid 59   and name HB1 ))
   (( segid "    " and resid 104  and name HB1 ))
      3.100     3.100     2.900 peak   474 spectrum    1 weight  0.10000E+01 volume  0.38397E-02 ppm1      1.882 ppm2      2.480 CV     1
 ASSI {  475}
   (( segid "    " and resid 79   and name HG1 ))
   (( segid "    " and resid 79   and name HB1 ))
      3.100     1.200     1.200 peak   475 spectrum    1 weight  0.10000E+01 volume  0.28082E-02 ppm1      1.693 ppm2      1.886 CV     1
 ASSI {  476}
   (( segid "    " and resid 79   and name HG1 ))
   (( segid "    " and resid 79   and name HD1 ))
      2.900     1.100     1.100 peak   476 spectrum    1 weight  0.10000E+01 volume  0.34004E-02 ppm1      1.691 ppm2      3.241 CV     1
 ASSI {  477}
   (( segid "    " and resid 79   and name HG1 ))
   (( segid "    " and resid 79   and name HA  ))
      3.000     1.100     1.100 peak   477 spectrum    1 weight  0.10000E+01 volume  0.41072E-02 ppm1      1.694 ppm2      4.504 CV     1
 ASSI {  478}
   (( segid "    " and resid 79   and name HD1 ))
   (( segid "    " and resid 79   and name HD2 ))
      2.300     0.700     0.700 peak   478 spectrum    1 weight  0.10000E+01 volume  0.17002E-02 ppm1      3.207 ppm2      3.213 CV     1
 ASSI {  482}
   (( segid "    " and resid 79   and name HD1 ))
   (( segid "    " and resid 71   and name HB1 ))
      2.700     0.900     0.900 peak   482 spectrum    1 weight  0.10000E+01 volume  0.44511E-02 ppm1      3.246 ppm2      2.198 CV     1
 OR {  482}
   (( segid "    " and resid 79   and name HD2 ))
   (( segid "    " and resid 71   and name HB1 ))
 OR {  482}
   (( segid "    " and resid 79   and name HD1 ))
   (( segid "    " and resid 71   and name HG2 ))
 ASSI {  483}
   (( segid "    " and resid 128  and name HD1 ))
   (( segid "    " and resid 128  and name HB1 ))
      2.800     1.000     1.000 peak   483 spectrum    1 weight  0.10000E+01 volume  0.45848E-02 ppm1      3.230 ppm2      2.007 CV     1
 OR {  483}
   (( segid "    " and resid 128  and name HD2 ))
   (( segid "    " and resid 128  and name HB1 ))
 ASSI {  484}
   (( segid "    " and resid 79   and name HD1 ))
   (( segid "    " and resid 79   and name HB1 ))
      2.400     0.700     0.700 peak   484 spectrum    1 weight  0.10000E+01 volume  0.39735E-02 ppm1      3.238 ppm2      1.884 CV     1
 ASSI {  488}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 110  and name HG2 ))
      2.600     0.900     0.900 peak   488 spectrum    1 weight  0.10000E+01 volume  0.54445E-02 ppm1      4.377 ppm2      2.715 CV     1
 OR {  488}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 110  and name HG1 ))
 ASSI {  490}
   (( segid "    " and resid 82   and name HB2 ))
   (( segid "    " and resid 83   and name HA  ))
      3.500     1.500     1.500 peak   490 spectrum    1 weight  0.10000E+01 volume  0.34386E-02 ppm1      2.113 ppm2      5.045 CV     1
 ASSI {  493}
   (( segid "    " and resid 81   and name HG1 ))
   (( segid "    " and resid 72   and name HB  ))
      2.000     0.500     0.500 peak   493 spectrum    1 weight  0.10000E+01 volume  0.45275E-02 ppm1      2.401 ppm2      4.026 CV     1
 ASSI {  494}
   (( segid "    " and resid 130  and name HB1 ))
   (( segid "    " and resid 131  and name HA  ))
      3.400     3.400     2.600 peak   494 spectrum    1 weight  0.10000E+01 volume  0.49286E-02 ppm1      2.386 ppm2      4.330 CV     1
 ASSI {  497}
   (( segid "    " and resid 81   and name HG2 ))
   (( segid "    " and resid 72   and name HB  ))
      2.100     0.500     0.500 peak   497 spectrum    1 weight  0.10000E+01 volume  0.46994E-02 ppm1      2.165 ppm2      4.023 CV     1
 ASSI {  498}
   (( segid "    " and resid 81   and name HG2 ))
   (( segid "    " and resid 71   and name HA  ))
      3.300     1.300     1.300 peak   498 spectrum    1 weight  0.10000E+01 volume  0.44892E-02 ppm1      2.190 ppm2      5.052 CV     1
 ASSI {  499}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 71   and name HG1 ))
      2.500     0.800     0.800 peak   499 spectrum    1 weight  0.10000E+01 volume  0.55017E-02 ppm1      5.052 ppm2      2.327 CV     1
 ASSI {  500}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 82   and name HB2 ))
      2.500     0.800     0.800 peak   500 spectrum    1 weight  0.10000E+01 volume  0.42027E-02 ppm1      5.066 ppm2      2.048 CV     1
 OR {  500}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 82   and name HG2 ))
 ASSI {  504}
   (( segid "    " and resid 82   and name HG1 ))
   (( segid "    " and resid 82   and name HG2 ))
      2.400     0.700     0.700 peak   504 spectrum    1 weight  0.10000E+01 volume  0.25025E-02 ppm1      2.251 ppm2      2.065 CV     1
 ASSI {  506}
   (( segid "    " and resid 34   and name HG1 ))
   (( segid "    " and resid 34   and name HA  ))
      3.000     1.100     1.100 peak   506 spectrum    1 weight  0.10000E+01 volume  0.37633E-02 ppm1      2.256 ppm2      4.289 CV     1
 ASSI {  510}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 67   and name HB  ))
      2.300     0.600     0.600 peak   510 spectrum    1 weight  0.10000E+01 volume  0.47376E-02 ppm1      2.051 ppm2      3.988 CV     1
 OR {  510}
   (( segid "    " and resid 85   and name HG1 ))
   (( segid "    " and resid 67   and name HB  ))
 ASSI {  511}
   (( segid "    " and resid 85   and name HG1 ))
   (( segid "    " and resid 85   and name HA  ))
      2.400     0.700     0.700 peak   511 spectrum    1 weight  0.10000E+01 volume  0.36296E-02 ppm1      2.047 ppm2      4.396 CV     1
 ASSI {  512}
   (( segid "    " and resid 82   and name HG2 ))
   (( segid "    " and resid 82   and name HA  ))
      2.700     0.900     0.900 peak   512 spectrum    1 weight  0.10000E+01 volume  0.46039E-02 ppm1      2.058 ppm2      5.063 CV     1
 ASSI {  514}
   (( segid "    " and resid 18   and name HG2 ))
   (  segid "    " and resid 19   and name HD% )
      3.000     3.000     3.000 peak   514 spectrum    1 weight  0.10000E+01 volume  0.55972E-02 ppm1      2.050 ppm2      7.286 CV     1
 OR {  514}
   (( segid "    " and resid 18   and name HG2 ))
   (  segid "    " and resid 19   and name HE% )
 ASSI {  517}
   (( segid "    " and resid 85  and name HG1 ))
   (  segid "    " and resid 67  and name HG2%)
      3.500     1.600     1.600 peak   517 spectrum    1 weight  0.10000E+01 volume  0.32476E-02 ppm1      2.051 ppm2      1.069 CV     1
 ASSI {  525}
   (( segid "    " and resid 104  and name HA  ))
   (( segid "    " and resid 104  and name HB1 ))
      2.400     0.700     0.700 peak   525 spectrum    1 weight  0.10000E+01 volume  0.46803E-02 ppm1      4.320 ppm2      2.430 CV     1
 ASSI {  526}
   (( segid "    " and resid 104  and name HA  ))
   (( segid "    " and resid 104  and name HG2 ))
      3.200     1.300     1.300 peak   526 spectrum    1 weight  0.10000E+01 volume  0.52916E-02 ppm1      4.311 ppm2      1.777 CV     1
 ASSI {  527}
   (( segid "    " and resid 104  and name HA  ))
   (( segid "    " and resid 104  and name HB2 ))
      2.900     1.100     1.100 peak   527 spectrum    1 weight  0.10000E+01 volume  0.43937E-02 ppm1      4.315 ppm2      1.690 CV     1
 ASSI {  529}
   (( segid "    " and resid 104  and name HA  ))
   (  segid "    " and resid 90   and name HD2%)
      2.600     0.900     0.900 peak   529 spectrum    1 weight  0.10000E+01 volume  0.48905E-02 ppm1      4.321 ppm2      0.754 CV     1
 ASSI {  541}
   (( segid "    " and resid 145  and name HB1 ))
   (( segid "    " and resid 145  and name HG2 ))
      2.500     0.800     0.800 peak   541 spectrum    1 weight  0.10000E+01 volume  0.40308E-02 ppm1      1.878 ppm2      1.421 CV     1
 ASSI {  542}
   (( segid "    " and resid 124  and name HG2 ))
   (( segid "    " and resid 124  and name HD1 ))
      2.900     1.100     1.100 peak   542 spectrum    1 weight  0.10000E+01 volume  0.40308E-02 ppm1      1.864 ppm2      3.958 CV     1
 OR {  542}
   (( segid "    " and resid 124  and name HG2 ))
   (( segid "    " and resid 124  and name HA  ))
 ASSI {  546}
   (( segid "    " and resid 117  and name HA  ))
   (( segid "    " and resid 117  and name HB1 ))
      2.200     0.600     0.600 peak   546 spectrum    1 weight  0.10000E+01 volume  0.47567E-02 ppm1      4.469 ppm2      2.994 CV     1
 ASSI {  549}
   (( segid "    " and resid 141  and name HB1 ))
   (( segid "    " and resid 142  and name HA  ))
      3.100     3.100     2.900 peak   549 spectrum    1 weight  0.10000E+01 volume  0.45275E-02 ppm1      2.032 ppm2      5.058 CV     1
 OR {  549}
   (( segid "    " and resid 141  and name HB2 ))
   (( segid "    " and resid 142  and name HA  ))
 ASSI {  552}
   (( segid "    " and resid 141  and name HB2 ))
   (( segid "    " and resid 141  and name HA  ))
      2.200     0.600     0.600 peak   552 spectrum    1 weight  0.10000E+01 volume  0.39353E-02 ppm1      1.960 ppm2      5.228 CV     1
 ASSI {  557}
   (( segid "    " and resid 141  and name HG1 ))
   (( segid "    " and resid 141  and name HA  ))
      2.500     0.800     0.800 peak   557 spectrum    1 weight  0.10000E+01 volume  0.40117E-02 ppm1      2.013 ppm2      5.230 CV     1
 ASSI {  559}
   (( segid "    " and resid 85   and name HG1 ))
   (  segid "    " and resid 67   and name HG2%)
      4.200     2.200     1.800 peak   559 spectrum    1 weight  0.10000E+01 volume  0.33431E-02 ppm1      2.048 ppm2      1.067 CV     1
 ASSI {  560}
   (( segid "    " and resid 141  and name HG2 ))
   (  segid "    " and resid 111  and name HG2%)
      3.000     1.100     1.100 peak   560 spectrum    1 weight  0.10000E+01 volume  0.40117E-02 ppm1      1.969 ppm2      1.198 CV     1
 ASSI {  561}
   (( segid "    " and resid 141  and name HG1 ))
   (  segid "    " and resid 142  and name HG1%)
      3.200     3.200     2.800 peak   561 spectrum    1 weight  0.10000E+01 volume  0.40117E-02 ppm1      2.016 ppm2      0.833 CV     1
 ASSI {  572}
   (( segid "    " and resid 132  and name HG11))
   (  segid "    " and resid 132  and name HD1%)
      2.500     0.800     0.800 peak   572 spectrum    1 weight  0.10000E+01 volume  0.38207E-02 ppm1      1.011 ppm2      0.459 CV     1
 ASSI {  577}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 144  and name HA  ))
      3.000     3.000     3.000 peak   577 spectrum    1 weight  0.10000E+01 volume  0.45657E-02 ppm1      5.330 ppm2      4.725 CV     1
 ASSI {  579}
   (( segid "    " and resid 87   and name HA  ))
   (( segid "    " and resid 87   and name HB  ))
      2.500     0.800     0.800 peak   579 spectrum    1 weight  0.10000E+01 volume  0.48140E-02 ppm1      5.357 ppm2      1.892 CV     1
 ASSI {  581}
   (( segid "    " and resid 87   and name HA  ))
   (  segid "    " and resid 87   and name HG1%)
      2.800     1.000     1.000 peak   581 spectrum    1 weight  0.10000E+01 volume  0.40499E-02 ppm1      5.343 ppm2      0.987 CV     1
 ASSI {  582}
   (( segid "    " and resid 87   and name HA  ))
   (  segid "    " and resid 87   and name HG2%)
      2.500     0.800     0.800 peak   582 spectrum    1 weight  0.10000E+01 volume  0.41072E-02 ppm1      5.354 ppm2      0.730 CV     1
 ASSI {  589}
   (  segid "    " and resid 87   and name HG1%)
   (  segid "    " and resid 87   and name HG2%)
      2.900     1.100     1.100 peak   589 spectrum    1 weight  0.10000E+01 volume  0.27699E-02 ppm1      0.984 ppm2      0.733 CV     1
 ASSI {  591}
   (  segid "    " and resid 87   and name HG2%)
   (  segid "    " and resid 67   and name HG2%)
      2.600     0.800     0.800 peak   591 spectrum    1 weight  0.10000E+01 volume  0.40881E-02 ppm1      0.732 ppm2      1.072 CV     1
 ASSI {  596}
   (( segid "    " and resid 88   and name HA  ))
   (  segid "    " and resid 88   and name HD% )
      3.200     1.300     1.300 peak   596 spectrum    1 weight  0.10000E+01 volume  0.49860E-02 ppm1      4.965 ppm2      6.967 CV     1
 ASSI {  597}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 89   and name HA  ))
      3.000     3.000     3.000 peak   597 spectrum    1 weight  0.10000E+01 volume  0.48905E-02 ppm1      4.974 ppm2      4.613 CV     1
 ASSI {  598}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 88   and name HB1 ))
      2.600     0.800     0.800 peak   598 spectrum    1 weight  0.10000E+01 volume  0.42218E-02 ppm1      4.969 ppm2      3.147 CV     1
 ASSI {  602}
   (( segid "    " and resid 88   and name HB1 ))
   (  segid "    " and resid 88   and name HE% )
      3.200     1.300     1.300 peak   602 spectrum    1 weight  0.10000E+01 volume  0.50051E-02 ppm1      3.148 ppm2      7.178 CV     1
 ASSI {  603}
   (( segid "    " and resid 88   and name HB1 ))
   (  segid "    " and resid 95   and name HG1%)
      2.500     0.800     0.800 peak   603 spectrum    1 weight  0.10000E+01 volume  0.45084E-02 ppm1      3.142 ppm2      0.325 CV     1
 ASSI {  604}
   (( segid "    " and resid 88   and name HB1 ))
   (  segid "    " and resid 95   and name HG2%)
      3.200     1.300     1.300 peak   604 spectrum    1 weight  0.10000E+01 volume  0.52343E-02 ppm1      3.136 ppm2      0.094 CV     1
 ASSI {  605}
   (( segid "    " and resid 145  and name HE2 ))
   (( segid "    " and resid 143  and name HB  ))
      2.800     1.000     1.000 peak   605 spectrum    1 weight  0.10000E+01 volume  0.46803E-02 ppm1      3.006 ppm2      4.090 CV     1
 OR {  605}
   (( segid "    " and resid 145  and name HE1 ))
   (( segid "    " and resid 143  and name HB  ))
 ASSI {  606}
   (( segid "    " and resid 145  and name HE2 ))
   (( segid "    " and resid 144  and name HA  ))
      1.600     1.600     4.400 peak   606 spectrum    1 weight  0.10000E+01 volume  0.37252E-02 ppm1      3.016 ppm2      4.617 CV     1
 OR {  606}
   (( segid "    " and resid 145  and name HE1 ))
   (( segid "    " and resid 144  and name HA  ))
 ASSI {  608}
   (( segid "    " and resid 145  and name HE1 ))
   (( segid "    " and resid 145  and name HB1 ))
      2.400     0.700     0.700 peak   608 spectrum    1 weight  0.10000E+01 volume  0.42791E-02 ppm1      3.005 ppm2      1.887 CV     1
 OR {  608}
   (( segid "    " and resid 145  and name HE2 ))
   (( segid "    " and resid 145  and name HB1 ))
 ASSI {  609}
   (( segid "    " and resid 145  and name HE2 ))
   (( segid "    " and resid 145  and name HD1 ))
      2.600     0.800     0.800 peak   609 spectrum    1 weight  0.10000E+01 volume  0.36487E-02 ppm1      3.014 ppm2      1.772 CV     1
 OR {  609}
   (( segid "    " and resid 145  and name HE1 ))
   (( segid "    " and resid 145  and name HD2 ))
 OR {  609}
   (( segid "    " and resid 145  and name HE1 ))
   (( segid "    " and resid 145  and name HD1 ))
 OR {  609}
   (( segid "    " and resid 145  and name HE2 ))
   (( segid "    " and resid 145  and name HD2 ))
 ASSI {  611}
   (( segid "    " and resid 145  and name HE2 ))
   (( segid "    " and resid 145  and name HG1 ))
      3.000     1.100     1.100 peak   611 spectrum    1 weight  0.10000E+01 volume  0.44702E-02 ppm1      3.001 ppm2      1.576 CV     1
 OR {  611}
   (( segid "    " and resid 145  and name HE1 ))
   (( segid "    " and resid 145  and name HG1 ))
 ASSI {  612}
   (( segid "    " and resid 145  and name HE1 ))
   (( segid "    " and resid 145  and name HG2 ))
      2.600     0.900     0.900 peak   612 spectrum    1 weight  0.10000E+01 volume  0.42218E-02 ppm1      3.001 ppm2      1.415 CV     1
 OR {  612}
   (( segid "    " and resid 145  and name HE2 ))
   (( segid "    " and resid 145  and name HG2 ))
 ASSI {  613}
   (( segid "    " and resid 145  and name HE2 ))
   (  segid "    " and resid  67  and name HG2%)
      2.600     0.900     0.900 peak   613 spectrum    1 weight  0.10000E+01 volume  0.42410E-02 ppm1      3.005 ppm2      1.064 CV     1
 OR {  613}
   (( segid "    " and resid 145  and name HE1 ))
   (  segid "    " and resid  67  and name HG2%)
 ASSI {  615}
   (( segid "    " and resid 89   and name HB  ))
   (( segid "    " and resid 92   and name HB1 ))
      2.200     0.600     0.600 peak   615 spectrum    1 weight  0.10000E+01 volume  0.56546E-02 ppm1      4.153 ppm2      2.898 CV     1
 ASSI {  616}
   (( segid "    " and resid 89   and name HB  ))
   (( segid "    " and resid 92   and name HB2 ))
      2.900     1.000     1.000 peak   616 spectrum    1 weight  0.10000E+01 volume  0.46803E-02 ppm1      4.146 ppm2      2.681 CV     1
 ASSI {  618}
   (( segid "    " and resid 89   and name HB  ))
   (  segid "    " and resid 89   and name HG2%)
      2.600     0.800     0.800 peak   618 spectrum    1 weight  0.10000E+01 volume  0.41455E-02 ppm1      4.138 ppm2      0.986 CV     1
 ASSI {  621}
   (  segid "    " and resid 108  and name HG1%)
   (( segid "    " and resid 108  and name HA  ))
      2.800     1.000     1.000 peak   621 spectrum    1 weight  0.10000E+01 volume  0.34577E-02 ppm1      0.944 ppm2      3.339 CV     1
 ASSI {  623}
   (  segid "    " and resid 68   and name HG2%)
   (  segid "    " and resid 88   and name HE% )
      2.200     0.600     0.600 peak   623 spectrum    1 weight  0.10000E+01 volume  0.43556E-02 ppm1      0.960 ppm2      7.178 CV     1
 ASSI {  629}
   (( segid "    " and resid 90   and name HB1 ))
   (( segid "    " and resid 90   and name HA  ))
      2.500     0.800     0.800 peak   629 spectrum    1 weight  0.10000E+01 volume  0.43746E-02 ppm1      1.958 ppm2      4.364 CV     1
 ASSI {  640}
   (( segid "    " and resid 59   and name HG1 ))
   (( segid "    " and resid 59   and name HD2 ))
      2.900     1.100     1.100 peak   640 spectrum    1 weight  0.10000E+01 volume  0.45848E-02 ppm1      1.772 ppm2      3.076 CV     1
 ASSI {  641}
   (( segid "    " and resid 59   and name HG1 ))
   (( segid "    " and resid 59   and name HA  ))
      3.100     1.200     1.200 peak   641 spectrum    1 weight  0.10000E+01 volume  0.46421E-02 ppm1      1.778 ppm2      5.198 CV     1
 ASSI {  647}
   (  segid "    " and resid 45   and name HD1%)
   (( segid "    " and resid 98   and name HA  ))
      2.500     0.800     0.800 peak   647 spectrum    1 weight  0.10000E+01 volume  0.34577E-02 ppm1      0.797 ppm2      3.842 CV     1
 ASSI {  652}
   (( segid "    " and resid 91   and name HA1 ))
   (( segid "    " and resid 91   and name HA2 ))
      2.000     0.500     0.500 peak   652 spectrum    1 weight  0.10000E+01 volume  0.42982E-02 ppm1      4.268 ppm2      3.935 CV     1
 ASSI {  654}
   (( segid "    " and resid 91   and name HA2 ))
   (( segid "    " and resid 100  and name HA  ))
      2.800     2.800     3.200 peak   654 spectrum    1 weight  0.10000E+01 volume  0.56355E-02 ppm1      3.928 ppm2      4.661 CV     1
 ASSI {  657}
   (( segid "    " and resid 149  and name HA  ))
   (( segid "    " and resid 148  and name HA  ))
      3.200     1.300     1.300 peak   657 spectrum    1 weight  0.10000E+01 volume  0.46230E-02 ppm1      4.852 ppm2      4.606 CV     1
 ASSI {  658}
   (( segid "    " and resid 149  and name HA  ))
   (( segid "    " and resid 64   and name HA  ))
      2.300     0.600     0.600 peak   658 spectrum    1 weight  0.10000E+01 volume  0.46421E-02 ppm1      4.853 ppm2      4.481 CV     1
 ASSI {  659}
   (( segid "    " and resid 92   and name HA  ))
   (( segid "    " and resid 92   and name HB1 ))
      2.800     1.000     1.000 peak   659 spectrum    1 weight  0.10000E+01 volume  0.53489E-02 ppm1      4.846 ppm2      2.897 CV     1
 ASSI {  660}
   (( segid "    " and resid 92   and name HA  ))
   (( segid "    " and resid 92   and name HB2 ))
      2.500     0.800     0.800 peak   660 spectrum    1 weight  0.10000E+01 volume  0.51006E-02 ppm1      4.848 ppm2      2.695 CV     1
 ASSI {  661}
   (( segid "    " and resid 149  and name HA  ))
   (( segid "    " and resid 149  and name HB2 ))
      2.400     0.700     0.700 peak   661 spectrum    1 weight  0.10000E+01 volume  0.53107E-02 ppm1      4.838 ppm2      2.509 CV     1
 ASSI {  662}
   (( segid "    " and resid 92   and name HB2 ))
   (( segid "    " and resid 92   and name HB1 ))
      2.200     0.600     0.600 peak   662 spectrum    1 weight  0.10000E+01 volume  0.34959E-02 ppm1      2.677 ppm2      2.895 CV     1
 ASSI {  667}
   (( segid "    " and resid 92   and name HB1 ))
   (  segid "    " and resid 89   and name HG2%)
      3.100     1.200     1.200 peak   667 spectrum    1 weight  0.10000E+01 volume  0.49477E-02 ppm1      2.895 ppm2      0.989 CV     1
 ASSI {  669}
   (( segid "    " and resid 93   and name HA  ))
   (( segid "    " and resid 93   and name HB1 ))
      2.500     0.800     0.800 peak   669 spectrum    1 weight  0.10000E+01 volume  0.40499E-02 ppm1      4.273 ppm2      3.204 CV     1
 ASSI {  671}
   (( segid "    " and resid 93   and name HA  ))
   (  segid "    " and resid 95   and name HG1%)
      3.400     3.400     2.600 peak   671 spectrum    1 weight  0.10000E+01 volume  0.44511E-02 ppm1      4.295 ppm2      0.324 CV     1
 ASSI {  672}
   (( segid "    " and resid 93   and name HA  ))
   (  segid "    " and resid 95   and name HG2%)
      2.700     0.900     0.900 peak   672 spectrum    1 weight  0.10000E+01 volume  0.48331E-02 ppm1      4.293 ppm2      0.091 CV     1
 ASSI {  673}
   (( segid "    " and resid 93   and name HB1 ))
   (( segid "    " and resid 93   and name HB2 ))
      2.400     0.700     0.700 peak   673 spectrum    1 weight  0.10000E+01 volume  0.28464E-02 ppm1      3.198 ppm2      3.201 CV     1
 ASSI {  675}
   (( segid "    " and resid 94   and name HB1 ))
   (( segid "    " and resid 88   and name HB2 ))
      2.000     0.500     0.500 peak   675 spectrum    1 weight  0.10000E+01 volume  0.49669E-02 ppm1      2.803 ppm2      3.126 CV     1
 ASSI {  676}
   (( segid "    " and resid 94   and name HB2 ))
   (( segid "    " and resid 88   and name HB1 ))
      4.600     2.700     1.400 peak   676 spectrum    1 weight  0.10000E+01 volume  0.47376E-02 ppm1      2.717 ppm2      3.149 CV     1
 ASSI {  681}
   (( segid "    " and resid 95   and name HA  ))
   (( segid "    " and resid 95   and name HB  ))
      2.500     0.800     0.800 peak   681 spectrum    1 weight  0.10000E+01 volume  0.40499E-02 ppm1      4.294 ppm2      1.807 CV     1
 ASSI {  682}
   (( segid "    " and resid 95   and name HA  ))
   (  segid "    " and resid 95   and name HG1%)
      2.500     0.800     0.800 peak   682 spectrum    1 weight  0.10000E+01 volume  0.53299E-02 ppm1      4.295 ppm2      0.324 CV     1
 ASSI {  683}
   (( segid "    " and resid 95   and name HA  ))
   (  segid "    " and resid 95   and name HG2%)
      3.100     1.200     1.200 peak   683 spectrum    1 weight  0.10000E+01 volume  0.44511E-02 ppm1      4.293 ppm2      0.092 CV     1
 ASSI {  684}
   (( segid "    " and resid 46   and name HB1 ))
   (( segid "    " and resid 46   and name HD2 ))
      2.500     0.800     0.800 peak   684 spectrum    1 weight  0.10000E+01 volume  0.45275E-02 ppm1      1.801 ppm2      2.786 CV     1
 OR {  684}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 46   and name HD2 ))
 OR {  684}
   (( segid "    " and resid 46   and name HB1 ))
   (( segid "    " and resid 46   and name HD1 ))
 OR {  684}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 46   and name HD1 ))
 ASSI {  685}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 36   and name HB2 ))
      3.200     1.200     1.200 peak   685 spectrum    1 weight  0.10000E+01 volume  0.52534E-02 ppm1      1.767 ppm2      2.868 CV     1
 ASSI {  686}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 36   and name HB1 ))
      4.200     2.200     1.800 peak   686 spectrum    1 weight  0.10000E+01 volume  0.52725E-02 ppm1      1.804 ppm2      3.056 CV     1
 ASSI {  688}
   (( segid "    " and resid 130  and name HB2 ))
   (( segid "    " and resid 130  and name HA  ))
      2.700     0.900     0.900 peak   688 spectrum    1 weight  0.10000E+01 volume  0.51387E-02 ppm1      1.812 ppm2      4.772 CV     1
 ASSI {  689}
   (( segid "    " and resid 46   and name HB1 ))
   (( segid "    " and resid 46   and name HA  ))
      2.400     0.700     0.700 peak   689 spectrum    1 weight  0.10000E+01 volume  0.44702E-02 ppm1      1.800 ppm2      5.937 CV     1
 OR {  689}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 46   and name HA  ))
 ASSI {  691}
   (( segid "    " and resid 95   and name HB  ))
   (  segid "    " and resid 95   and name HG1%)
      2.400     0.700     0.700 peak   691 spectrum    1 weight  0.10000E+01 volume  0.43556E-02 ppm1      1.806 ppm2      0.325 CV     1
 ASSI {  692}
   (( segid "    " and resid 95   and name HB  ))
   (  segid "    " and resid 95   and name HG2%)
      2.600     0.900     0.900 peak   692 spectrum    1 weight  0.10000E+01 volume  0.35150E-02 ppm1      1.806 ppm2      0.092 CV     1
 ASSI {  703}
   (  segid "    " and resid 95   and name HG2%)
   (( segid "    " and resid 99   and name HB2 ))
      3.500     1.500     1.500 peak   703 spectrum    1 weight  0.10000E+01 volume  0.40308E-02 ppm1      0.090 ppm2      1.331 CV     1
 ASSI {  704}
   (  segid "    " and resid 95   and name HG2%)
   (( segid "    " and resid 99   and name HB1 ))
      2.300     0.700     0.700 peak   704 spectrum    1 weight  0.10000E+01 volume  0.38780E-02 ppm1      0.089 ppm2      1.503 CV     1
 ASSI {  709}
   (  segid "    " and resid 95   and name HG2%)
   (( segid "    " and resid 97   and name HA  ))
      3.100     1.200     1.200 peak   709 spectrum    1 weight  0.10000E+01 volume  0.51387E-02 ppm1      0.094 ppm2      4.027 CV     1
 ASSI {  711}
   (  segid "    " and resid 95   and name HG2%)
   (( segid "    " and resid 100  and name HA  ))
      2.500     0.800     0.800 peak   711 spectrum    1 weight  0.10000E+01 volume  0.45084E-02 ppm1      0.093 ppm2      4.630 CV     1
 ASSI {  713}
   (  segid "    " and resid 95   and name HG2%)
   (( segid "    " and resid 88   and name HZ  ))
      2.700     0.900     0.900 peak   713 spectrum    1 weight  0.10000E+01 volume  0.46230E-02 ppm1      0.081 ppm2      6.852 CV     1
 ASSI {  714}
   (  segid "    " and resid 95   and name HG2%)
   (  segid "    " and resid 88   and name HD% )
      2.400     0.700     0.700 peak   714 spectrum    1 weight  0.10000E+01 volume  0.46039E-02 ppm1      0.088 ppm2      6.962 CV     1
 ASSI {  715}
   (  segid "    " and resid 95   and name HG2%)
   (  segid "    " and resid 88   and name HE% )
      2.400     0.700     0.700 peak   715 spectrum    1 weight  0.10000E+01 volume  0.39162E-02 ppm1      0.086 ppm2      7.178 CV     1
 ASSI {  716}
   (( segid "    " and resid 118  and name HA  ))
   (( segid "    " and resid 137  and name HA  ))
      2.900     2.900     3.100 peak   716 spectrum    1 weight  0.10000E+01 volume  0.48522E-02 ppm1      4.007 ppm2      4.648 CV     1
 ASSI {  718}
   (( segid "    " and resid 96   and name HA  ))
   (  segid "    " and resid 96   and name HD1%)
      3.600     1.600     1.600 peak   718 spectrum    1 weight  0.10000E+01 volume  0.47567E-02 ppm1      4.019 ppm2      0.751 CV     1
 ASSI {  719}
   (( segid "    " and resid 96   and name HA  ))
   (  segid "    " and resid 96   and name HG2%)
      2.700     0.900     0.900 peak   719 spectrum    1 weight  0.10000E+01 volume  0.35532E-02 ppm1      4.016 ppm2      0.278 CV     1
 ASSI {  720}
   (( segid "    " and resid 96   and name HB  ))
   (( segid "    " and resid 96   and name HA  ))
      2.400     0.700     0.700 peak   720 spectrum    1 weight  0.10000E+01 volume  0.54062E-02 ppm1      2.099 ppm2      4.023 CV     1
 ASSI {  721}
   (( segid "    " and resid 96   and name HB  ))
   (( segid "    " and resid 121  and name HA  ))
      2.400     0.700     0.700 peak   721 spectrum    1 weight  0.10000E+01 volume  0.39926E-02 ppm1      2.098 ppm2      4.461 CV     1
 ASSI {  722}
   (( segid "    " and resid 96   and name HB  ))
   (( segid "    " and resid 120  and name HA  ))
      2.500     2.500     3.500 peak   722 spectrum    1 weight  0.10000E+01 volume  0.51770E-02 ppm1      2.107 ppm2      4.764 CV     1
 ASSI {  725}
   (( segid "    " and resid 96   and name HB  ))
   (( segid "    " and resid 96   and name HG11))
      2.100     0.600     0.600 peak   725 spectrum    1 weight  0.10000E+01 volume  0.48905E-02 ppm1      2.090 ppm2      1.277 CV     1
 ASSI {  726}
   (( segid "    " and resid 96   and name HB  ))
   (  segid "    " and resid 96   and name HD1%)
      2.500     0.800     0.800 peak   726 spectrum    1 weight  0.10000E+01 volume  0.48713E-02 ppm1      2.096 ppm2      0.752 CV     1
 ASSI {  727}
   (( segid "    " and resid 96   and name HB  ))
   (  segid "    " and resid 96   and name HG2%)
      2.500     0.800     0.800 peak   727 spectrum    1 weight  0.10000E+01 volume  0.45275E-02 ppm1      2.097 ppm2      0.278 CV     1
 ASSI {  728}
   (( segid "    " and resid 62   and name HD1 ))
   (( segid "    " and resid 62   and name HA  ))
      3.200     1.300     1.300 peak   728 spectrum    1 weight  0.10000E+01 volume  0.48140E-02 ppm1      1.736 ppm2      3.618 CV     1
 ASSI {  730}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 100  and name HB1 ))
      2.000     0.500     0.500 peak   730 spectrum    1 weight  0.10000E+01 volume  0.43937E-02 ppm1      4.030 ppm2      2.578 CV     1
 ASSI {  731}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 97   and name HG1 ))
      2.300     0.700     0.700 peak   731 spectrum    1 weight  0.10000E+01 volume  0.46230E-02 ppm1      4.016 ppm2      2.654 CV     1
 ASSI {  733}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 100  and name HB2 ))
      3.000     1.100     1.100 peak   733 spectrum    1 weight  0.10000E+01 volume  0.47758E-02 ppm1      4.030 ppm2      2.413 CV     1
 ASSI {  735}
   (( segid "    " and resid 97   and name HG2 ))
   (( segid "    " and resid 97   and name HA  ))
      3.200     1.200     1.200 peak   735 spectrum    1 weight  0.10000E+01 volume  0.45084E-02 ppm1      2.478 ppm2      4.030 CV     1
 ASSI {  736}
   (( segid "    " and resid 97   and name HG1 ))
   (  segid "    " and resid 120  and name HD% )
      3.400     1.500     1.500 peak   736 spectrum    1 weight  0.10000E+01 volume  0.55017E-02 ppm1      2.640 ppm2      6.920 CV     1
 ASSI {  737}
   (( segid "    " and resid 97   and name HG2 ))
   (  segid "    " and resid 120  and name HD% )
      3.300     1.400     1.400 peak   737 spectrum    1 weight  0.10000E+01 volume  0.49860E-02 ppm1      2.483 ppm2      6.936 CV     1
 ASSI {  739}
   (( segid "    " and resid 97   and name HG1 ))
   (( segid "    " and resid 97   and name HB1 ))
      2.700     0.900     0.900 peak   739 spectrum    1 weight  0.10000E+01 volume  0.35532E-02 ppm1      2.649 ppm2      2.279 CV     1
 OR {  739}
   (( segid "    " and resid 97   and name HG1 ))
   (( segid "    " and resid 97   and name HB2 ))
 ASSI {  743}
   (( segid "    " and resid 97   and name HG2 ))
   (( segid "    " and resid 101  and name HG  ))
      3.400     1.400     1.400 peak   743 spectrum    1 weight  0.10000E+01 volume  0.53871E-02 ppm1      2.476 ppm2      1.806 CV     1
 ASSI {  747}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 120  and name HB1 ))
      2.600     0.900     0.900 peak   747 spectrum    1 weight  0.10000E+01 volume  0.49477E-02 ppm1      3.843 ppm2      3.283 CV     1
 ASSI {  748}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 120  and name HB2 ))
      3.500     1.500     1.500 peak   748 spectrum    1 weight  0.10000E+01 volume  0.52534E-02 ppm1      3.833 ppm2      2.556 CV     1
 ASSI {  749}
   (( segid "    " and resid 98   and name HA  ))
   (  segid "    " and resid 98   and name HB% )
      2.400     0.700     0.700 peak   749 spectrum    1 weight  0.10000E+01 volume  0.34195E-02 ppm1      3.840 ppm2      1.140 CV     1
 ASSI {  751}
   (( segid "    " and resid 98   and name HA  ))
   (  segid "    " and resid 45   and name HD2%)
      2.400     0.700     0.700 peak   751 spectrum    1 weight  0.10000E+01 volume  0.41072E-02 ppm1      3.838 ppm2      0.519 CV     1
 ASSI {  754}
   (  segid "    " and resid 98   and name HB% )
   (  segid "    " and resid 45   and name HD2%)
      2.800     1.000     1.000 peak   754 spectrum    1 weight  0.10000E+01 volume  0.44320E-02 ppm1      1.136 ppm2      0.517 CV     1
 ASSI {  755}
   (  segid "    " and resid 98   and name HB% )
   (  segid "    " and resid 96   and name HG2%)
      3.700     1.700     1.700 peak   755 spectrum    1 weight  0.10000E+01 volume  0.45275E-02 ppm1      1.137 ppm2      0.282 CV     1
 ASSI {  756}
   (  segid "    " and resid 98   and name HB% )
   (( segid "    " and resid 120  and name HB2 ))
      3.200     1.300     1.300 peak   756 spectrum    1 weight  0.10000E+01 volume  0.41836E-02 ppm1      1.138 ppm2      2.563 CV     1
 ASSI {  757}
   (  segid "    " and resid 98   and name HB% )
   (( segid "    " and resid 120  and name HB1 ))
      2.200     0.600     0.600 peak   757 spectrum    1 weight  0.10000E+01 volume  0.44892E-02 ppm1      1.137 ppm2      3.274 CV     1
 ASSI {  760}
   (( segid "    " and resid 99   and name HB1 ))
   (( segid "    " and resid 99   and name HB2 ))
      2.000     0.500     0.500 peak   760 spectrum    1 weight  0.10000E+01 volume  0.31712E-02 ppm1      1.524 ppm2      1.381 CV     1
 ASSI {  762}
   (( segid "    " and resid 99   and name HB1 ))
   (( segid "    " and resid 99   and name HA  ))
      2.600     0.900     0.900 peak   762 spectrum    1 weight  0.10000E+01 volume  0.45084E-02 ppm1      1.503 ppm2      4.194 CV     1
 ASSI {  765}
   (( segid "    " and resid 99   and name HB2 ))
   (  segid "    " and resid 99   and name HD2%)
      2.500     0.800     0.800 peak   765 spectrum    1 weight  0.10000E+01 volume  0.37061E-02 ppm1      1.337 ppm2      0.760 CV     1
 ASSI {  768}
   (( segid "    " and resid 99   and name HG  ))
   (( segid "    " and resid 99   and name HB1 ))
      2.400     0.700     0.700 peak   768 spectrum    1 weight  0.10000E+01 volume  0.26744E-02 ppm1      1.370 ppm2      1.496 CV     1
 ASSI {  772}
   (( segid "    " and resid 99   and name HG  ))
   (( segid "    " and resid 99   and name HA  ))
      2.500     0.800     0.800 peak   772 spectrum    1 weight  0.10000E+01 volume  0.50815E-02 ppm1      1.363 ppm2      4.196 CV     1
 ASSI {  773}
   (( segid "    " and resid 99   and name HG  ))
   (( segid "    " and resid 88   and name HZ  ))
      2.000     0.500     0.500 peak   773 spectrum    1 weight  0.10000E+01 volume  0.56928E-02 ppm1      1.365 ppm2      6.850 CV     1
 ASSI {  774}
   (( segid "    " and resid 17   and name HG1 ))
   (( segid "    " and resid 18   and name HN  ))
      2.900     2.900     3.100 peak   774 spectrum    1 weight  0.10000E+01 volume  0.57692E-02 ppm1      1.376 ppm2      8.446 CV     1
 ASSI {  786}
   (  segid "    " and resid 45   and name HD1%)
   (( segid "    " and resid 120  and name HB1 ))
      3.000     1.100     1.100 peak   786 spectrum    1 weight  0.10000E+01 volume  0.48331E-02 ppm1      0.802 ppm2      3.283 CV     1
 ASSI {  789}
   (  segid "    " and resid 99   and name HD2%)
   (( segid "    " and resid 99   and name HG  ))
      2.400     0.700     0.700 peak   789 spectrum    1 weight  0.10000E+01 volume  0.30183E-02 ppm1      0.755 ppm2      1.377 CV     1
 ASSI {  793}
   (  segid "    " and resid 99   and name HD2%)
   (  segid "    " and resid 88   and name HE% )
      2.400     0.700     0.700 peak   793 spectrum    1 weight  0.10000E+01 volume  0.44511E-02 ppm1      0.754 ppm2      7.178 CV     1
 ASSI {  800}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 19   and name HB2 ))
      2.600     0.800     0.800 peak   800 spectrum    1 weight  0.10000E+01 volume  0.49860E-02 ppm1      4.600 ppm2      3.051 CV     1
 ASSI {  801}
   (( segid "    " and resid 100  and name HA  ))
   (  segid "    " and resid 90   and name HD1%)
      2.300     0.700     0.700 peak   801 spectrum    1 weight  0.10000E+01 volume  0.53299E-02 ppm1      4.611 ppm2      1.053 CV     1
 ASSI {  802}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 100  and name HB2 ))
      2.200     0.600     0.600 peak   802 spectrum    1 weight  0.10000E+01 volume  0.53107E-02 ppm1      4.615 ppm2      2.414 CV     1
 ASSI {  807}
   (( segid "    " and resid 100  and name HB1 ))
   (( segid "    " and resid 100  and name HA  ))
      2.600     0.900     0.900 peak   807 spectrum    1 weight  0.10000E+01 volume  0.51579E-02 ppm1      2.557 ppm2      4.608 CV     1
 ASSI {  811}
   (( segid "    " and resid 100  and name HB1 ))
   (  segid "    " and resid 95   and name HG2%)
      2.900     1.000     1.000 peak   811 spectrum    1 weight  0.10000E+01 volume  0.56928E-02 ppm1      2.571 ppm2      0.094 CV     1
 ASSI {  812}
   (( segid "    " and resid 100  and name HB2 ))
   (  segid "    " and resid 95   and name HG2%)
      2.200     0.600     0.600 peak   812 spectrum    1 weight  0.10000E+01 volume  0.49860E-02 ppm1      2.407 ppm2      0.092 CV     1
 ASSI {  813}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 19   and name HA  ))
      3.100     3.100     2.900 peak   813 spectrum    1 weight  0.10000E+01 volume  0.31329E-02 ppm1      4.294 ppm2      4.670 CV     1
 ASSI {  814}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 103  and name HB  ))
      3.400     1.500     1.500 peak   814 spectrum    1 weight  0.10000E+01 volume  0.50432E-02 ppm1      4.286 ppm2      2.337 CV     1
 ASSI {  816}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 104  and name HG1 ))
      2.900     1.100     1.100 peak   816 spectrum    1 weight  0.10000E+01 volume  0.45466E-02 ppm1      4.283 ppm2      2.075 CV     1
 ASSI {  818}
   (( segid "    " and resid 15   and name HA  ))
   (  segid "    " and resid 15   and name HD1%)
      3.100     1.200     1.200 peak   818 spectrum    1 weight  0.10000E+01 volume  0.35532E-02 ppm1      4.278 ppm2      0.848 CV     1
 ASSI {  821}
   (( segid "    " and resid 37   and name HB1 ))
   (( segid "    " and resid 37   and name HA  ))
      2.800     1.000     1.000 peak   821 spectrum    1 weight  0.10000E+01 volume  0.40881E-02 ppm1      1.929 ppm2      4.579 CV     1
 ASSI {  822}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 37   and name HA  ))
      2.500     0.800     0.800 peak   822 spectrum    1 weight  0.10000E+01 volume  0.39926E-02 ppm1      1.736 ppm2      4.579 CV     1
 ASSI {  830}
   (  segid "    " and resid 66   and name HG1%)
   (  segid "    " and resid 103  and name HG1%)
      2.600     0.900     0.900 peak   830 spectrum    1 weight  0.10000E+01 volume  0.46039E-02 ppm1      0.679 ppm2      1.314 CV     1
 ASSI {  832}
   (  segid "    " and resid 66   and name HG1%)
   (( segid "    " and resid 64   and name HB1 ))
      3.000     1.100     1.100 peak   832 spectrum    1 weight  0.10000E+01 volume  0.47567E-02 ppm1      0.677 ppm2      2.213 CV     1
 OR {  832}
   (  segid "    " and resid 66   and name HG1%)
   (( segid "    " and resid 64   and name HG2 ))
 ASSI {  833}
   (  segid "    " and resid 66   and name HG1%)
   (( segid "    " and resid 66   and name HA  ))
      2.600     0.800     0.800 peak   833 spectrum    1 weight  0.10000E+01 volume  0.33813E-02 ppm1      0.681 ppm2      5.057 CV     1
 ASSI {  835}
   (( segid "    " and resid 102  and name HA  ))
   (( segid "    " and resid 98   and name HA  ))
      3.100     3.100     2.900 peak   835 spectrum    1 weight  0.10000E+01 volume  0.52534E-02 ppm1      4.481 ppm2      3.858 CV     1
 ASSI {  836}
   (( segid "    " and resid 102  and name HA  ))
   (( segid "    " and resid 102  and name HB1 ))
      2.500     0.800     0.800 peak   836 spectrum    1 weight  0.10000E+01 volume  0.48713E-02 ppm1      4.466 ppm2      3.612 CV     1
 ASSI {  839}
   (( segid "    " and resid 102  and name HA  ))
   (  segid "    " and resid 105  and name HD1%)
      2.500     0.800     0.800 peak   839 spectrum    1 weight  0.10000E+01 volume  0.56164E-02 ppm1      4.467 ppm2      0.987 CV     1
 ASSI {  840}
   (( segid "    " and resid 102  and name HA  ))
   (  segid "    " and resid 39   and name HD1%)
      2.300     0.700     0.700 peak   840 spectrum    1 weight  0.10000E+01 volume  0.46421E-02 ppm1      4.470 ppm2      0.764 CV     1
 ASSI {  844}
   (( segid "    " and resid 102  and name HB2 ))
   (( segid "    " and resid 47   and name HG2 ))
      2.500     0.800     0.800 peak   844 spectrum    1 weight  0.10000E+01 volume  0.55591E-02 ppm1      3.592 ppm2      1.385 CV     1
 OR {  844}
   (( segid "    " and resid 102  and name HB2 ))
   (( segid "    " and resid 47   and name HG1 ))
 OR {  844}
   (( segid "    " and resid 102  and name HB1 ))
   (( segid "    " and resid 47   and name HG1 ))
 ASSI {  849}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 103  and name HB  ))
      2.400     0.700     0.700 peak   849 spectrum    1 weight  0.10000E+01 volume  0.51387E-02 ppm1      3.954 ppm2      2.298 CV     1
 ASSI {  850}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 106  and name HB1 ))
      2.300     0.700     0.700 peak   850 spectrum    1 weight  0.10000E+01 volume  0.52343E-02 ppm1      3.961 ppm2      2.185 CV     1
 ASSI {  852}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 106  and name HG2 ))
      2.600     0.800     0.800 peak   852 spectrum    1 weight  0.10000E+01 volume  0.56546E-02 ppm1      3.970 ppm2      1.969 CV     1
 OR {  852}
   (( segid "    " and resid 103  and name HA  ))
   (  segid "    " and resid 106  and name HE% )
 OR {  852}
   (( segid "    " and resid 103  and name HA  ))
   (( segid "    " and resid 106  and name HB2 ))
 ASSI {  853}
   (( segid "    " and resid 103  and name HA  ))
   (  segid "    " and resid 103  and name HG1%)
      2.600     0.800     0.800 peak   853 spectrum    1 weight  0.10000E+01 volume  0.35914E-02 ppm1      3.966 ppm2      1.306 CV     1
 ASSI {  854}
   (( segid "    " and resid 103  and name HA  ))
   (  segid "    " and resid 103  and name HG2%)
      2.400     0.700     0.700 peak   854 spectrum    1 weight  0.10000E+01 volume  0.42027E-02 ppm1      3.966 ppm2      1.033 CV     1
 ASSI {  856}
   (( segid "    " and resid 103  and name HB  ))
   (( segid "    " and resid 104  and name HD1 ))
      1.700     0.400     0.500 peak   856 spectrum    1 weight  0.10000E+01 volume  0.44702E-02 ppm1      2.306 ppm2      3.646 CV     1
 ASSI {  857}
   (( segid "    " and resid 103  and name HB  ))
   (( segid "    " and resid 62   and name HG2 ))
      3.600     3.600     2.400 peak   857 spectrum    1 weight  0.10000E+01 volume  0.36487E-02 ppm1      2.301 ppm2      1.305 CV     1
 ASSI {  858}
   (( segid "    " and resid 103  and name HB  ))
   (  segid "    " and resid 68   and name HG1%)
      3.400     3.400     2.600 peak   858 spectrum    1 weight  0.10000E+01 volume  0.39735E-02 ppm1      2.300 ppm2      1.041 CV     1
 ASSI {  862}
   (( segid "    " and resid 55   and name HB1 ))
   (( segid "    " and resid 55   and name HB2 ))
      2.300     0.700     0.700 peak   862 spectrum    1 weight  0.10000E+01 volume  0.32284E-02 ppm1      2.303 ppm2      2.048 CV     1
 ASSI {  863}
   (( segid "    " and resid 55   and name HB1 ))
   (( segid "    " and resid 55   and name HD1 ))
      2.900     1.100     1.100 peak   863 spectrum    1 weight  0.10000E+01 volume  0.47950E-02 ppm1      2.309 ppm2      3.829 CV     1
 ASSI {  866}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 59   and name HD1 ))
      3.000     1.100     1.100 peak   866 spectrum    1 weight  0.10000E+01 volume  0.56546E-02 ppm1      4.380 ppm2      3.192 CV     1
 ASSI {  868}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 105  and name HB1 ))
      2.500     0.800     0.800 peak   868 spectrum    1 weight  0.10000E+01 volume  0.44892E-02 ppm1      4.385 ppm2      1.801 CV     1
 ASSI {  869}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 105  and name HB2 ))
      2.700     0.900     0.900 peak   869 spectrum    1 weight  0.10000E+01 volume  0.46994E-02 ppm1      4.381 ppm2      1.705 CV     1
 ASSI {  870}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 105  and name HG  ))
      2.700     0.900     0.900 peak   870 spectrum    1 weight  0.10000E+01 volume  0.47185E-02 ppm1      4.373 ppm2      1.622 CV     1
 ASSI {  871}
   (( segid "    " and resid 105  and name HA  ))
   (  segid "    " and resid 105  and name HD1%)
      3.400     1.400     1.400 peak   871 spectrum    1 weight  0.10000E+01 volume  0.51770E-02 ppm1      4.379 ppm2      0.982 CV     1
 ASSI {  872}
   (( segid "    " and resid 105  and name HA  ))
   (  segid "    " and resid 105  and name HD2%)
      2.500     0.800     0.800 peak   872 spectrum    1 weight  0.10000E+01 volume  0.46039E-02 ppm1      4.377 ppm2      0.878 CV     1
 ASSI {  875}
   (( segid "    " and resid 105  and name HB1 ))
   (  segid "    " and resid 105  and name HD1%)
      2.600     0.800     0.800 peak   875 spectrum    1 weight  0.10000E+01 volume  0.40308E-02 ppm1      1.813 ppm2      0.987 CV     1
 ASSI {  876}
   (( segid "    " and resid 105  and name HB2 ))
   (  segid "    " and resid 105  and name HD1%)
      2.600     0.800     0.800 peak   876 spectrum    1 weight  0.10000E+01 volume  0.40117E-02 ppm1      1.710 ppm2      0.987 CV     1
 ASSI {  881}
   (  segid "    " and resid 105  and name HD1%)
   (( segid "    " and resid 37   and name HG  ))
      1.700     1.700     4.300 peak   881 spectrum    1 weight  0.10000E+01 volume  0.35341E-02 ppm1      0.966 ppm2      1.493 CV     1
 ASSI {  888}
   (  segid "    " and resid 105  and name HD2%)
   (( segid "    " and resid 105  and name HB1 ))
      2.700     0.900     0.900 peak   888 spectrum    1 weight  0.10000E+01 volume  0.37061E-02 ppm1      0.872 ppm2      1.797 CV     1
 ASSI {  891}
   (( segid "    " and resid 119  and name HG1 ))
   (( segid "    " and resid 120  and name HA  ))
      3.000     1.100     1.100 peak   891 spectrum    1 weight  0.10000E+01 volume  0.28082E-02 ppm1      0.875 ppm2      4.769 CV     1
 ASSI {  895}
   (( segid "    " and resid 106  and name HA  ))
   (( segid "    " and resid 106  and name HB2 ))
      2.300     0.700     0.700 peak   895 spectrum    1 weight  0.10000E+01 volume  0.46803E-02 ppm1      4.389 ppm2      1.879 CV     1
 ASSI {  896}
   (( segid "    " and resid 106  and name HA  ))
   (( segid "    " and resid 105  and name HB2 ))
      3.000     3.000     3.000 peak   896 spectrum    1 weight  0.10000E+01 volume  0.45084E-02 ppm1      4.389 ppm2      1.741 CV     1
 ASSI {  897}
   (( segid "    " and resid 85   and name HA  ))
   (  segid "    " and resid 67   and name HG2%)
      3.500     1.600     1.600 peak   897 spectrum    1 weight  0.10000E+01 volume  0.47185E-02 ppm1      4.387 ppm2      1.069 CV     1
 ASSI {  898}
   (( segid "    " and resid 106  and name HB2 ))
   (( segid "    " and resid 106  and name HB1 ))
      2.000     0.500     0.500 peak   898 spectrum    1 weight  0.10000E+01 volume  0.36869E-02 ppm1      1.913 ppm2      2.152 CV     1
 ASSI {  900}
   (( segid "    " and resid 46   and name HB1 ))
   (( segid "    " and resid 46   and name HG1 ))
      2.500     0.800     0.800 peak   900 spectrum    1 weight  0.10000E+01 volume  0.37633E-02 ppm1      1.858 ppm2      1.383 CV     1
 OR {  900}
   (( segid "    " and resid 46   and name HB1 ))
   (( segid "    " and resid 46   and name HG2 ))
 ASSI {  909}
   (( segid "    " and resid 100  and name HB2 ))
   (  segid "    " and resid 88   and name HD% )
      1.500     1.500     4.500 peak   909 spectrum    1 weight  0.10000E+01 volume  0.51579E-02 ppm1      2.466 ppm2      7.016 CV     1
 ASSI {  912}
   (( segid "    " and resid 48   and name HE2 ))
   (( segid "    " and resid 36   and name HZ2 ))
      2.400     0.700     0.700 peak   912 spectrum    1 weight  0.10000E+01 volume  0.58456E-02 ppm1      2.316 ppm2      7.464 CV     1
 ASSI {  915}
   (( segid "    " and resid 100  and name HB2 ))
   (  segid "    " and resid 101  and name HD1%)
      3.800     3.800     2.200 peak   915 spectrum    1 weight  0.10000E+01 volume  0.41836E-02 ppm1      2.472 ppm2      0.630 CV     1
 ASSI {  924}
   (( segid "    " and resid 108  and name HB  ))
   (( segid "    " and resid 57   and name HB2 ))
      3.100     1.200     1.200 peak   924 spectrum    1 weight  0.10000E+01 volume  0.45084E-02 ppm1      2.043 ppm2      3.985 CV     1
 ASSI {  925}
   (( segid "    " and resid 10   and name HB1 ))
   (( segid "    " and resid 10   and name HA  ))
      2.900     1.000     1.000 peak   925 spectrum    1 weight  0.10000E+01 volume  0.34004E-02 ppm1      2.055 ppm2      4.294 CV     1
 ASSI {  932}
   (( segid "    " and resid 109  and name HA2 ))
   (( segid "    " and resid 109  and name HA1 ))
      2.300     0.600     0.600 peak   932 spectrum    1 weight  0.10000E+01 volume  0.39926E-02 ppm1      3.753 ppm2      4.406 CV     1
 ASSI {  933}
   (( segid "    " and resid 110  and name HB2 ))
   (( segid "    " and resid 107  and name HB1 ))
      1.600     1.600     4.400 peak   933 spectrum    1 weight  0.10000E+01 volume  0.44702E-02 ppm1      1.986 ppm2      2.602 CV     1
 ASSI {  934}
   (( segid "    " and resid 110  and name HB2 ))
   (( segid "    " and resid 106  and name HA  ))
      3.200     3.200     2.800 peak   934 spectrum    1 weight  0.10000E+01 volume  0.47376E-02 ppm1      2.004 ppm2      4.403 CV     1
 ASSI {  935}
   (( segid "    " and resid 80   and name HB  ))
   (  segid "    " and resid 132  and name HD1%)
      2.800     1.000     1.000 peak   935 spectrum    1 weight  0.10000E+01 volume  0.47758E-02 ppm1      2.010 ppm2      0.459 CV     1
 ASSI {  937}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 42   and name HA  ))
      2.700     0.900     0.900 peak   937 spectrum    1 weight  0.10000E+01 volume  0.45084E-02 ppm1      2.763 ppm2      4.879 CV     1
 ASSI {  938}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 42   and name HN  ))
      2.800     0.900     0.900 peak   938 spectrum    1 weight  0.10000E+01 volume  0.56355E-02 ppm1      2.747 ppm2      7.106 CV     1
 ASSI {  940}
   (( segid "    " and resid 110  and name HG2 ))
   (( segid "    " and resid 110  and name HB1 ))
      2.400     0.700     0.700 peak   940 spectrum    1 weight  0.10000E+01 volume  0.50624E-02 ppm1      2.757 ppm2      2.261 CV     1
 OR {  940}
   (( segid "    " and resid 110  and name HG1 ))
   (( segid "    " and resid 110  and name HB1 ))
 ASSI {  950}
   (( segid "    " and resid 143  and name HB  ))
   (( segid "    " and resid 69   and name HB1 ))
      1.600     0.300     0.600 peak   950 spectrum    1 weight  0.10000E+01 volume  0.39353E-02 ppm1      4.086 ppm2      3.195 CV     1
 ASSI {  951}
   (( segid "    " and resid 143  and name HB  ))
   (( segid "    " and resid 69   and name HB2 ))
      3.400     1.400     1.400 peak   951 spectrum    1 weight  0.10000E+01 volume  0.41645E-02 ppm1      4.088 ppm2      3.095 CV     1
 ASSI {  952}
   (( segid "    " and resid 143  and name HB  ))
   (( segid "    " and resid 145  and name HE2 ))
      3.000     1.100     1.100 peak   952 spectrum    1 weight  0.10000E+01 volume  0.55209E-02 ppm1      4.084 ppm2      3.009 CV     1
 ASSI {  953}
   (( segid "    " and resid 143  and name HB  ))
   (  segid "    " and resid 143  and name HG2%)
      2.400     0.700     0.700 peak   953 spectrum    1 weight  0.10000E+01 volume  0.38780E-02 ppm1      4.084 ppm2      1.045 CV     1
 ASSI {  956}
   (  segid "    " and resid 111  and name HG2%)
   (( segid "    " and resid 141  and name HG2 ))
      3.000     1.100     1.100 peak   956 spectrum    1 weight  0.10000E+01 volume  0.39926E-02 ppm1      1.192 ppm2      1.967 CV     1
 OR {  956}
   (  segid "    " and resid 111  and name HG2%)
   (( segid "    " and resid 141  and name HB2 ))
 ASSI {  957}
   (  segid "    " and resid 111  and name HG2%)
   (( segid "    " and resid 111  and name HB  ))
      2.500     0.800     0.800 peak   957 spectrum    1 weight  0.10000E+01 volume  0.38016E-02 ppm1      1.195 ppm2      3.778 CV     1
 ASSI {  958}
   (  segid "    " and resid 111  and name HG2%)
   (( segid "    " and resid 111  and name HA  ))
      2.600     0.800     0.800 peak   958 spectrum    1 weight  0.10000E+01 volume  0.37442E-02 ppm1      1.193 ppm2      5.618 CV     1
 ASSI {  962}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 111  and name HB  ))
      3.000     3.000     3.000 peak   962 spectrum    1 weight  0.10000E+01 volume  0.58074E-02 ppm1      5.194 ppm2      3.801 CV     1
 ASSI {  964}
   (( segid "    " and resid 112  and name HA  ))
   (  segid "    " and resid 111  and name HG2%)
      3.100     1.200     1.200 peak   964 spectrum    1 weight  0.10000E+01 volume  0.55209E-02 ppm1      5.181 ppm2      1.201 CV     1
 ASSI {  965}
   (( segid "    " and resid 112  and name HA  ))
   (  segid "    " and resid 49   and name HG2%)
      3.200     1.300     1.300 peak   965 spectrum    1 weight  0.10000E+01 volume  0.54635E-02 ppm1      5.197 ppm2      1.051 CV     1
 ASSI {  966}
   (  segid "    " and resid 112  and name HB% )
   (( segid "    " and resid 113  and name HB2 ))
      3.700     1.700     1.700 peak   966 spectrum    1 weight  0.10000E+01 volume  0.31329E-02 ppm1      1.538 ppm2      1.971 CV     1
 ASSI {  967}
   (  segid "    " and resid 112  and name HB% )
   (( segid "    " and resid 47   and name HE2 ))
      3.200     1.300     1.300 peak   967 spectrum    1 weight  0.10000E+01 volume  0.37825E-02 ppm1      1.537 ppm2      2.578 CV     1
 OR {  967}
   (  segid "    " and resid 112  and name HB% )
   (( segid "    " and resid 47   and name HE1 ))
 ASSI {  971}
   (  segid "    " and resid 112  and name HB% )
   (( segid "    " and resid 143  and name HA  ))
      3.200     3.200     2.800 peak   971 spectrum    1 weight  0.10000E+01 volume  0.49096E-02 ppm1      1.538 ppm2      5.621 CV     1
 ASSI {  973}
   (  segid "    " and resid 112  and name HB% )
   (( segid "    " and resid 110  and name HG2 ))
      2.600     0.800     0.800 peak   973 spectrum    1 weight  0.10000E+01 volume  0.54062E-02 ppm1      1.527 ppm2      2.717 CV     1
 OR {  973}
   (  segid "    " and resid 112  and name HB% )
   (( segid "    " and resid 110  and name HG1 ))
 ASSI {  975}
   (  segid "    " and resid 112  and name HB% )
   (( segid "    " and resid 106  and name HB1 ))
      2.900     1.100     1.100 peak   975 spectrum    1 weight  0.10000E+01 volume  0.46612E-02 ppm1      1.537 ppm2      2.188 CV     1
 ASSI {  981}
   (( segid "    " and resid 113  and name HB1 ))
   (( segid "    " and resid 113  and name HG2 ))
      2.200     0.600     0.600 peak   981 spectrum    1 weight  0.10000E+01 volume  0.41836E-02 ppm1      2.006 ppm2      2.522 CV     1
 ASSI {  983}
   (( segid "    " and resid 113  and name HB2 ))
   (( segid "    " and resid 113  and name HG2 ))
      2.800     1.000     1.000 peak   983 spectrum    1 weight  0.10000E+01 volume  0.42027E-02 ppm1      1.915 ppm2      2.525 CV     1
 ASSI {  984}
   (( segid "    " and resid 113  and name HB2 ))
   (( segid "    " and resid 113  and name HG1 ))
      2.400     0.700     0.700 peak   984 spectrum    1 weight  0.10000E+01 volume  0.41645E-02 ppm1      1.916 ppm2      2.659 CV     1
 ASSI {  985}
   (( segid "    " and resid 113  and name HB1 ))
   (( segid "    " and resid 113  and name HG1 ))
      2.800     1.000     1.000 peak   985 spectrum    1 weight  0.10000E+01 volume  0.43365E-02 ppm1      2.008 ppm2      2.662 CV     1
 ASSI {  986}
   (( segid "    " and resid 113  and name HB1 ))
   (( segid "    " and resid 113  and name HA  ))
      2.700     0.900     0.900 peak   986 spectrum    1 weight  0.10000E+01 volume  0.40881E-02 ppm1      2.008 ppm2      5.526 CV     1
 ASSI {  987}
   (( segid "    " and resid 113  and name HB2 ))
   (( segid "    " and resid 113  and name HA  ))
      2.200     0.600     0.600 peak   987 spectrum    1 weight  0.10000E+01 volume  0.39926E-02 ppm1      1.918 ppm2      5.528 CV     1
 ASSI {  989}
   (( segid "    " and resid 113  and name HB2 ))
   (  segid "    " and resid 114  and name HG2%)
      3.700     1.700     1.700 peak   989 spectrum    1 weight  0.10000E+01 volume  0.31329E-02 ppm1      1.962 ppm2      0.851 CV     1
 ASSI {  993}
   (( segid "    " and resid 113  and name HG1 ))
   (( segid "    " and resid 113  and name HA  ))
      2.300     0.700     0.700 peak   993 spectrum    1 weight  0.10000E+01 volume  0.46803E-02 ppm1      2.660 ppm2      5.526 CV     1
 ASSI {  994}
   (( segid "    " and resid 113  and name HG2 ))
   (( segid "    " and resid 113  and name HA  ))
      2.900     1.000     1.000 peak   994 spectrum    1 weight  0.10000E+01 volume  0.44320E-02 ppm1      2.530 ppm2      5.528 CV     1
 ASSI {  996}
   (( segid "    " and resid 113  and name HG1 ))
   (( segid "    " and resid 36   and name HH2 ))
      3.200     1.300     1.300 peak   996 spectrum    1 weight  0.10000E+01 volume  0.43365E-02 ppm1      2.667 ppm2      7.018 CV     1
 ASSI {  997}
   (( segid "    " and resid 113  and name HG2 ))
   (( segid "    " and resid 36   and name HH2 ))
      2.200     0.600     0.600 peak   997 spectrum    1 weight  0.10000E+01 volume  0.42218E-02 ppm1      2.531 ppm2      7.017 CV     1
 ASSI {  998}
   (( segid "    " and resid 113  and name HG1 ))
   (( segid "    " and resid 36   and name HZ2 ))
      3.600     1.600     1.600 peak   998 spectrum    1 weight  0.10000E+01 volume  0.53489E-02 ppm1      2.671 ppm2      7.463 CV     1
 ASSI {  999}
   (( segid "    " and resid 113  and name HG2 ))
   (( segid "    " and resid 36   and name HZ2 ))
      2.700     0.900     0.900 peak   999 spectrum    1 weight  0.10000E+01 volume  0.57310E-02 ppm1      2.532 ppm2      7.466 CV     1
 ASSI { 1013}
   (( segid "    " and resid 114  and name HA  ))
   (( segid "    " and resid 36   and name HH2 ))
      3.200     1.300     1.300 peak  1013 spectrum    1 weight  0.10000E+01 volume  0.53299E-02 ppm1      5.616 ppm2      7.010 CV     1
 ASSI { 1015}
   (( segid "    " and resid 114  and name HA  ))
   (( segid "    " and resid 115  and name HB  ))
      3.500     1.500     1.500 peak  1015 spectrum    1 weight  0.10000E+01 volume  0.56546E-02 ppm1      5.616 ppm2      4.085 CV     1
 ASSI { 1017}
   (( segid "    " and resid 114  and name HA  ))
   (( segid "    " and resid 114  and name HB  ))
      2.400     0.700     0.700 peak  1017 spectrum    1 weight  0.10000E+01 volume  0.51770E-02 ppm1      5.627 ppm2      2.049 CV     1
 ASSI { 1019}
   (( segid "    " and resid 143  and name HA  ))
   (  segid "    " and resid 143  and name HG2%)
      2.600     0.800     0.800 peak  1019 spectrum    1 weight  0.10000E+01 volume  0.42218E-02 ppm1      5.619 ppm2      1.044 CV     1
 ASSI { 1020}
   (( segid "    " and resid 114  and name HA  ))
   (  segid "    " and resid 114  and name HG1%)
      2.500     0.800     0.800 peak  1020 spectrum    1 weight  0.10000E+01 volume  0.42791E-02 ppm1      5.620 ppm2      0.928 CV     1
 ASSI { 1021}
   (( segid "    " and resid 114  and name HA  ))
   (  segid "    " and resid 114  and name HG2%)
      2.500     0.800     0.800 peak  1021 spectrum    1 weight  0.10000E+01 volume  0.42791E-02 ppm1      5.615 ppm2      0.868 CV     1
 ASSI { 1022}
   (( segid "    " and resid 142  and name HB  ))
   (( segid "    " and resid 142  and name HA  ))
      2.400     0.700     0.700 peak  1022 spectrum    1 weight  0.10000E+01 volume  0.42791E-02 ppm1      1.964 ppm2      5.072 CV     1
 ASSI { 1028}
   (  segid "    " and resid 142  and name HG1%)
   (( segid "    " and resid 68   and name HB  ))
      2.600     0.900     0.900 peak  1028 spectrum    1 weight  0.10000E+01 volume  0.34386E-02 ppm1      0.855 ppm2      2.230 CV     1
 ASSI { 1032}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 115  and name HB  ))
      2.600     0.900     0.900 peak  1032 spectrum    1 weight  0.10000E+01 volume  0.41455E-02 ppm1      5.135 ppm2      4.117 CV     1
 ASSI { 1033}
   (( segid "    " and resid 115  and name HA  ))
   (  segid "    " and resid 115  and name HG2%)
      2.700     0.900     0.900 peak  1033 spectrum    1 weight  0.10000E+01 volume  0.39543E-02 ppm1      5.133 ppm2      1.121 CV     1
 ASSI { 1035}
   (( segid "    " and resid 115  and name HB  ))
   (( segid "    " and resid 116  and name HA  ))
      2.700     2.700     3.300 peak  1035 spectrum    1 weight  0.10000E+01 volume  0.56736E-02 ppm1      4.125 ppm2      5.377 CV     1
 ASSI { 1036}
   (( segid "    " and resid 115  and name HB  ))
   (( segid "    " and resid 36   and name HH2 ))
      2.600     0.900     0.900 peak  1036 spectrum    1 weight  0.10000E+01 volume  0.58647E-02 ppm1      4.118 ppm2      7.004 CV     1
 ASSI { 1037}
   (( segid "    " and resid 115  and name HB  ))
   (( segid "    " and resid 36   and name HE3 ))
      3.000     3.000     3.000 peak  1037 spectrum    1 weight  0.10000E+01 volume  0.57692E-02 ppm1      4.114 ppm2      7.232 CV     1
 ASSI { 1042}
   (( segid "    " and resid 116  and name HA  ))
   (  segid "    " and resid 120  and name HD% )
      3.100     1.200     1.200 peak  1042 spectrum    1 weight  0.10000E+01 volume  0.56928E-02 ppm1      5.358 ppm2      6.928 CV     1
 ASSI { 1049}
   (( segid "    " and resid 116  and name HA  ))
   (  segid "    " and resid 114  and name HG1%)
      3.000     1.100     1.100 peak  1049 spectrum    1 weight  0.10000E+01 volume  0.38971E-02 ppm1      5.348 ppm2      0.867 CV     1
 ASSI { 1050}
   (( segid "    " and resid 116  and name HA  ))
   (  segid "    " and resid 45   and name HD1%)
      2.900     1.100     1.100 peak  1050 spectrum    1 weight  0.10000E+01 volume  0.52534E-02 ppm1      5.351 ppm2      0.800 CV     1
 ASSI { 1051}
   (( segid "    " and resid 116  and name HA  ))
   (  segid "    " and resid 45   and name HD2%)
      3.200     1.300     1.300 peak  1051 spectrum    1 weight  0.10000E+01 volume  0.52725E-02 ppm1      5.368 ppm2      0.516 CV     1
 ASSI { 1054}
   (  segid "    " and resid 116  and name HB% )
   (  segid "    " and resid 120  and name HD% )
      3.400     1.400     1.400 peak  1054 spectrum    1 weight  0.10000E+01 volume  0.41645E-02 ppm1      1.103 ppm2      6.940 CV     1
 ASSI { 1055}
   (  segid "    " and resid 116  and name HB% )
   (( segid "    " and resid 120  and name HB1 ))
      2.500     0.800     0.800 peak  1055 spectrum    1 weight  0.10000E+01 volume  0.42791E-02 ppm1      1.109 ppm2      3.271 CV     1
 ASSI { 1057}
   (  segid "    " and resid 116  and name HB% )
   (  segid "    " and resid 45   and name HD2%)
      3.000     1.100     1.100 peak  1057 spectrum    1 weight  0.10000E+01 volume  0.45084E-02 ppm1      1.109 ppm2      0.513 CV     1
 ASSI { 1059}
   (( segid "    " and resid 127  and name HA  ))
   (( segid "    " and resid 127  and name HB1 ))
      2.700     0.900     0.900 peak  1059 spectrum    1 weight  0.10000E+01 volume  0.41455E-02 ppm1      4.529 ppm2      3.005 CV     1
 ASSI { 1060}
   (( segid "    " and resid 117  and name HB2 ))
   (( segid "    " and resid 117  and name HB1 ))
      1.800     0.400     0.400 peak  1060 spectrum    1 weight  0.10000E+01 volume  0.39543E-02 ppm1      2.482 ppm2      2.989 CV     1
 ASSI { 1065}
   (( segid "    " and resid 117  and name HB2 ))
   (( segid "    " and resid 44   and name HB2 ))
      1.900     0.500     0.500 peak  1065 spectrum    1 weight  0.10000E+01 volume  0.53680E-02 ppm1      2.484 ppm2      1.685 CV     1
 ASSI { 1068}
   (( segid "    " and resid 117  and name HB2 ))
   (  segid "    " and resid 44   and name HD2%)
      2.500     0.800     0.800 peak  1068 spectrum    1 weight  0.10000E+01 volume  0.46612E-02 ppm1      2.488 ppm2      0.833 CV     1
 ASSI { 1070}
   (( segid "    " and resid 118  and name HA  ))
   (( segid "    " and resid 118  and name HB1 ))
      2.500     0.800     0.800 peak  1070 spectrum    1 weight  0.10000E+01 volume  0.43937E-02 ppm1      3.949 ppm2      3.590 CV     1
 ASSI { 1071}
   (( segid "    " and resid 118  and name HA  ))
   (( segid "    " and resid 118  and name HB2 ))
      2.200     0.600     0.600 peak  1071 spectrum    1 weight  0.10000E+01 volume  0.45275E-02 ppm1      3.960 ppm2      3.518 CV     1
 ASSI { 1072}
   (( segid "    " and resid 118  and name HA  ))
   (( segid "    " and resid 121  and name HB2 ))
      2.100     0.500     0.500 peak  1072 spectrum    1 weight  0.10000E+01 volume  0.50815E-02 ppm1      3.945 ppm2      2.640 CV     1
 ASSI { 1073}
   (( segid "    " and resid 118  and name HB1 ))
   (( segid "    " and resid 118  and name HB2 ))
      1.900     0.500     0.500 peak  1073 spectrum    1 weight  0.10000E+01 volume  0.37825E-02 ppm1      3.582 ppm2      3.512 CV     1
 ASSI { 1075}
   (( segid "    " and resid 118  and name HB1 ))
   (( segid "    " and resid 135  and name HA  ))
      2.300     0.700     0.700 peak  1075 spectrum    1 weight  0.10000E+01 volume  0.46803E-02 ppm1      3.567 ppm2      3.870 CV     1
 ASSI { 1077}
   (( segid "    " and resid 118  and name HB1 ))
   (( segid "    " and resid 122  and name HA  ))
      3.200     3.200     2.800 peak  1077 spectrum    1 weight  0.10000E+01 volume  0.43556E-02 ppm1      3.603 ppm2      4.506 CV     1
 ASSI { 1078}
   (( segid "    " and resid 118  and name HB1 ))
   (( segid "    " and resid 137  and name HA  ))
      3.400     3.400     2.600 peak  1078 spectrum    1 weight  0.10000E+01 volume  0.48331E-02 ppm1      3.593 ppm2      4.651 CV     1
 ASSI { 1079}
   (( segid "    " and resid 118  and name HB1 ))
   (( segid "    " and resid 117  and name HB1 ))
      3.000     3.000     3.000 peak  1079 spectrum    1 weight  0.10000E+01 volume  0.53489E-02 ppm1      3.612 ppm2      2.996 CV     1
 ASSI { 1081}
   (( segid "    " and resid 118  and name HB1 ))
   (( segid "    " and resid 119  and name HB1 ))
      2.800     2.800     3.200 peak  1081 spectrum    1 weight  0.10000E+01 volume  0.57692E-02 ppm1      3.603 ppm2      1.621 CV     1
 ASSI { 1084}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 75   and name HB2 ))
      2.600     0.900     0.900 peak  1084 spectrum    1 weight  0.10000E+01 volume  0.38971E-02 ppm1      3.989 ppm2      2.038 CV     1
 OR { 1084}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 75   and name HB1 ))
 ASSI { 1088}
   (( segid "    " and resid 119  and name HB1 ))
   (( segid "    " and resid 119  and name HE2 ))
      2.000     0.500     0.500 peak  1088 spectrum    1 weight  0.10000E+01 volume  0.47567E-02 ppm1      1.634 ppm2      2.767 CV     1
 ASSI { 1089}
   (( segid "    " and resid 119  and name HB2 ))
   (( segid "    " and resid 119  and name HE2 ))
      3.200     1.300     1.300 peak  1089 spectrum    1 weight  0.10000E+01 volume  0.50241E-02 ppm1      1.271 ppm2      2.772 CV     1
 ASSI { 1090}
   (( segid "    " and resid 119  and name HB1 ))
   (( segid "    " and resid 117  and name HB2 ))
      3.800     1.800     1.800 peak  1090 spectrum    1 weight  0.10000E+01 volume  0.53299E-02 ppm1      1.631 ppm2      2.423 CV     1
 ASSI { 1091}
   (( segid "    " and resid 119  and name HB2 ))
   (( segid "    " and resid 117  and name HB2 ))
      3.900     1.900     1.900 peak  1091 spectrum    1 weight  0.10000E+01 volume  0.54635E-02 ppm1      1.260 ppm2      2.489 CV     1
 ASSI { 1092}
   (( segid "    " and resid 119  and name HB1 ))
   (( segid "    " and resid 119  and name HA  ))
      2.500     0.800     0.800 peak  1092 spectrum    1 weight  0.10000E+01 volume  0.35532E-02 ppm1      1.643 ppm2      3.969 CV     1
 ASSI { 1093}
   (( segid "    " and resid 119  and name HB2 ))
   (( segid "    " and resid 119  and name HA  ))
      2.600     0.900     0.900 peak  1093 spectrum    1 weight  0.10000E+01 volume  0.38588E-02 ppm1      1.264 ppm2      3.970 CV     1
 ASSI { 1095}
   (( segid "    " and resid 119  and name HB1 ))
   (( segid "    " and resid 120  and name HA  ))
      3.300     3.300     2.700 peak  1095 spectrum    1 weight  0.10000E+01 volume  0.51006E-02 ppm1      1.658 ppm2      4.780 CV     1
 ASSI { 1096}
   (( segid "    " and resid 119  and name HB1 ))
   (  segid "    " and resid 120  and name HD% )
      3.600     1.600     1.600 peak  1096 spectrum    1 weight  0.10000E+01 volume  0.54445E-02 ppm1      1.613 ppm2      6.924 CV     1
 ASSI { 1097}
   (( segid "    " and resid 119  and name HB2 ))
   (  segid "    " and resid 120  and name HD% )
      3.300     1.300     1.300 peak  1097 spectrum    1 weight  0.10000E+01 volume  0.56546E-02 ppm1      1.274 ppm2      6.920 CV     1
 ASSI { 1098}
   (( segid "    " and resid 119  and name HB2 ))
   (  segid "    " and resid 120  and name HE% )
      3.200     1.300     1.300 peak  1098 spectrum    1 weight  0.10000E+01 volume  0.58074E-02 ppm1      1.282 ppm2      6.705 CV     1
 ASSI { 1099}
   (( segid "    " and resid 119  and name HB1 ))
   (( segid "    " and resid 119  and name HG1 ))
      2.700     0.900     0.900 peak  1099 spectrum    1 weight  0.10000E+01 volume  0.43173E-02 ppm1      1.634 ppm2      0.933 CV     1
 ASSI { 1100}
   (( segid "    " and resid 119  and name HB2 ))
   (( segid "    " and resid 119  and name HG1 ))
      2.200     0.600     0.600 peak  1100 spectrum    1 weight  0.10000E+01 volume  0.40308E-02 ppm1      1.263 ppm2      0.935 CV     1
 ASSI { 1101}
   (( segid "    " and resid 119  and name HB2 ))
   (( segid "    " and resid 119  and name HG2 ))
      2.600     0.900     0.900 peak  1101 spectrum    1 weight  0.10000E+01 volume  0.46803E-02 ppm1      1.259 ppm2      0.626 CV     1
 ASSI { 1102}
   (( segid "    " and resid 119  and name HB1 ))
   (( segid "    " and resid 119  and name HG2 ))
      2.300     0.600     0.600 peak  1102 spectrum    1 weight  0.10000E+01 volume  0.42027E-02 ppm1      1.641 ppm2      0.625 CV     1
 ASSI { 1105}
   (( segid "    " and resid 119  and name HG1 ))
   (( segid "    " and resid 119  and name HD2 ))
      2.200     0.600     0.600 peak  1105 spectrum    1 weight  0.10000E+01 volume  0.35341E-02 ppm1      0.941 ppm2      1.385 CV     1
 ASSI { 1106}
   (( segid "    " and resid 119  and name HG2 ))
   (( segid "    " and resid 119  and name HD2 ))
      2.300     0.700     0.700 peak  1106 spectrum    1 weight  0.10000E+01 volume  0.37633E-02 ppm1      0.624 ppm2      1.382 CV     1
 ASSI { 1108}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 83   and name HG1 ))
      3.400     1.400     1.400 peak  1108 spectrum    1 weight  0.10000E+01 volume  0.43746E-02 ppm1      0.948 ppm2      2.186 CV     1
 ASSI { 1109}
   (( segid "    " and resid 119  and name HG1 ))
   (( segid "    " and resid 119  and name HE2 ))
      3.100     1.200     1.200 peak  1109 spectrum    1 weight  0.10000E+01 volume  0.44702E-02 ppm1      0.933 ppm2      2.766 CV     1
 ASSI { 1110}
   (( segid "    " and resid 119  and name HG2 ))
   (( segid "    " and resid 119  and name HE1 ))
      2.200     0.600     0.600 peak  1110 spectrum    1 weight  0.10000E+01 volume  0.42982E-02 ppm1      0.620 ppm2      2.769 CV     1
 OR { 1110}
   (( segid "    " and resid 119  and name HG2 ))
   (( segid "    " and resid 119  and name HE2 ))
 ASSI { 1111}
   (( segid "    " and resid 119  and name HG2 ))
   (( segid "    " and resid 119  and name HA  ))
      2.900     1.000     1.000 peak  1111 spectrum    1 weight  0.10000E+01 volume  0.46421E-02 ppm1      0.619 ppm2      3.971 CV     1
 ASSI { 1112}
   (( segid "    " and resid 119  and name HG1 ))
   (  segid "    " and resid 120  and name HE% )
      2.400     0.700     0.700 peak  1112 spectrum    1 weight  0.10000E+01 volume  0.51006E-02 ppm1      0.937 ppm2      6.703 CV     1
 ASSI { 1113}
   (( segid "    " and resid 119  and name HG2 ))
   (  segid "    " and resid 120  and name HE% )
      3.100     1.200     1.200 peak  1113 spectrum    1 weight  0.10000E+01 volume  0.51197E-02 ppm1      0.618 ppm2      6.701 CV     1
 ASSI { 1114}
   (( segid "    " and resid 119  and name HG1 ))
   (  segid "    " and resid 120  and name HD% )
      2.100     0.600     0.600 peak  1114 spectrum    1 weight  0.10000E+01 volume  0.44511E-02 ppm1      0.939 ppm2      6.951 CV     1
 ASSI { 1115}
   (( segid "    " and resid 119  and name HG2 ))
   (  segid "    " and resid 120  and name HD% )
      2.500     0.800     0.800 peak  1115 spectrum    1 weight  0.10000E+01 volume  0.54445E-02 ppm1      0.626 ppm2      6.936 CV     1
 ASSI { 1116}
   (  segid "    " and resid 86   and name HD1%)
   (  segid "    " and resid 95   and name HG1%)
      3.500     1.500     1.500 peak  1116 spectrum    1 weight  0.10000E+01 volume  0.43365E-02 ppm1      0.952 ppm2      0.326 CV     1
 ASSI { 1117}
   (( segid "    " and resid 119  and name HD1 ))
   (( segid "    " and resid 119  and name HB1 ))
      2.700     0.900     0.900 peak  1117 spectrum    1 weight  0.10000E+01 volume  0.41072E-02 ppm1      1.394 ppm2      1.648 CV     1
 OR { 1117}
   (( segid "    " and resid 119  and name HD2 ))
   (( segid "    " and resid 119  and name HB1 ))
 ASSI { 1118}
   (( segid "    " and resid 119  and name HD2 ))
   (( segid "    " and resid 119  and name HE1 ))
      2.500     0.800     0.800 peak  1118 spectrum    1 weight  0.10000E+01 volume  0.37825E-02 ppm1      1.391 ppm2      2.766 CV     1
 OR { 1118}
   (( segid "    " and resid 119  and name HD1 ))
   (( segid "    " and resid 119  and name HE2 ))
 OR { 1118}
   (( segid "    " and resid 119  and name HD2 ))
   (( segid "    " and resid 119  and name HE2 ))
 OR { 1118}
   (( segid "    " and resid 119  and name HD1 ))
   (( segid "    " and resid 119  and name HE1 ))
 ASSI { 1120}
   (( segid "    " and resid 47   and name HD2 ))
   (( segid "    " and resid 47   and name HD1 ))
      2.100     0.500     0.500 peak  1120 spectrum    1 weight  0.10000E+01 volume  0.37633E-02 ppm1      1.470 ppm2      1.797 CV     1
 OR { 1120}
   (( segid "    " and resid 47   and name HD2 ))
   (( segid "    " and resid 47   and name HB1 ))
 ASSI { 1124}
   (( segid "    " and resid 47   and name HD2 ))
   (( segid "    " and resid 47   and name HA  ))
      3.300     1.400     1.400 peak  1124 spectrum    1 weight  0.10000E+01 volume  0.50432E-02 ppm1      1.464 ppm2      5.942 CV     1
 ASSI { 1125}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 58   and name HB1 ))
      2.700     0.900     0.900 peak  1125 spectrum    1 weight  0.10000E+01 volume  0.50051E-02 ppm1      4.767 ppm2      3.875 CV     1
 ASSI { 1127}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 58   and name HB2 ))
      2.500     0.800     0.800 peak  1127 spectrum    1 weight  0.10000E+01 volume  0.55591E-02 ppm1      4.772 ppm2      3.795 CV     1
 ASSI { 1128}
   (( segid "    " and resid 120  and name HB1 ))
   (( segid "    " and resid 120  and name HB2 ))
      1.900     0.500     0.500 peak  1128 spectrum    1 weight  0.10000E+01 volume  0.40308E-02 ppm1      3.271 ppm2      2.568 CV     1
 ASSI { 1132}
   (( segid "    " and resid 120  and name HB2 ))
   (  segid "    " and resid 120  and name HE% )
      3.100     1.200     1.200 peak  1132 spectrum    1 weight  0.10000E+01 volume  0.53680E-02 ppm1      2.554 ppm2      6.704 CV     1
 ASSI { 1133}
   (( segid "    " and resid 120  and name HB2 ))
   (  segid "    " and resid 120  and name HD% )
      2.300     0.600     0.600 peak  1133 spectrum    1 weight  0.10000E+01 volume  0.42791E-02 ppm1      2.564 ppm2      6.936 CV     1
 ASSI { 1134}
   (( segid "    " and resid 120  and name HB1 ))
   (  segid "    " and resid 120  and name HD% )
      2.300     0.700     0.700 peak  1134 spectrum    1 weight  0.10000E+01 volume  0.45466E-02 ppm1      3.279 ppm2      6.935 CV     1
 ASSI { 1136}
   (( segid "    " and resid 120  and name HB1 ))
   (( segid "    " and resid 97   and name HB1 ))
      2.900     1.000     1.000 peak  1136 spectrum    1 weight  0.10000E+01 volume  0.50624E-02 ppm1      3.291 ppm2      2.277 CV     1
 OR { 1136}
   (( segid "    " and resid 120  and name HB1 ))
   (( segid "    " and resid 97   and name HB2 ))
 ASSI { 1137}
   (( segid "    " and resid 120  and name HB2 ))
   (  segid "    " and resid 116  and name HB% )
      2.300     0.600     0.600 peak  1137 spectrum    1 weight  0.10000E+01 volume  0.45848E-02 ppm1      2.562 ppm2      1.124 CV     1
 ASSI { 1138}
   (( segid "    " and resid 42   and name HB1 ))
   (  segid "    " and resid 44   and name HD1%)
      3.600     1.600     1.600 peak  1138 spectrum    1 weight  0.10000E+01 volume  0.53107E-02 ppm1      3.278 ppm2      0.961 CV     1
 ASSI { 1140}
   (( segid "    " and resid 121  and name HB1 ))
   (( segid "    " and resid 121  and name HB2 ))
      1.900     0.500     0.500 peak  1140 spectrum    1 weight  0.10000E+01 volume  0.45657E-02 ppm1      3.255 ppm2      2.652 CV     1
 ASSI { 1142}
   (( segid "    " and resid 121  and name HB1 ))
   (( segid "    " and resid 118  and name HA  ))
      3.000     1.100     1.100 peak  1142 spectrum    1 weight  0.10000E+01 volume  0.43556E-02 ppm1      3.252 ppm2      3.955 CV     1
 ASSI { 1144}
   (( segid "    " and resid 121  and name HB1 ))
   (( segid "    " and resid 121  and name HA  ))
      2.200     0.600     0.600 peak  1144 spectrum    1 weight  0.10000E+01 volume  0.53680E-02 ppm1      3.252 ppm2      4.467 CV     1
 ASSI { 1145}
   (( segid "    " and resid 121  and name HB2 ))
   (( segid "    " and resid 121  and name HA  ))
      2.400     0.700     0.700 peak  1145 spectrum    1 weight  0.10000E+01 volume  0.49477E-02 ppm1      2.643 ppm2      4.465 CV     1
 ASSI { 1146}
   (( segid "    " and resid 121  and name HB1 ))
   (  segid "    " and resid 122  and name HE% )
      2.500     0.800     0.800 peak  1146 spectrum    1 weight  0.10000E+01 volume  0.59794E-02 ppm1      3.248 ppm2      6.648 CV     1
 ASSI { 1147}
   (( segid "    " and resid 121  and name HB2 ))
   (  segid "    " and resid 122  and name HE% )
      3.200     3.200     2.800 peak  1147 spectrum    1 weight  0.10000E+01 volume  0.60558E-02 ppm1      2.644 ppm2      6.632 CV     1
 ASSI { 1148}
   (( segid "    " and resid 121  and name HB1 ))
   (  segid "    " and resid 122  and name HD% )
      2.200     0.600     0.600 peak  1148 spectrum    1 weight  0.10000E+01 volume  0.61130E-02 ppm1      3.237 ppm2      7.118 CV     1
 ASSI { 1149}
   (( segid "    " and resid 121  and name HB2 ))
   (  segid "    " and resid 122  and name HD% )
      3.100     1.200     1.200 peak  1149 spectrum    1 weight  0.10000E+01 volume  0.54635E-02 ppm1      2.640 ppm2      7.104 CV     1
 ASSI { 1157}
   (( segid "    " and resid 122  and name HB1 ))
   (( segid "    " and resid 122  and name HB2 ))
      2.000     0.500     0.500 peak  1157 spectrum    1 weight  0.10000E+01 volume  0.40308E-02 ppm1      3.080 ppm2      2.713 CV     1
 ASSI { 1159}
   (( segid "    " and resid 122  and name HB1 ))
   (( segid "    " and resid 126  and name HA2 ))
      2.500     0.800     0.800 peak  1159 spectrum    1 weight  0.10000E+01 volume  0.50815E-02 ppm1      3.073 ppm2      3.510 CV     1
 ASSI { 1160}
   (( segid "    " and resid 122  and name HB2 ))
   (( segid "    " and resid 126  and name HA2 ))
      2.300     0.600     0.600 peak  1160 spectrum    1 weight  0.10000E+01 volume  0.54826E-02 ppm1      2.695 ppm2      3.507 CV     1
 ASSI { 1161}
   (( segid "    " and resid 122  and name HB1 ))
   (( segid "    " and resid 126  and name HA1 ))
      3.000     1.100     1.100 peak  1161 spectrum    1 weight  0.10000E+01 volume  0.52343E-02 ppm1      3.082 ppm2      3.820 CV     1
 ASSI { 1162}
   (( segid "    " and resid 122  and name HB2 ))
   (( segid "    " and resid 126  and name HA1 ))
      3.200     1.300     1.300 peak  1162 spectrum    1 weight  0.10000E+01 volume  0.56736E-02 ppm1      2.736 ppm2      3.823 CV     1
 ASSI { 1163}
   (( segid "    " and resid 122  and name HB2 ))
   (( segid "    " and resid 127  and name HA  ))
      2.800     1.000     1.000 peak  1163 spectrum    1 weight  0.10000E+01 volume  0.48140E-02 ppm1      2.720 ppm2      4.530 CV     1
 ASSI { 1164}
   (( segid "    " and resid 122  and name HB1 ))
   (  segid "    " and resid 122  and name HD% )
      2.500     0.800     0.800 peak  1164 spectrum    1 weight  0.10000E+01 volume  0.44892E-02 ppm1      3.073 ppm2      7.109 CV     1
 ASSI { 1165}
   (( segid "    " and resid 122  and name HB2 ))
   (  segid "    " and resid 122  and name HD% )
      2.500     0.800     0.800 peak  1165 spectrum    1 weight  0.10000E+01 volume  0.47376E-02 ppm1      2.718 ppm2      7.111 CV     1
 ASSI { 1166}
   (( segid "    " and resid 122  and name HB1 ))
   (  segid "    " and resid 122  and name HE% )
      3.200     1.300     1.300 peak  1166 spectrum    1 weight  0.10000E+01 volume  0.64187E-02 ppm1      3.090 ppm2      6.638 CV     1
 ASSI { 1172}
   (( segid "    " and resid 41   and name HA1 ))
   (( segid "    " and resid 38   and name HA  ))
      4.000     2.000     2.000 peak  1172 spectrum    1 weight  0.10000E+01 volume  0.55017E-02 ppm1      4.151 ppm2      4.745 CV     1
 ASSI { 1173}
   (( segid "    " and resid 123  and name HA1 ))
   (( segid "    " and resid 123  and name HA2 ))
      1.900     0.500     0.500 peak  1173 spectrum    1 weight  0.10000E+01 volume  0.39735E-02 ppm1      4.143 ppm2      3.593 CV     1
 ASSI { 1174}
   (( segid "    " and resid 123  and name HA2 ))
   (( segid "    " and resid 119  and name HA  ))
      3.300     1.400     1.400 peak  1174 spectrum    1 weight  0.10000E+01 volume  0.46612E-02 ppm1      3.564 ppm2      3.956 CV     1
 ASSI { 1176}
   (( segid "    " and resid 41   and name HA2 ))
   (( segid "    " and resid 40   and name HA  ))
      3.100     3.100     2.900 peak  1176 spectrum    1 weight  0.10000E+01 volume  0.54635E-02 ppm1      3.604 ppm2      4.643 CV     1
 ASSI { 1177}
   (( segid "    " and resid 41   and name HA2 ))
   (( segid "    " and resid 38   and name HA  ))
      3.100     3.100     2.900 peak  1177 spectrum    1 weight  0.10000E+01 volume  0.53871E-02 ppm1      3.580 ppm2      4.741 CV     1
 ASSI { 1179}
   (( segid "    " and resid 57   and name HB2 ))
   (( segid "    " and resid 59   and name HA  ))
      3.200     3.200     2.800 peak  1179 spectrum    1 weight  0.10000E+01 volume  0.50051E-02 ppm1      3.970 ppm2      5.191 CV     1
 ASSI { 1181}
   (( segid "    " and resid 57   and name HB2 ))
   (( segid "    " and resid 107  and name HB1 ))
      1.900     0.500     0.500 peak  1181 spectrum    1 weight  0.10000E+01 volume  0.47950E-02 ppm1      3.986 ppm2      2.572 CV     1
 ASSI { 1182}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 134  and name HB1 ))
      2.500     2.500     3.500 peak  1182 spectrum    1 weight  0.10000E+01 volume  0.56928E-02 ppm1      3.956 ppm2      2.294 CV     1
 ASSI { 1183}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 124  and name HB1 ))
      2.600     0.800     0.800 peak  1183 spectrum    1 weight  0.10000E+01 volume  0.38397E-02 ppm1      3.985 ppm2      2.116 CV     1
 ASSI { 1186}
   (( segid "    " and resid 57   and name HB2 ))
   (( segid "    " and resid 59   and name HG2 ))
      2.700     2.700     3.300 peak  1186 spectrum    1 weight  0.10000E+01 volume  0.57501E-02 ppm1      3.979 ppm2      1.535 CV     1
 ASSI { 1187}
   (( segid "    " and resid 23   and name HB1 ))
   (( segid "    " and resid 23   and name HB2 ))
      2.400     0.700     0.700 peak  1187 spectrum    1 weight  0.10000E+01 volume  0.28846E-02 ppm1      2.113 ppm2      1.890 CV     1
 ASSI { 1195}
   (( segid "    " and resid 145  and name HB1 ))
   (  segid "    " and resid 143  and name HG2%)
      2.800     1.000     1.000 peak  1195 spectrum    1 weight  0.10000E+01 volume  0.42218E-02 ppm1      1.883 ppm2      1.085 CV     1
 ASSI { 1200}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 125  and name HG1 ))
      2.900     1.100     1.100 peak  1200 spectrum    1 weight  0.10000E+01 volume  0.47950E-02 ppm1      4.149 ppm2      2.548 CV     1
 ASSI { 1201}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 125  and name HG2 ))
      3.000     1.100     1.100 peak  1201 spectrum    1 weight  0.10000E+01 volume  0.46039E-02 ppm1      4.146 ppm2      2.420 CV     1
 ASSI { 1202}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 125  and name HB1 ))
      2.500     0.800     0.800 peak  1202 spectrum    1 weight  0.10000E+01 volume  0.43365E-02 ppm1      4.145 ppm2      2.271 CV     1
 ASSI { 1203}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 125  and name HB2 ))
      3.000     1.100     1.100 peak  1203 spectrum    1 weight  0.10000E+01 volume  0.42027E-02 ppm1      4.146 ppm2      2.132 CV     1
 ASSI { 1207}
   (( segid "    " and resid 125  and name HB1 ))
   (( segid "    " and resid 125  and name HG2 ))
      2.500     0.800     0.800 peak  1207 spectrum    1 weight  0.10000E+01 volume  0.39353E-02 ppm1      2.264 ppm2      2.481 CV     1
 ASSI { 1208}
   (( segid "    " and resid 125  and name HB2 ))
   (( segid "    " and resid 125  and name HG2 ))
      3.000     1.200     1.200 peak  1208 spectrum    1 weight  0.10000E+01 volume  0.34959E-02 ppm1      2.137 ppm2      2.400 CV     1
 ASSI { 1209}
   (( segid "    " and resid 125  and name HB2 ))
   (( segid "    " and resid 125  and name HG1 ))
      2.500     0.800     0.800 peak  1209 spectrum    1 weight  0.10000E+01 volume  0.42791E-02 ppm1      2.140 ppm2      2.549 CV     1
 ASSI { 1216}
   (( segid "    " and resid 97   and name HB1 ))
   (  segid "    " and resid 120  and name HD% )
      2.300     0.700     0.700 peak  1216 spectrum    1 weight  0.10000E+01 volume  0.39162E-02 ppm1      2.266 ppm2      6.936 CV     1
 OR { 1216}
   (( segid "    " and resid 97   and name HB2 ))
   (  segid "    " and resid 120  and name HD% )
 ASSI { 1217}
   (( segid "    " and resid 104  and name HG1 ))
   (( segid "    " and resid 104  and name HB2 ))
      2.800     1.000     1.000 peak  1217 spectrum    1 weight  0.10000E+01 volume  0.43556E-02 ppm1      2.122 ppm2      1.651 CV     1
 ASSI { 1222}
   (( segid "    " and resid 29   and name HB1 ))
   (  segid "    " and resid 28   and name HB% )
      3.500     1.500     1.500 peak  1222 spectrum    1 weight  0.10000E+01 volume  0.55972E-02 ppm1      2.398 ppm2      1.361 CV     1
 ASSI { 1223}
   (( segid "    " and resid 125  and name HG1 ))
   (( segid "    " and resid 124  and name HB2 ))
      2.700     2.700     3.300 peak  1223 spectrum    1 weight  0.10000E+01 volume  0.59794E-02 ppm1      2.567 ppm2      1.928 CV     1
 OR { 1223}
   (( segid "    " and resid 125  and name HG1 ))
   (( segid "    " and resid 124  and name HG2 ))
 ASSI { 1236}
   (( segid "    " and resid 127  and name HA  ))
   (( segid "    " and resid 131  and name HB2 ))
      3.600     3.600     2.400 peak  1236 spectrum    1 weight  0.10000E+01 volume  0.42982E-02 ppm1      4.512 ppm2      2.918 CV     1
 OR { 1236}
   (( segid "    " and resid 127  and name HA  ))
   (( segid "    " and resid 131  and name HB1 ))
 ASSI { 1237}
   (( segid "    " and resid 127  and name HB1 ))
   (( segid "    " and resid 127  and name HB2 ))
      1.900     0.500     0.500 peak  1237 spectrum    1 weight  0.10000E+01 volume  0.35532E-02 ppm1      3.002 ppm2      2.690 CV     1
 ASSI { 1239}
   (( segid "    " and resid 127  and name HB1 ))
   (( segid "    " and resid 122  and name HB1 ))
      3.100     1.200     1.200 peak  1239 spectrum    1 weight  0.10000E+01 volume  0.52725E-02 ppm1      3.002 ppm2      3.127 CV     1
 ASSI { 1241}
   (( segid "    " and resid 127  and name HB2 ))
   (( segid "    " and resid 127  and name HA  ))
      2.400     0.700     0.700 peak  1241 spectrum    1 weight  0.10000E+01 volume  0.38971E-02 ppm1      2.690 ppm2      4.506 CV     1
 ASSI { 1243}
   (( segid "    " and resid 127  and name HB2 ))
   (( segid "    " and resid 130  and name HA  ))
      3.400     3.400     2.600 peak  1243 spectrum    1 weight  0.10000E+01 volume  0.60749E-02 ppm1      2.711 ppm2      4.786 CV     1
 ASSI { 1244}
   (( segid "    " and resid 127  and name HB1 ))
   (( segid "    " and resid 132  and name HB  ))
      2.900     1.100     1.100 peak  1244 spectrum    1 weight  0.10000E+01 volume  0.43173E-02 ppm1      3.007 ppm2      1.144 CV     1
 ASSI { 1245}
   (( segid "    " and resid 127  and name HB2 ))
   (( segid "    " and resid 132  and name HB  ))
      2.800     1.000     1.000 peak  1245 spectrum    1 weight  0.10000E+01 volume  0.44892E-02 ppm1      2.692 ppm2      1.145 CV     1
 ASSI { 1246}
   (( segid "    " and resid 127  and name HB2 ))
   (( segid "    " and resid 132  and name HG11))
      2.600     0.800     0.800 peak  1246 spectrum    1 weight  0.10000E+01 volume  0.54062E-02 ppm1      2.691 ppm2      1.014 CV     1
 ASSI { 1247}
   (( segid "    " and resid 127  and name HB1 ))
   (( segid "    " and resid 132  and name HG11))
      2.400     0.700     0.700 peak  1247 spectrum    1 weight  0.10000E+01 volume  0.51579E-02 ppm1      2.996 ppm2      1.006 CV     1
 ASSI { 1248}
   (( segid "    " and resid 127  and name HB1 ))
   (  segid "    " and resid 132  and name HG2%)
      3.400     1.500     1.500 peak  1248 spectrum    1 weight  0.10000E+01 volume  0.51770E-02 ppm1      3.001 ppm2      0.933 CV     1
 ASSI { 1249}
   (( segid "    " and resid 127  and name HB2 ))
   (  segid "    " and resid 132  and name HG2%)
      3.400     1.400     1.400 peak  1249 spectrum    1 weight  0.10000E+01 volume  0.53871E-02 ppm1      2.692 ppm2      0.936 CV     1
 ASSI { 1250}
   (( segid "    " and resid 127  and name HB2 ))
   (  segid "    " and resid 132  and name HD1%)
      2.400     0.700     0.700 peak  1250 spectrum    1 weight  0.10000E+01 volume  0.48140E-02 ppm1      2.696 ppm2      0.460 CV     1
 ASSI { 1251}
   (( segid "    " and resid 127  and name HB1 ))
   (  segid "    " and resid 132  and name HD1%)
      2.200     0.600     0.600 peak  1251 spectrum    1 weight  0.10000E+01 volume  0.47376E-02 ppm1      3.006 ppm2      0.458 CV     1
 ASSI { 1257}
   (( segid "    " and resid 128  and name HG1 ))
   (( segid "    " and resid 128  and name HD1 ))
      2.600     0.900     0.900 peak  1257 spectrum    1 weight  0.10000E+01 volume  0.34768E-02 ppm1      1.691 ppm2      3.241 CV     1
 ASSI { 1259}
   (( segid "    " and resid 128  and name HG1 ))
   (( segid "    " and resid 127  and name HA  ))
      3.500     1.600     1.600 peak  1259 spectrum    1 weight  0.10000E+01 volume  0.41072E-02 ppm1      1.694 ppm2      4.504 CV     1
 ASSI { 1262}
   (( segid "    " and resid 129  and name HB1 ))
   (( segid "    " and resid 129  and name HA  ))
      2.800     1.000     1.000 peak  1262 spectrum    1 weight  0.10000E+01 volume  0.37442E-02 ppm1      3.765 ppm2      4.506 CV     1
 ASSI { 1263}
   (( segid "    " and resid 129  and name HB1 ))
   (( segid "    " and resid 130  and name HA  ))
      3.000     3.000     3.000 peak  1263 spectrum    1 weight  0.10000E+01 volume  0.40499E-02 ppm1      3.765 ppm2      4.741 CV     1
 ASSI { 1264}
   (( segid "    " and resid 129  and name HB2 ))
   (( segid "    " and resid 130  and name HA  ))
      3.300     1.400     1.400 peak  1264 spectrum    1 weight  0.10000E+01 volume  0.40117E-02 ppm1      3.603 ppm2      4.742 CV     1
 ASSI { 1266}
   (( segid "    " and resid 129  and name HB1 ))
   (( segid "    " and resid 128  and name HD1 ))
      1.500     1.500     4.500 peak  1266 spectrum    1 weight  0.10000E+01 volume  0.54254E-02 ppm1      3.766 ppm2      3.189 CV     1
 ASSI { 1271}
   (( segid "    " and resid 29   and name HA  ))
   (  segid "    " and resid 30   and name HB% )
      3.200     1.300     1.300 peak  1271 spectrum    1 weight  0.10000E+01 volume  0.57883E-02 ppm1      4.745 ppm2      1.548 CV     1
 ASSI { 1272}
   (( segid "    " and resid 130  and name HA  ))
   (( segid "    " and resid 130  and name HG2 ))
      3.200     1.300     1.300 peak  1272 spectrum    1 weight  0.10000E+01 volume  0.58839E-02 ppm1      4.749 ppm2      1.438 CV     1
 ASSI { 1273}
   (( segid "    " and resid 29   and name HA  ))
   (( segid "    " and resid 29   and name HB2 ))
      2.800     1.000     1.000 peak  1273 spectrum    1 weight  0.10000E+01 volume  0.60175E-02 ppm1      4.729 ppm2      2.181 CV     1
 ASSI { 1282}
   (( segid "    " and resid 97   and name HG1 ))
   (( segid "    " and resid 101  and name HG  ))
      2.200     0.600     0.600 peak  1282 spectrum    1 weight  0.10000E+01 volume  0.59602E-02 ppm1      2.655 ppm2      1.839 CV     1
 ASSI { 1286}
   (( segid "    " and resid 79   and name HB1 ))
   (( segid "    " and resid 73   and name HA  ))
      3.200     1.300     1.300 peak  1286 spectrum    1 weight  0.10000E+01 volume  0.49669E-02 ppm1      1.887 ppm2      5.544 CV     1
 ASSI { 1290}
   (( segid "    " and resid 31   and name HD2 ))
   (( segid "    " and resid 29   and name HA  ))
      3.500     1.500     1.500 peak  1290 spectrum    1 weight  0.10000E+01 volume  0.29610E-02 ppm1      3.664 ppm2      4.740 CV     1
 ASSI { 1291}
   (( segid "    " and resid 31   and name HD1 ))
   (( segid "    " and resid 29   and name HA  ))
      3.400     1.400     1.400 peak  1291 spectrum    1 weight  0.10000E+01 volume  0.29037E-02 ppm1      3.814 ppm2      4.744 CV     1
 ASSI { 1292}
   (( segid "    " and resid 84   and name HD1 ))
   (( segid "    " and resid 83   and name HA  ))
      2.400     0.700     0.700 peak  1292 spectrum    1 weight  0.10000E+01 volume  0.41263E-02 ppm1      3.804 ppm2      5.037 CV     1
 ASSI { 1293}
   (( segid "    " and resid 31   and name HD2 ))
   (( segid "    " and resid 31   and name HG2 ))
      2.500     0.800     0.800 peak  1293 spectrum    1 weight  0.10000E+01 volume  0.37061E-02 ppm1      3.651 ppm2      2.027 CV     1
 ASSI { 1294}
   (( segid "    " and resid 25   and name HD1 ))
   (( segid "    " and resid 25   and name HG1 ))
      2.600     0.800     0.800 peak  1294 spectrum    1 weight  0.10000E+01 volume  0.30183E-02 ppm1      3.808 ppm2      2.027 CV     1
 ASSI { 1299}
   (( segid "    " and resid 61   and name HA  ))
   (  segid "    " and resid 61   and name HG1%)
      2.800     0.900     0.900 peak  1299 spectrum    1 weight  0.10000E+01 volume  0.41645E-02 ppm1      4.412 ppm2      0.937 CV     1
 ASSI { 1301}
   (( segid "    " and resid 131  and name HB1 ))
   (( segid "    " and resid 131  and name HB2 ))
      2.200     0.600     0.600 peak  1301 spectrum    1 weight  0.10000E+01 volume  0.38016E-02 ppm1      2.977 ppm2      2.858 CV     1
 ASSI { 1303}
   (( segid "    " and resid 76   and name HB2 ))
   (( segid "    " and resid 76   and name HB1 ))
      2.200     0.600     0.600 peak  1303 spectrum    1 weight  0.10000E+01 volume  0.40117E-02 ppm1      2.868 ppm2      3.323 CV     1
 ASSI { 1306}
   (( segid "    " and resid 76   and name HB2 ))
   (( segid "    " and resid 76   and name HA  ))
      2.800     1.000     1.000 peak  1306 spectrum    1 weight  0.10000E+01 volume  0.47950E-02 ppm1      2.878 ppm2      4.575 CV     1
 ASSI { 1307}
   (( segid "    " and resid 131  and name HB1 ))
   (  segid "    " and resid 131  and name HD% )
      2.500     0.800     0.800 peak  1307 spectrum    1 weight  0.10000E+01 volume  0.50241E-02 ppm1      2.988 ppm2      7.193 CV     1
 ASSI { 1308}
   (( segid "    " and resid 131  and name HB2 ))
   (  segid "    " and resid 131  and name HD% )
      2.700     0.900     0.900 peak  1308 spectrum    1 weight  0.10000E+01 volume  0.48331E-02 ppm1      2.857 ppm2      7.187 CV     1
 ASSI { 1318}
   (( segid "    " and resid 132  and name HB  ))
   (( segid "    " and resid 132  and name HA  ))
      2.500     0.800     0.800 peak  1318 spectrum    1 weight  0.10000E+01 volume  0.51197E-02 ppm1      1.136 ppm2      4.111 CV     1
 ASSI { 1319}
   (( segid "    " and resid 132  and name HB  ))
   (  segid "    " and resid 122  and name HD% )
      2.500     0.800     0.800 peak  1319 spectrum    1 weight  0.10000E+01 volume  0.53680E-02 ppm1      1.157 ppm2      7.120 CV     1
 ASSI { 1320}
   (( segid "    " and resid 132  and name HB  ))
   (( segid "    " and resid 132  and name HG11))
      2.400     0.700     0.700 peak  1320 spectrum    1 weight  0.10000E+01 volume  0.46039E-02 ppm1      1.155 ppm2      1.017 CV     1
 ASSI { 1322}
   (( segid "    " and resid 132  and name HB  ))
   (  segid "    " and resid 132  and name HD1%)
      2.600     0.800     0.800 peak  1322 spectrum    1 weight  0.10000E+01 volume  0.41455E-02 ppm1      1.144 ppm2      0.457 CV     1
 ASSI { 1325}
   (( segid "    " and resid 134  and name HB1 ))
   (( segid "    " and resid 124  and name HD2 ))
      3.300     1.400     1.400 peak  1325 spectrum    1 weight  0.10000E+01 volume  0.43173E-02 ppm1      2.293 ppm2      3.604 CV     1
 ASSI { 1328}
   (( segid "    " and resid 134  and name HB1 ))
   (( segid "    " and resid 119  and name HB1 ))
      3.000     3.000     3.000 peak  1328 spectrum    1 weight  0.10000E+01 volume  0.38207E-02 ppm1      2.296 ppm2      1.619 CV     1
 ASSI { 1336}
   (( segid "    " and resid 135  and name HB1 ))
   (( segid "    " and resid 135  and name HA  ))
      2.500     0.800     0.800 peak  1336 spectrum    1 weight  0.10000E+01 volume  0.41455E-02 ppm1      3.215 ppm2      3.868 CV     1
 ASSI { 1338}
   (( segid "    " and resid 135  and name HB1 ))
   (( segid "    " and resid 118  and name HB1 ))
      3.100     3.100     2.900 peak  1338 spectrum    1 weight  0.10000E+01 volume  0.53489E-02 ppm1      3.217 ppm2      3.603 CV     1
 ASSI { 1349}
   (( segid "    " and resid 135  and name HB2 ))
   (  segid "    " and resid 137  and name HB% )
      2.800     2.800     3.200 peak  1349 spectrum    1 weight  0.10000E+01 volume  0.58647E-02 ppm1      3.173 ppm2      1.442 CV     1
 ASSI { 1350}
   (( segid "    " and resid 135  and name HB1 ))
   (  segid "    " and resid 137  and name HB% )
      2.900     2.900     3.100 peak  1350 spectrum    1 weight  0.10000E+01 volume  0.58839E-02 ppm1      3.263 ppm2      1.442 CV     1
 OR { 1350}
   (( segid "    " and resid 135  and name HB2 ))
   (  segid "    " and resid 137  and name HB% )
 ASSI { 1355}
   (  segid "    " and resid 136  and name HB% )
   (( segid "    " and resid 136  and name HA  ))
      2.600     0.800     0.800 peak  1355 spectrum    1 weight  0.10000E+01 volume  0.39735E-02 ppm1      1.271 ppm2      4.407 CV     1
 ASSI { 1356}
   (  segid "    " and resid 136  and name HB% )
   (( segid "    " and resid 74   and name HA  ))
      2.900     2.900     3.100 peak  1356 spectrum    1 weight  0.10000E+01 volume  0.41263E-02 ppm1      1.260 ppm2      4.770 CV     1
 ASSI { 1357}
   (  segid "    " and resid 78   and name HG2%)
   (  segid "    " and resid 80   and name HG1%)
      2.900     1.000     1.000 peak  1357 spectrum    1 weight  0.10000E+01 volume  0.30566E-02 ppm1      1.271 ppm2      0.935 CV     1
 ASSI { 1358}
   (  segid "    " and resid 136  and name HB% )
   (  segid "    " and resid 74   and name HD2%)
      3.200     1.300     1.300 peak  1358 spectrum    1 weight  0.10000E+01 volume  0.29419E-02 ppm1      1.264 ppm2      0.856 CV     1
 ASSI { 1359}
   (  segid "    " and resid 136  and name HB% )
   (  segid "    " and resid 132  and name HD1%)
      3.500     1.500     1.500 peak  1359 spectrum    1 weight  0.10000E+01 volume  0.45084E-02 ppm1      1.272 ppm2      0.458 CV     1
 ASSI { 1360}
   (( segid "    " and resid 137  and name HA  ))
   (  segid "    " and resid 137  and name HB% )
      2.400     0.700     0.700 peak  1360 spectrum    1 weight  0.10000E+01 volume  0.48331E-02 ppm1      4.644 ppm2      1.457 CV     1
 ASSI { 1362}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 6    and name HA  ))
      2.900     1.000     1.000 peak  1362 spectrum    1 weight  0.10000E+01 volume  0.35341E-02 ppm1      1.404 ppm2      4.296 CV     1
 ASSI { 1363}
   (( segid "    " and resid 138  and name HA  ))
   (( segid "    " and resid 138  and name HB1 ))
      2.600     0.800     0.800 peak  1363 spectrum    1 weight  0.10000E+01 volume  0.39926E-02 ppm1      5.244 ppm2      1.904 CV     1
 ASSI { 1365}
   (( segid "    " and resid 138  and name HA  ))
   (  segid "    " and resid 138  and name HD2%)
      3.300     1.400     1.400 peak  1365 spectrum    1 weight  0.10000E+01 volume  0.34004E-02 ppm1      5.245 ppm2      0.861 CV     1
 ASSI { 1372}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 146  and name HB  ))
      3.000     1.100     1.100 peak  1372 spectrum    1 weight  0.10000E+01 volume  0.57692E-02 ppm1      5.084 ppm2      4.119 CV     1
 ASSI { 1373}
   (( segid "    " and resid 139  and name HA  ))
   (( segid "    " and resid 139  and name HB1 ))
      2.700     0.900     0.900 peak  1373 spectrum    1 weight  0.10000E+01 volume  0.45848E-02 ppm1      5.092 ppm2      2.892 CV     1
 ASSI { 1374}
   (( segid "    " and resid 139  and name HA  ))
   (( segid "    " and resid 139  and name HB2 ))
      2.400     0.700     0.700 peak  1374 spectrum    1 weight  0.10000E+01 volume  0.59411E-02 ppm1      5.094 ppm2      2.683 CV     1
 ASSI { 1376}
   (( segid "    " and resid 139  and name HA  ))
   (  segid "    " and resid 140  and name HD1%)
      3.700     1.700     1.700 peak  1376 spectrum    1 weight  0.10000E+01 volume  0.57501E-02 ppm1      5.071 ppm2      0.957 CV     1
 ASSI { 1382}
   (( segid "    " and resid 139  and name HB2 ))
   (( segid "    " and resid 73   and name HB1 ))
      3.000     1.100     1.100 peak  1382 spectrum    1 weight  0.10000E+01 volume  0.46230E-02 ppm1      2.687 ppm2      3.726 CV     1
 ASSI { 1386}
   (( segid "    " and resid 139  and name HB1 ))
   (  segid "    " and resid 115  and name HG2%)
      3.200     1.300     1.300 peak  1386 spectrum    1 weight  0.10000E+01 volume  0.51961E-02 ppm1      2.890 ppm2      1.121 CV     1
 ASSI { 1387}
   (( segid "    " and resid 139  and name HB2 ))
   (  segid "    " and resid 115  and name HG2%)
      2.700     0.900     0.900 peak  1387 spectrum    1 weight  0.10000E+01 volume  0.51006E-02 ppm1      2.684 ppm2      1.124 CV     1
 ASSI { 1388}
   (( segid "    " and resid 139  and name HB1 ))
   (  segid "    " and resid 140  and name HD2%)
      3.100     3.100     2.900 peak  1388 spectrum    1 weight  0.10000E+01 volume  0.63041E-02 ppm1      2.880 ppm2      0.730 CV     1
 ASSI { 1390}
   (( segid "    " and resid 140  and name HA  ))
   (( segid "    " and resid 140  and name HB2 ))
      2.400     0.700     0.700 peak  1390 spectrum    1 weight  0.10000E+01 volume  0.45084E-02 ppm1      5.293 ppm2      1.304 CV     1
 ASSI { 1391}
   (( segid "    " and resid 140  and name HA  ))
   (  segid "    " and resid 140  and name HD1%)
      3.300     1.400     1.400 peak  1391 spectrum    1 weight  0.10000E+01 volume  0.36296E-02 ppm1      5.290 ppm2      0.940 CV     1
 ASSI { 1397}
   (( segid "    " and resid 44   and name HB1 ))
   (  segid "    " and resid 120  and name HE% )
      3.600     1.600     1.600 peak  1397 spectrum    1 weight  0.10000E+01 volume  0.44511E-02 ppm1      1.964 ppm2      6.703 CV     1
 ASSI { 1398}
   (( segid "    " and resid 44   and name HB2 ))
   (  segid "    " and resid 120  and name HE% )
      3.100     1.200     1.200 peak  1398 spectrum    1 weight  0.10000E+01 volume  0.46039E-02 ppm1      1.698 ppm2      6.703 CV     1
 ASSI { 1400}
   (( segid "    " and resid 44   and name HB1 ))
   (( segid "    " and resid 117  and name HB1 ))
      3.500     1.600     1.600 peak  1400 spectrum    1 weight  0.10000E+01 volume  0.54062E-02 ppm1      1.952 ppm2      2.998 CV     1
 ASSI { 1401}
   (( segid "    " and resid 44   and name HB2 ))
   (( segid "    " and resid 117  and name HB1 ))
      3.100     1.200     1.200 peak  1401 spectrum    1 weight  0.10000E+01 volume  0.52343E-02 ppm1      1.691 ppm2      2.989 CV     1
 ASSI { 1402}
   (( segid "    " and resid 140  and name HB1 ))
   (  segid "    " and resid 140  and name HD1%)
      3.200     1.300     1.300 peak  1402 spectrum    1 weight  0.10000E+01 volume  0.35341E-02 ppm1      1.931 ppm2      0.965 CV     1
 ASSI { 1404}
   (( segid "    " and resid 45   and name HB1 ))
   (  segid "    " and resid 40   and name HD2%)
      3.000     1.200     1.200 peak  1404 spectrum    1 weight  0.10000E+01 volume  0.43746E-02 ppm1      1.705 ppm2      0.594 CV     1
 ASSI { 1405}
   (( segid "    " and resid 45   and name HB1 ))
   (  segid "    " and resid 45   and name HD2%)
      2.600     0.800     0.800 peak  1405 spectrum    1 weight  0.10000E+01 volume  0.38207E-02 ppm1      1.696 ppm2      0.518 CV     1
 ASSI { 1410}
   (  segid "    " and resid 140  and name HD1%)
   (( segid "    " and resid 70   and name HA  ))
      3.400     1.500     1.500 peak  1410 spectrum    1 weight  0.10000E+01 volume  0.36106E-02 ppm1      0.947 ppm2      5.376 CV     1
 ASSI { 1412}
   (  segid "    " and resid 140  and name HD2%)
   (  segid "    " and resid 72   and name HG2%)
      2.800     1.000     1.000 peak  1412 spectrum    1 weight  0.10000E+01 volume  0.31712E-02 ppm1      0.707 ppm2      1.135 CV     1
 ASSI { 1417}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 85   and name HA  ))
      2.400     0.700     0.700 peak  1417 spectrum    1 weight  0.10000E+01 volume  0.38207E-02 ppm1      2.046 ppm2      4.396 CV     1
 OR { 1417}
   (( segid "    " and resid 85   and name HG1 ))
   (( segid "    " and resid 85   and name HA  ))
 ASSI { 1419}
   (( segid "    " and resid 141  and name HG2 ))
   (( segid "    " and resid 141  and name HA  ))
      2.800     1.000     1.000 peak  1419 spectrum    1 weight  0.10000E+01 volume  0.40690E-02 ppm1      1.969 ppm2      5.230 CV     1
 ASSI { 1421}
   (( segid "    " and resid 141  and name HG2 ))
   (  segid "    " and resid 111  and name HG2%)
      2.600     0.800     0.800 peak  1421 spectrum    1 weight  0.10000E+01 volume  0.41263E-02 ppm1      1.969 ppm2      1.198 CV     1
 OR { 1421}
   (( segid "    " and resid 141  and name HG1 ))
   (  segid "    " and resid 111  and name HG2%)
 ASSI { 1422}
   (( segid "    " and resid 85   and name HG2 ))
   (  segid "    " and resid 67   and name HG2%)
      3.600     1.600     1.600 peak  1422 spectrum    1 weight  0.10000E+01 volume  0.34959E-02 ppm1      2.045 ppm2      1.067 CV     1
 OR { 1422}
   (( segid "    " and resid 85   and name HG1 ))
   (  segid "    " and resid 67   and name HG2%)
 ASSI { 1423}
   (( segid "    " and resid 142  and name HA  ))
   (( segid "    " and resid 70   and name HA  ))
      2.400     0.700     0.700 peak  1423 spectrum    1 weight  0.10000E+01 volume  0.43746E-02 ppm1      5.068 ppm2      5.380 CV     1
 ASSI { 1427}
   (( segid "    " and resid 142  and name HA  ))
   (  segid "    " and resid 140  and name HD1%)
      3.000     1.200     1.200 peak  1427 spectrum    1 weight  0.10000E+01 volume  0.49860E-02 ppm1      5.066 ppm2      0.951 CV     1
 ASSI { 1428}
   (( segid "    " and resid 142  and name HA  ))
   (  segid "    " and resid 142  and name HG2%)
      3.000     1.100     1.100 peak  1428 spectrum    1 weight  0.10000E+01 volume  0.41645E-02 ppm1      5.074 ppm2      0.850 CV     1
 ASSI { 1431}
   (  segid "    " and resid 142  and name HG1%)
   (( segid "    " and resid 142  and name HB  ))
      2.600     0.800     0.800 peak  1431 spectrum    1 weight  0.10000E+01 volume  0.28082E-02 ppm1      0.854 ppm2      1.969 CV     1
 ASSI { 1433}
   (  segid "    " and resid 44   and name HD2%)
   (( segid "    " and resid 117  and name HB1 ))
      3.400     1.400     1.400 peak  1433 spectrum    1 weight  0.10000E+01 volume  0.42601E-02 ppm1      0.835 ppm2      2.994 CV     1
 ASSI { 1434}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 108  and name HA  ))
      2.400     0.700     0.700 peak  1434 spectrum    1 weight  0.10000E+01 volume  0.37442E-02 ppm1      0.841 ppm2      3.337 CV     1
 ASSI { 1442}
   (  segid "    " and resid 142  and name HG2%)
   (( segid "    " and resid 141  and name HA  ))
      3.400     1.400     1.400 peak  1442 spectrum    1 weight  0.10000E+01 volume  0.38207E-02 ppm1      0.855 ppm2      5.227 CV     1
 ASSI { 1446}
   (( segid "    " and resid 143  and name HA  ))
   (( segid "    " and resid 143  and name HB  ))
      2.300     0.700     0.700 peak  1446 spectrum    1 weight  0.10000E+01 volume  0.48905E-02 ppm1      5.615 ppm2      4.086 CV     1
 ASSI { 1447}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 111  and name HB  ))
      2.500     0.800     0.800 peak  1447 spectrum    1 weight  0.10000E+01 volume  0.49286E-02 ppm1      5.622 ppm2      3.781 CV     1
 ASSI { 1450}
   (( segid "    " and resid 143  and name HA  ))
   (( segid "    " and resid 144  and name HB2 ))
      3.400     1.500     1.500 peak  1450 spectrum    1 weight  0.10000E+01 volume  0.61130E-02 ppm1      5.615 ppm2      1.326 CV     1
 ASSI { 1455}
   (  segid "    " and resid 68   and name HG1%)
   (  segid "    " and resid 88   and name HE% )
      2.400     0.700     0.700 peak  1455 spectrum    1 weight  0.10000E+01 volume  0.36487E-02 ppm1      1.097 ppm2      7.179 CV     1
 ASSI { 1456}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 36   and name HH2 ))
      3.200     1.300     1.300 peak  1456 spectrum    1 weight  0.10000E+01 volume  0.41455E-02 ppm1      1.120 ppm2      7.014 CV     1
 ASSI { 1457}
   (  segid "    " and resid 68   and name HG1%)
   (( segid "    " and resid 88   and name HZ  ))
      2.800     1.000     1.000 peak  1457 spectrum    1 weight  0.10000E+01 volume  0.50241E-02 ppm1      1.105 ppm2      6.856 CV     1
 ASSI { 1458}
   (  segid "    " and resid 68   and name HG1%)
   (  segid "    " and resid 66   and name HG2%)
      2.500     0.800     0.800 peak  1458 spectrum    1 weight  0.10000E+01 volume  0.44702E-02 ppm1      1.085 ppm2      0.023 CV     1
 ASSI { 1459}
   (( segid "    " and resid 94   and name HA  ))
   (  segid "    " and resid 95   and name HG2%)
      3.200     1.300     1.300 peak  1459 spectrum    1 weight  0.10000E+01 volume  0.56546E-02 ppm1      4.682 ppm2      0.121 CV     1
 ASSI { 1460}
   (( segid "    " and resid 94   and name HA  ))
   (( segid "    " and resid 94   and name HB2 ))
      2.400     0.700     0.700 peak  1460 spectrum    1 weight  0.10000E+01 volume  0.62659E-02 ppm1      4.681 ppm2      2.729 CV     1
 ASSI { 1462}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 36   and name HZ3 ))
      2.900     2.900     3.100 peak  1462 spectrum    1 weight  0.10000E+01 volume  0.66479E-02 ppm1      4.675 ppm2      7.032 CV     1
 OR { 1462}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 36   and name HH2 ))
 ASSI { 1464}
   (( segid "    " and resid 144  and name HB2 ))
   (( segid "    " and resid 144  and name HB1 ))
      2.000     0.500     0.500 peak  1464 spectrum    1 weight  0.10000E+01 volume  0.41263E-02 ppm1      1.310 ppm2      2.367 CV     1
 ASSI { 1474}
   (  segid "    " and resid 99   and name HD2%)
   (( segid "    " and resid 99   and name HB1 ))
      2.400     0.700     0.700 peak  1474 spectrum    1 weight  0.10000E+01 volume  0.37442E-02 ppm1      0.748 ppm2      1.499 CV     1
 ASSI { 1475}
   (  segid "    " and resid 99   and name HD2%)
   (( segid "    " and resid 95   and name HB  ))
      2.600     0.800     0.800 peak  1475 spectrum    1 weight  0.10000E+01 volume  0.39543E-02 ppm1      0.753 ppm2      1.809 CV     1
 ASSI { 1478}
   (  segid "    " and resid 99   and name HD2%)
   (( segid "    " and resid 88   and name HZ  ))
      2.700     0.900     0.900 peak  1478 spectrum    1 weight  0.10000E+01 volume  0.46230E-02 ppm1      0.752 ppm2      6.852 CV     1
 ASSI { 1480}
   (  segid "    " and resid 99   and name HD2%)
   (  segid "    " and resid 95   and name HG1%)
      2.400     0.700     0.700 peak  1480 spectrum    1 weight  0.10000E+01 volume  0.38971E-02 ppm1      0.745 ppm2      0.325 CV     1
 ASSI { 1481}
   (  segid "    " and resid 99   and name HD2%)
   (  segid "    " and resid 95   and name HG2%)
      2.700     0.900     0.900 peak  1481 spectrum    1 weight  0.10000E+01 volume  0.37633E-02 ppm1      0.744 ppm2      0.099 CV     1
 ASSI { 1483}
   (( segid "    " and resid 145  and name HA  ))
   (( segid "    " and resid 145  and name HB1 ))
      2.400     0.700     0.700 peak  1483 spectrum    1 weight  0.10000E+01 volume  0.46039E-02 ppm1      4.330 ppm2      1.879 CV     1
 ASSI { 1485}
   (( segid "    " and resid 145  and name HA  ))
   (( segid "    " and resid 145  and name HG1 ))
      3.200     1.300     1.300 peak  1485 spectrum    1 weight  0.10000E+01 volume  0.52725E-02 ppm1      4.330 ppm2      1.580 CV     1
 ASSI { 1487}
   (( segid "    " and resid 145  and name HB1 ))
   (( segid "    " and resid 145  and name HB2 ))
      2.200     0.600     0.600 peak  1487 spectrum    1 weight  0.10000E+01 volume  0.30947E-02 ppm1      1.845 ppm2      1.703 CV     1
 ASSI { 1502}
   (( segid "    " and resid 66   and name HB  ))
   (  segid "    " and resid 66   and name HG2%)
      2.400     0.700     0.700 peak  1502 spectrum    1 weight  0.10000E+01 volume  0.39926E-02 ppm1      1.695 ppm2      0.026 CV     1
 ASSI { 1515}
   (( segid "    " and resid 146  and name HA  ))
   (  segid "    " and resid 146  and name HG2%)
      2.700     0.900     0.900 peak  1515 spectrum    1 weight  0.10000E+01 volume  0.49477E-02 ppm1      4.523 ppm2      1.115 CV     1
 ASSI { 1516}
   (( segid "    " and resid 146  and name HA  ))
   (  segid "    " and resid 148  and name HG1%)
      3.300     3.300     2.700 peak  1516 spectrum    1 weight  0.10000E+01 volume  0.49477E-02 ppm1      4.517 ppm2      0.840 CV     1
 ASSI { 1519}
   (( segid "    " and resid 146  and name HB  ))
   (  segid "    " and resid 148  and name HG1%)
      3.000     1.100     1.100 peak  1519 spectrum    1 weight  0.10000E+01 volume  0.45466E-02 ppm1      4.060 ppm2      0.901 CV     1
 ASSI { 1521}
   (( segid "    " and resid 146  and name HB  ))
   (  segid "    " and resid 66   and name HG2%)
      1.500     1.500     4.500 peak  1521 spectrum    1 weight  0.10000E+01 volume  0.58456E-02 ppm1      4.065 ppm2      0.088 CV     1
 ASSI { 1524}
   (  segid "    " and resid 146  and name HG2%)
   (( segid "    " and resid 147  and name HA  ))
      3.100     1.200     1.200 peak  1524 spectrum    1 weight  0.10000E+01 volume  0.32476E-02 ppm1      1.129 ppm2      5.021 CV     1
 ASSI { 1525}
   (  segid "    " and resid 147  and name HB% )
   (  segid "    " and resid 66   and name HG1%)
      2.800     1.000     1.000 peak  1525 spectrum    1 weight  0.10000E+01 volume  0.33431E-02 ppm1      1.132 ppm2      0.680 CV     1
 ASSI { 1529}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 83   and name HG2 ))
      2.700     0.900     0.900 peak  1529 spectrum    1 weight  0.10000E+01 volume  0.46994E-02 ppm1      5.036 ppm2      2.188 CV     1
 OR { 1529}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 83   and name HG1 ))
 ASSI { 1536}
   (  segid "    " and resid 147  and name HB% )
   (  segid "    " and resid 148  and name HG1%)
      3.400     1.500     1.500 peak  1536 spectrum    1 weight  0.10000E+01 volume  0.31329E-02 ppm1      1.118 ppm2      0.848 CV     1
 ASSI { 1537}
   (( segid "    " and resid 148  and name HA  ))
   (( segid "    " and resid 148  and name HB  ))
      2.600     0.800     0.800 peak  1537 spectrum    1 weight  0.10000E+01 volume  0.49286E-02 ppm1      4.597 ppm2      2.125 CV     1
 ASSI { 1538}
   (( segid "    " and resid 148  and name HA  ))
   (  segid "    " and resid 148  and name HG2%)
      2.600     0.900     0.900 peak  1538 spectrum    1 weight  0.10000E+01 volume  0.51579E-02 ppm1      4.589 ppm2      0.901 CV     1
 OR { 1538}
   (( segid "    " and resid 148  and name HA  ))
   (  segid "    " and resid 148  and name HG1%)
 ASSI { 1541}
   (( segid "    " and resid 64   and name HG2 ))
   (( segid "    " and resid 64   and name HG1 ))
      1.900     0.500     0.500 peak  1541 spectrum    1 weight  0.10000E+01 volume  0.39162E-02 ppm1      2.131 ppm2      2.491 CV     1
 ASSI { 1542}
   (( segid "    " and resid 148  and name HB  ))
   (  segid "    " and resid 148  and name HG2%)
      2.700     0.900     0.900 peak  1542 spectrum    1 weight  0.10000E+01 volume  0.35723E-02 ppm1      2.098 ppm2      0.904 CV     1
 ASSI { 1553}
   (  segid "    " and resid 114  and name HG2%)
   (  segid "    " and resid 112  and name HB% )
      3.100     1.200     1.200 peak  1553 spectrum    1 weight  0.10000E+01 volume  0.34959E-02 ppm1      0.914 ppm2      1.545 CV     1
 ASSI { 1559}
   (( segid "    " and resid 149  and name HA  ))
   (( segid "    " and resid 150  and name HA  ))
      3.000     3.000     3.000 peak  1559 spectrum    1 weight  0.10000E+01 volume  0.61704E-02 ppm1      4.855 ppm2      4.183 CV     1
 ASSI { 1569}
   (( segid "    " and resid 99   and name HA  ))
   (( segid "    " and resid 99   and name HB2 ))
      2.300     0.600     0.600 peak  1569 spectrum    1 weight  0.10000E+01 volume  0.43556E-02 ppm1      4.193 ppm2      1.319 CV     1
 ASSI { 1571}
   (( segid "    " and resid 150  and name HB1 ))
   (( segid "    " and resid 150  and name HA  ))
      2.900     1.100     1.100 peak  1571 spectrum    1 weight  0.10000E+01 volume  0.32476E-02 ppm1      1.595 ppm2      4.172 CV     1
 ASSI { 1572}
   (( segid "    " and resid 20   and name HB1 ))
   (( segid "    " and resid 20   and name HA  ))
      2.700     0.900     0.900 peak  1572 spectrum    1 weight  0.10000E+01 volume  0.40308E-02 ppm1      1.576 ppm2      4.303 CV     1
 ASSI { 1578}
   (  segid "    " and resid 74   and name HD2%)
   (  segid "    " and resid 132  and name HD1%)
      2.600     0.800     0.800 peak  1578 spectrum    1 weight  0.10000E+01 volume  0.33048E-02 ppm1      0.864 ppm2      0.461 CV     1
 ASSI {    1}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 37   and name HN  ))
      3.600     1.600     1.600 peak     1 spectrum    1 weight  0.10000E+01 volume  0.17348E-02 ppm1      8.270 ppm2      9.583 CV     1
 ASSI {    1}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 34   and name HN  ))
      3.400     3.400     2.600 peak     1 spectrum    1 weight  0.10000E+01 volume  0.19252E-02 ppm1      8.278 ppm2      8.541 CV     1
 ASSI {    5}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 36   and name HE3 ))
      3.600     1.600     1.600 peak     5 spectrum    1 weight  0.10000E+01 volume  0.17422E-02 ppm1      8.269 ppm2      7.169 CV     1
 ASSI {    7}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 12   and name HD2 ))
      3.700     1.700     1.700 peak     7 spectrum    1 weight  0.10000E+01 volume  0.19033E-02 ppm1      8.278 ppm2      3.665 CV     1
 ASSI {   10}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 11   and name HG2 ))
      3.500     1.500     1.500 peak    10 spectrum    1 weight  0.10000E+01 volume  0.18228E-02 ppm1      8.278 ppm2      2.348 CV     1
 OR {   10}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 11   and name HG1 ))
 ASSI {   13}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 36   and name HE3 ))
      3.900     1.900     1.900 peak    13 spectrum    1 weight  0.10000E+01 volume  0.18666E-02 ppm1      9.580 ppm2      7.202 CV     1
 ASSI {   14}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 38   and name HA  ))
      3.700     1.700     1.700 peak    14 spectrum    1 weight  0.10000E+01 volume  0.17861E-02 ppm1      9.579 ppm2      4.794 CV     1
 ASSI {   17}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 36   and name HB1 ))
      2.700     0.900     0.900 peak    17 spectrum    1 weight  0.10000E+01 volume  0.19544E-02 ppm1      9.581 ppm2      3.058 CV     1
 ASSI {   18}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 36   and name HB2 ))
      2.700     0.900     0.900 peak    18 spectrum    1 weight  0.10000E+01 volume  0.17788E-02 ppm1      9.580 ppm2      2.852 CV     1
 ASSI {   21}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 37   and name HG  ))
      3.900     1.900     1.900 peak    21 spectrum    1 weight  0.10000E+01 volume  0.18301E-02 ppm1      9.578 ppm2      1.485 CV     1
 ASSI {   22}
   (( segid "    " and resid 37   and name HN  ))
   (  segid "    " and resid 37   and name HD1%)
      4.000     2.000     2.000 peak    22 spectrum    1 weight  0.10000E+01 volume  0.18666E-02 ppm1      9.580 ppm2      0.972 CV     1
 ASSI {   24}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 37   and name HN  ))
      3.600     1.600     1.600 peak    24 spectrum    1 weight  0.10000E+01 volume  0.21375E-02 ppm1      8.981 ppm2      9.590 CV     1
 ASSI {   25}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 40   and name HN  ))
      3.600     3.600     2.400 peak    25 spectrum    1 weight  0.10000E+01 volume  0.22473E-02 ppm1      8.982 ppm2      8.697 CV     1
 ASSI {   27}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 39   and name HN  ))
      3.300     1.400     1.400 peak    27 spectrum    1 weight  0.10000E+01 volume  0.21741E-02 ppm1      8.982 ppm2      8.300 CV     1
 ASSI {   28}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 41   and name HN  ))
      3.500     1.600     1.600 peak    28 spectrum    1 weight  0.10000E+01 volume  0.23132E-02 ppm1      8.980 ppm2      7.536 CV     1
 ASSI {   35}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 46   and name HD1 ))
      3.100     1.200     1.200 peak    35 spectrum    1 weight  0.10000E+01 volume  0.23571E-02 ppm1      8.981 ppm2      2.800 CV     1
 ASSI {   38}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 37   and name HB1 ))
      3.700     1.700     1.700 peak    38 spectrum    1 weight  0.10000E+01 volume  0.20057E-02 ppm1      8.985 ppm2      1.914 CV     1
 ASSI {   39}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 37   and name HB2 ))
      4.100     2.100     1.900 peak    39 spectrum    1 weight  0.10000E+01 volume  0.19179E-02 ppm1      8.982 ppm2      1.714 CV     1
 ASSI {   40}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 37   and name HG  ))
      3.200     1.300     1.300 peak    40 spectrum    1 weight  0.10000E+01 volume  0.19471E-02 ppm1      8.983 ppm2      1.480 CV     1
 ASSI {   42}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 47   and name HN  ))
      3.500     1.500     1.500 peak    42 spectrum    1 weight  0.10000E+01 volume  0.18007E-02 ppm1      8.294 ppm2      9.006 CV     1
 ASSI {   43}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 40   and name HN  ))
      2.800     1.000     1.000 peak    43 spectrum    1 weight  0.10000E+01 volume  0.17348E-02 ppm1      8.296 ppm2      8.641 CV     1
 ASSI {   44}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 46   and name HA  ))
      2.700     0.900     0.900 peak    44 spectrum    1 weight  0.10000E+01 volume  0.17422E-02 ppm1      8.292 ppm2      5.918 CV     1
 ASSI {   47}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 38   and name HB1 ))
      3.500     1.600     1.600 peak    47 spectrum    1 weight  0.10000E+01 volume  0.19252E-02 ppm1      8.292 ppm2      2.580 CV     1
 OR {   47}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 38   and name HB2 ))
 ASSI {   50}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 45   and name HG  ))
      3.400     1.400     1.400 peak    50 spectrum    1 weight  0.10000E+01 volume  0.19471E-02 ppm1      8.301 ppm2      1.225 CV     1
 ASSI {   52}
   (( segid "    " and resid 39   and name HN  ))
   (  segid "    " and resid 45   and name HD2%)
      3.900     1.900     1.900 peak    52 spectrum    1 weight  0.10000E+01 volume  0.20643E-02 ppm1      8.302 ppm2      0.516 CV     1
 ASSI {   55}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 42   and name HN  ))
      3.000     1.100     1.100 peak    55 spectrum    1 weight  0.10000E+01 volume  0.19618E-02 ppm1      8.633 ppm2      7.073 CV     1
 ASSI {   56}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 42   and name HD21))
      3.100     1.200     1.200 peak    56 spectrum    1 weight  0.10000E+01 volume  0.23644E-02 ppm1      8.631 ppm2      6.549 CV     1
 ASSI {   57}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 46   and name HA  ))
      3.500     1.500     1.500 peak    57 spectrum    1 weight  0.10000E+01 volume  0.23132E-02 ppm1      8.637 ppm2      5.922 CV     1
 ASSI {   58}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 38   and name HA  ))
      3.200     1.300     1.300 peak    58 spectrum    1 weight  0.10000E+01 volume  0.17569E-02 ppm1      8.637 ppm2      4.735 CV     1
 ASSI {   60}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 41   and name HA1 ))
      4.100     2.100     1.900 peak    60 spectrum    1 weight  0.10000E+01 volume  0.21302E-02 ppm1      8.633 ppm2      4.137 CV     1
 ASSI {   61}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 41   and name HA2 ))
      3.800     1.800     1.800 peak    61 spectrum    1 weight  0.10000E+01 volume  0.19911E-02 ppm1      8.628 ppm2      3.605 CV     1
 ASSI {   62}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 39   and name HA  ))
      3.100     1.200     1.200 peak    62 spectrum    1 weight  0.10000E+01 volume  0.18666E-02 ppm1      8.634 ppm2      3.465 CV     1
 ASSI {   67}
   (( segid "    " and resid 40   and name HN  ))
   (  segid "    " and resid 40   and name HD2%)
      3.400     1.500     1.500 peak    67 spectrum    1 weight  0.10000E+01 volume  0.17129E-02 ppm1      8.636 ppm2      0.575 CV     1
 ASSI {   71}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 39   and name HN  ))
      3.000     1.100     1.100 peak    71 spectrum    1 weight  0.10000E+01 volume  0.20789E-02 ppm1      7.554 ppm2      8.244 CV     1
 ASSI {   72}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 42   and name HD22))
      3.600     1.600     1.600 peak    72 spectrum    1 weight  0.10000E+01 volume  0.20424E-02 ppm1      7.555 ppm2      7.824 CV     1
 ASSI {   74}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 38   and name HA  ))
      3.200     1.300     1.300 peak    74 spectrum    1 weight  0.10000E+01 volume  0.17202E-02 ppm1      7.559 ppm2      4.732 CV     1
 ASSI {   75}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 40   and name HA  ))
      3.000     1.100     1.100 peak    75 spectrum    1 weight  0.10000E+01 volume  0.16983E-02 ppm1      7.559 ppm2      4.597 CV     1
 ASSI {   79}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 42   and name HB1 ))
      3.600     1.600     1.600 peak    79 spectrum    1 weight  0.10000E+01 volume  0.22253E-02 ppm1      7.561 ppm2      3.323 CV     1
 ASSI {   80}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 40   and name HB1 ))
      3.600     1.600     1.600 peak    80 spectrum    1 weight  0.10000E+01 volume  0.18666E-02 ppm1      7.557 ppm2      1.814 CV     1
 ASSI {   81}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 37   and name HG  ))
      1.800     1.800     4.200 peak    81 spectrum    1 weight  0.10000E+01 volume  0.20862E-02 ppm1      7.567 ppm2      1.467 CV     1
 ASSI {   89}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 38   and name HA  ))
      3.400     1.500     1.500 peak    89 spectrum    1 weight  0.10000E+01 volume  0.17642E-02 ppm1      7.070 ppm2      4.730 CV     1
 ASSI {   90}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 40   and name HA  ))
      3.100     1.200     1.200 peak    90 spectrum    1 weight  0.10000E+01 volume  0.19765E-02 ppm1      7.070 ppm2      4.586 CV     1
 ASSI {   92}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 41   and name HA2 ))
      2.700     0.900     0.900 peak    92 spectrum    1 weight  0.10000E+01 volume  0.16983E-02 ppm1      7.068 ppm2      3.602 CV     1
 ASSI {   93}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 43   and name HA2 ))
      4.500     2.500     1.500 peak    93 spectrum    1 weight  0.10000E+01 volume  0.17642E-02 ppm1      7.068 ppm2      3.474 CV     1
 ASSI {   94}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 42   and name HB1 ))
      2.800     1.000     1.000 peak    94 spectrum    1 weight  0.10000E+01 volume  0.18812E-02 ppm1      7.070 ppm2      3.283 CV     1
 ASSI {   97}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 40   and name HB1 ))
      3.100     1.200     1.200 peak    97 spectrum    1 weight  0.10000E+01 volume  0.17422E-02 ppm1      7.068 ppm2      1.812 CV     1
 ASSI {   98}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 40   and name HB2 ))
      3.000     1.100     1.100 peak    98 spectrum    1 weight  0.10000E+01 volume  0.17934E-02 ppm1      7.069 ppm2      1.600 CV     1
 ASSI {   99}
   (( segid "    " and resid 42   and name HN  ))
   (  segid "    " and resid 45   and name HD2%)
      4.000     2.000     2.000 peak    99 spectrum    1 weight  0.10000E+01 volume  0.24522E-02 ppm1      7.067 ppm2      0.467 CV     1
 ASSI {  100}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 40   and name HN  ))
      3.900     1.900     1.900 peak   100 spectrum    1 weight  0.10000E+01 volume  0.22107E-02 ppm1      9.875 ppm2      8.630 CV     1
 ASSI {  101}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 45   and name HN  ))
      3.100     1.200     1.200 peak   101 spectrum    1 weight  0.10000E+01 volume  0.21009E-02 ppm1      9.872 ppm2      8.353 CV     1
 ASSI {  106}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 42   and name HA  ))
      3.400     1.400     1.400 peak   106 spectrum    1 weight  0.10000E+01 volume  0.17422E-02 ppm1      9.880 ppm2      4.866 CV     1
 ASSI {  108}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 43   and name HA1 ))
      3.100     1.200     1.200 peak   108 spectrum    1 weight  0.10000E+01 volume  0.14274E-02 ppm1      9.880 ppm2      4.046 CV     1
 ASSI {  110}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 43   and name HA2 ))
      2.600     0.900     0.900 peak   110 spectrum    1 weight  0.10000E+01 volume  0.13835E-02 ppm1      9.880 ppm2      3.472 CV     1
 ASSI {  111}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 42   and name HB1 ))
      3.700     1.700     1.700 peak   111 spectrum    1 weight  0.10000E+01 volume  0.21375E-02 ppm1      9.881 ppm2      3.270 CV     1
 ASSI {  112}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 38   and name HB1 ))
      2.700     0.900     0.900 peak   112 spectrum    1 weight  0.10000E+01 volume  0.24084E-02 ppm1      9.877 ppm2      2.568 CV     1
 OR {  112}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 38   and name HB2 ))
 ASSI {  113}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 44   and name HB1 ))
      3.800     1.800     1.800 peak   113 spectrum    1 weight  0.10000E+01 volume  0.21741E-02 ppm1      9.880 ppm2      1.956 CV     1
 ASSI {  116}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 40   and name HN  ))
      3.900     1.900     1.900 peak   116 spectrum    1 weight  0.10000E+01 volume  0.23571E-02 ppm1      7.660 ppm2      8.636 CV     1
 ASSI {  119}
   (( segid "    " and resid 44   and name HN  ))
   (  segid "    " and resid 120  and name HE% )
      4.800     2.900     1.200 peak   119 spectrum    1 weight  0.10000E+01 volume  0.19106E-02 ppm1      7.658 ppm2      6.687 CV     1
 ASSI {  120}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 42   and name HD21))
      2.800     1.000     1.000 peak   120 spectrum    1 weight  0.10000E+01 volume  0.22107E-02 ppm1      7.658 ppm2      6.489 CV     1
 ASSI {  121}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 42   and name HA  ))
      3.800     1.800     1.800 peak   121 spectrum    1 weight  0.10000E+01 volume  0.21302E-02 ppm1      7.652 ppm2      4.873 CV     1
 ASSI {  122}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 107  and name HA  ))
      2.800     1.000     1.000 peak   122 spectrum    1 weight  0.10000E+01 volume  0.20057E-02 ppm1      7.654 ppm2      4.703 CV     1
 ASSI {  124}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 43   and name HA1 ))
      3.000     1.100     1.100 peak   124 spectrum    1 weight  0.10000E+01 volume  0.20424E-02 ppm1      7.659 ppm2      4.160 CV     1
 ASSI {  125}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 42   and name HB2 ))
      3.500     1.600     1.600 peak   125 spectrum    1 weight  0.10000E+01 volume  0.21302E-02 ppm1      7.652 ppm2      2.767 CV     1
 ASSI {  128}
   (( segid "    " and resid 44   and name HN  ))
   (  segid "    " and resid 40   and name HD2%)
      4.200     2.200     1.800 peak   128 spectrum    1 weight  0.10000E+01 volume  0.21961E-02 ppm1      7.656 ppm2      0.601 CV     1
 ASSI {  129}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 40   and name HN  ))
      3.500     1.500     1.500 peak   129 spectrum    1 weight  0.10000E+01 volume  0.20862E-02 ppm1      8.357 ppm2      8.676 CV     1
 ASSI {  130}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 117  and name HN  ))
      3.300     1.300     1.300 peak   130 spectrum    1 weight  0.10000E+01 volume  0.21741E-02 ppm1      8.362 ppm2      8.156 CV     1
 ASSI {  133}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 45   and name HA  ))
      2.600     0.800     0.800 peak   133 spectrum    1 weight  0.10000E+01 volume  0.17129E-02 ppm1      8.355 ppm2      5.210 CV     1
 ASSI {  135}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 38   and name HB1 ))
      3.500     1.600     1.600 peak   135 spectrum    1 weight  0.10000E+01 volume  0.18301E-02 ppm1      8.362 ppm2      2.682 CV     1
 ASSI {  136}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 117  and name HB2 ))
      3.700     1.700     1.700 peak   136 spectrum    1 weight  0.10000E+01 volume  0.22473E-02 ppm1      8.356 ppm2      2.477 CV     1
 ASSI {  137}
   (( segid "    " and resid 45   and name HN  ))
   (  segid "    " and resid 45   and name HD2%)
      3.700     1.700     1.700 peak   137 spectrum    1 weight  0.10000E+01 volume  0.20276E-02 ppm1      8.355 ppm2      0.483 CV     1
 ASSI {  138}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 115  and name HN  ))
      2.700     0.900     0.900 peak   138 spectrum    1 weight  0.10000E+01 volume  0.18960E-02 ppm1      8.814 ppm2      9.297 CV     1
 ASSI {  139}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 47   and name HN  ))
      3.500     1.500     1.500 peak   139 spectrum    1 weight  0.10000E+01 volume  0.20497E-02 ppm1      8.810 ppm2      9.068 CV     1
 ASSI {  141}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 45   and name HN  ))
      3.200     1.300     1.300 peak   141 spectrum    1 weight  0.10000E+01 volume  0.19838E-02 ppm1      8.817 ppm2      8.362 CV     1
 ASSI {  142}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 117  and name HN  ))
      4.300     2.400     1.700 peak   142 spectrum    1 weight  0.10000E+01 volume  0.21667E-02 ppm1      8.816 ppm2      8.160 CV     1
 ASSI {  144}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 114  and name HA  ))
      3.300     1.400     1.400 peak   144 spectrum    1 weight  0.10000E+01 volume  0.21009E-02 ppm1      8.809 ppm2      5.610 CV     1
 ASSI {  145}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 116  and name HA  ))
      3.700     1.700     1.700 peak   145 spectrum    1 weight  0.10000E+01 volume  0.17348E-02 ppm1      8.815 ppm2      5.330 CV     1
 ASSI {  147}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 38   and name HA  ))
      3.800     1.800     1.800 peak   147 spectrum    1 weight  0.10000E+01 volume  0.22473E-02 ppm1      8.812 ppm2      4.767 CV     1
 ASSI {  148}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 115  and name HB  ))
      3.000     1.100     1.100 peak   148 spectrum    1 weight  0.10000E+01 volume  0.23058E-02 ppm1      8.810 ppm2      4.116 CV     1
 ASSI {  149}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 46   and name HD1 ))
      4.100     2.100     1.900 peak   149 spectrum    1 weight  0.10000E+01 volume  0.19984E-02 ppm1      8.820 ppm2      2.743 CV     1
 ASSI {  150}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 46   and name HB2 ))
      2.700     0.900     0.900 peak   150 spectrum    1 weight  0.10000E+01 volume  0.15592E-02 ppm1      8.816 ppm2      1.761 CV     1
 ASSI {  151}
   (( segid "    " and resid 46   and name HN  ))
   (  segid "    " and resid 115  and name HG2%)
      3.500     1.500     1.500 peak   151 spectrum    1 weight  0.10000E+01 volume  0.18447E-02 ppm1      8.814 ppm2      1.101 CV     1
 ASSI {  152}
   (( segid "    " and resid 46   and name HN  ))
   (  segid "    " and resid 45   and name HD1%)
      3.000     1.100     1.100 peak   152 spectrum    1 weight  0.10000E+01 volume  0.15079E-02 ppm1      8.816 ppm2      0.791 CV     1
 ASSI {  153}
   (( segid "    " and resid 46   and name HN  ))
   (  segid "    " and resid 45   and name HD2%)
      3.800     1.800     1.800 peak   153 spectrum    1 weight  0.10000E+01 volume  0.22912E-02 ppm1      8.824 ppm2      0.540 CV     1
 ASSI {  158}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 36   and name HE3 ))
      3.000     1.100     1.100 peak   158 spectrum    1 weight  0.10000E+01 volume  0.18812E-02 ppm1      9.014 ppm2      7.206 CV     1
 ASSI {  159}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 36   and name HZ3 ))
      3.500     1.600     1.600 peak   159 spectrum    1 weight  0.10000E+01 volume  0.21448E-02 ppm1      9.012 ppm2      6.976 CV     1
 ASSI {  160}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 47   and name HA  ))
      2.900     1.100     1.100 peak   160 spectrum    1 weight  0.10000E+01 volume  0.12883E-02 ppm1      9.011 ppm2      5.923 CV     1
 ASSI {  161}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 36   and name HB1 ))
      3.600     1.600     1.600 peak   161 spectrum    1 weight  0.10000E+01 volume  0.21888E-02 ppm1      9.018 ppm2      3.056 CV     1
 ASSI {  162}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 36   and name HB2 ))
      3.000     1.100     1.100 peak   162 spectrum    1 weight  0.10000E+01 volume  0.19911E-02 ppm1      9.007 ppm2      2.850 CV     1
 ASSI {  165}
   (( segid "    " and resid 47   and name HN  ))
   (  segid "    " and resid 37   and name HD2%)
      3.600     1.600     1.600 peak   165 spectrum    1 weight  0.10000E+01 volume  0.18960E-02 ppm1      9.008 ppm2      0.964 CV     1
 ASSI {  166}
   (( segid "    " and resid 47   and name HN  ))
   (  segid "    " and resid 39   and name HD1%)
      3.500     1.500     1.500 peak   166 spectrum    1 weight  0.10000E+01 volume  0.18520E-02 ppm1      9.014 ppm2      0.743 CV     1
 OR {  166}
   (( segid "    " and resid 47   and name HN  ))
   (  segid "    " and resid 39   and name HG2%)
 ASSI {  168}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 115  and name HN  ))
      4.000     2.000     2.000 peak   168 spectrum    1 weight  0.10000E+01 volume  0.20643E-02 ppm1      9.517 ppm2      9.303 CV     1
 ASSI {  170}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 47   and name HN  ))
      3.400     1.400     1.400 peak   170 spectrum    1 weight  0.10000E+01 volume  0.22985E-02 ppm1      9.521 ppm2      9.002 CV     1
 ASSI {  172}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 36   and name HE3 ))
      2.800     1.000     1.000 peak   172 spectrum    1 weight  0.10000E+01 volume  0.21375E-02 ppm1      9.522 ppm2      7.208 CV     1
 ASSI {  173}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 36   and name HZ3 ))
      3.200     1.300     1.300 peak   173 spectrum    1 weight  0.10000E+01 volume  0.19033E-02 ppm1      9.520 ppm2      6.999 CV     1
 OR {  173}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 36   and name HH2 ))
 ASSI {  176}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 114  and name HA  ))
      3.200     1.300     1.300 peak   176 spectrum    1 weight  0.10000E+01 volume  0.17275E-02 ppm1      9.521 ppm2      5.597 CV     1
 ASSI {  177}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 112  and name HA  ))
      3.200     1.300     1.300 peak   177 spectrum    1 weight  0.10000E+01 volume  0.22399E-02 ppm1      9.522 ppm2      5.169 CV     1
 ASSI {  178}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 48   and name HA  ))
      2.900     1.100     1.100 peak   178 spectrum    1 weight  0.10000E+01 volume  0.17861E-02 ppm1      9.520 ppm2      4.652 CV     1
 ASSI {  179}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 49   and name HA  ))
      3.300     3.300     2.700 peak   179 spectrum    1 weight  0.10000E+01 volume  0.24376E-02 ppm1      9.530 ppm2      3.938 CV     1
 ASSI {  181}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 36   and name HB1 ))
      3.100     3.100     2.900 peak   181 spectrum    1 weight  0.10000E+01 volume  0.26060E-02 ppm1      9.523 ppm2      3.003 CV     1
 ASSI {  182}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 113  and name HG1 ))
      3.500     3.500     2.500 peak   182 spectrum    1 weight  0.10000E+01 volume  0.23790E-02 ppm1      9.520 ppm2      2.662 CV     1
 ASSI {  183}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 113  and name HG2 ))
      3.000     3.000     3.000 peak   183 spectrum    1 weight  0.10000E+01 volume  0.22253E-02 ppm1      9.529 ppm2      2.536 CV     1
 ASSI {  184}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 113  and name HB1 ))
      3.100     1.200     1.200 peak   184 spectrum    1 weight  0.10000E+01 volume  0.21229E-02 ppm1      9.521 ppm2      2.003 CV     1
 ASSI {  185}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 47   and name HB1 ))
      3.600     1.700     1.700 peak   185 spectrum    1 weight  0.10000E+01 volume  0.18080E-02 ppm1      9.521 ppm2      1.767 CV     1
 ASSI {  187}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 47   and name HG2 ))
      2.800     1.000     1.000 peak   187 spectrum    1 weight  0.10000E+01 volume  0.15811E-02 ppm1      9.521 ppm2      1.362 CV     1
 ASSI {  191}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 47   and name HA  ))
      3.600     3.600     2.400 peak   191 spectrum    1 weight  0.10000E+01 volume  0.23205E-02 ppm1      9.114 ppm2      5.900 CV     1
 ASSI {  194}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 118  and name HB2 ))
      2.800     1.000     1.000 peak   194 spectrum    1 weight  0.10000E+01 volume  0.21302E-02 ppm1      9.116 ppm2      3.557 CV     1
 OR {  194}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 118  and name HB1 ))
 ASSI {  195}
   (( segid "    " and resid 49   and name HN  ))
   (  segid "    " and resid 49   and name HG2%)
      3.100     1.200     1.200 peak   195 spectrum    1 weight  0.10000E+01 volume  0.18739E-02 ppm1      9.109 ppm2      1.038 CV     1
 ASSI {  198}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 111  and name HN  ))
      3.400     1.400     1.400 peak   198 spectrum    1 weight  0.10000E+01 volume  0.19033E-02 ppm1      9.124 ppm2      9.035 CV     1
 ASSI {  201}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 111  and name HA  ))
      3.700     1.700     1.700 peak   201 spectrum    1 weight  0.10000E+01 volume  0.23278E-02 ppm1      9.124 ppm2      5.596 CV     1
 ASSI {  202}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 113  and name HA  ))
      4.000     2.000     2.000 peak   202 spectrum    1 weight  0.10000E+01 volume  0.23937E-02 ppm1      9.128 ppm2      5.486 CV     1
 ASSI {  206}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 110  and name HB1 ))
      3.600     3.600     2.400 peak   206 spectrum    1 weight  0.10000E+01 volume  0.24522E-02 ppm1      9.129 ppm2      2.169 CV     1
 ASSI {  207}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 113  and name HB1 ))
      4.100     2.100     1.900 peak   207 spectrum    1 weight  0.10000E+01 volume  0.22180E-02 ppm1      9.130 ppm2      1.985 CV     1
 ASSI {  208}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 50   and name HB2 ))
      3.000     1.100     1.100 peak   208 spectrum    1 weight  0.10000E+01 volume  0.16616E-02 ppm1      9.128 ppm2      1.449 CV     1
 ASSI {  209}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 47   and name HG1 ))
      3.900     1.900     1.900 peak   209 spectrum    1 weight  0.10000E+01 volume  0.20935E-02 ppm1      9.123 ppm2      1.330 CV     1
 OR {  209}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 47   and name HG2 ))
 ASSI {  210}
   (( segid "    " and resid 50   and name HN  ))
   (  segid "    " and resid 111  and name HG2%)
      4.300     2.300     1.700 peak   210 spectrum    1 weight  0.10000E+01 volume  0.21448E-02 ppm1      9.129 ppm2      1.175 CV     1
 ASSI {  211}
   (( segid "    " and resid 50   and name HN  ))
   (  segid "    " and resid 51   and name HG2%)
      3.900     3.900     2.100 peak   211 spectrum    1 weight  0.10000E+01 volume  0.17129E-02 ppm1      9.124 ppm2      0.947 CV     1
 ASSI {  212}
   (( segid "    " and resid 50   and name HN  ))
   (  segid "    " and resid 49   and name HG2%)
      3.800     1.800     1.800 peak   212 spectrum    1 weight  0.10000E+01 volume  0.21814E-02 ppm1      9.127 ppm2      1.033 CV     1
 ASSI {  214}
   (( segid "    " and resid 50   and name HN  ))
   (  segid "    " and resid 50   and name HD1%)
      3.800     1.800     1.800 peak   214 spectrum    1 weight  0.10000E+01 volume  0.19179E-02 ppm1      9.128 ppm2      0.830 CV     1
 ASSI {  215}
   (( segid "    " and resid 50   and name HN  ))
   (  segid "    " and resid 50   and name HD2%)
      3.600     1.600     1.600 peak   215 spectrum    1 weight  0.10000E+01 volume  0.20130E-02 ppm1      9.129 ppm2      0.730 CV     1
 ASSI {  219}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 18   and name HN  ))
      3.300     1.400     1.400 peak   219 spectrum    1 weight  0.10000E+01 volume  0.19398E-02 ppm1      8.152 ppm2      8.413 CV     1
 ASSI {  220}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 111  and name HA  ))
      3.400     1.500     1.500 peak   220 spectrum    1 weight  0.10000E+01 volume  0.20643E-02 ppm1      8.139 ppm2      5.591 CV     1
 ASSI {  221}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 112  and name HA  ))
      3.600     1.600     1.600 peak   221 spectrum    1 weight  0.10000E+01 volume  0.17788E-02 ppm1      8.144 ppm2      5.173 CV     1
 ASSI {  222}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 50   and name HA  ))
      3.400     1.500     1.500 peak   222 spectrum    1 weight  0.10000E+01 volume  0.16397E-02 ppm1      8.142 ppm2      4.474 CV     1
 ASSI {  223}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 49   and name HA  ))
      3.200     1.300     1.300 peak   223 spectrum    1 weight  0.10000E+01 volume  0.17129E-02 ppm1      8.139 ppm2      3.961 CV     1
 ASSI {  224}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 52   and name HD2 ))
      4.000     2.000     2.000 peak   224 spectrum    1 weight  0.10000E+01 volume  0.21448E-02 ppm1      8.146 ppm2      3.650 CV     1
 ASSI {  225}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 17   and name HD1 ))
      3.300     1.400     1.400 peak   225 spectrum    1 weight  0.10000E+01 volume  0.22180E-02 ppm1      8.138 ppm2      3.204 CV     1
 ASSI {  228}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 17   and name HG2 ))
      3.500     1.500     1.500 peak   228 spectrum    1 weight  0.10000E+01 volume  0.21009E-02 ppm1      8.147 ppm2      1.310 CV     1
 ASSI {  230}
   (( segid "    " and resid 51   and name HN  ))
   (  segid "    " and resid 50   and name HD2%)
      4.500     2.500     1.500 peak   230 spectrum    1 weight  0.10000E+01 volume  0.15811E-02 ppm1      8.142 ppm2      0.759 CV     1
 ASSI {  232}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 111  and name HN  ))
      3.600     1.600     1.600 peak   232 spectrum    1 weight  0.10000E+01 volume  0.20497E-02 ppm1      9.200 ppm2      9.038 CV     1
 ASSI {  234}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 107  and name HN  ))
      3.600     1.600     1.600 peak   234 spectrum    1 weight  0.10000E+01 volume  0.21375E-02 ppm1      9.210 ppm2      7.659 CV     1
 ASSI {  236}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 110  and name HA  ))
      2.700     0.900     0.900 peak   236 spectrum    1 weight  0.10000E+01 volume  0.18666E-02 ppm1      9.204 ppm2      4.610 CV     1
 ASSI {  237}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 52   and name HA  ))
      3.000     1.200     1.200 peak   237 spectrum    1 weight  0.10000E+01 volume  0.13030E-02 ppm1      9.207 ppm2      4.369 CV     1
 ASSI {  238}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 57   and name HB1 ))
      4.000     2.000     2.000 peak   238 spectrum    1 weight  0.10000E+01 volume  0.15152E-02 ppm1      9.204 ppm2      3.999 CV     1
 ASSI {  240}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 110  and name HG2 ))
      3.800     1.800     1.800 peak   240 spectrum    1 weight  0.10000E+01 volume  0.19544E-02 ppm1      9.206 ppm2      2.698 CV     1
 OR {  240}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 110  and name HG1 ))
 ASSI {  241}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 107  and name HB1 ))
      3.700     1.700     1.700 peak   241 spectrum    1 weight  0.10000E+01 volume  0.19033E-02 ppm1      9.202 ppm2      2.548 CV     1
 ASSI {  243}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 52   and name HB1 ))
      4.000     2.000     2.000 peak   243 spectrum    1 weight  0.10000E+01 volume  0.15152E-02 ppm1      9.206 ppm2      2.309 CV     1
 ASSI {  245}
   (( segid "    " and resid 53   and name HN  ))
   (  segid "    " and resid 49   and name HG2%)
      4.000     2.000     2.000 peak   245 spectrum    1 weight  0.10000E+01 volume  0.17569E-02 ppm1      9.204 ppm2      1.032 CV     1
 ASSI {  246}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 57   and name HN  ))
      3.200     1.300     1.300 peak   246 spectrum    1 weight  0.10000E+01 volume  0.22399E-02 ppm1      8.837 ppm2      7.823 CV     1
 ASSI {  251}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 56   and name HA1 ))
      3.000     1.200     1.200 peak   251 spectrum    1 weight  0.10000E+01 volume  0.24816E-02 ppm1      8.838 ppm2      4.171 CV     1
 ASSI {  252}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 56   and name HA2 ))
      3.200     1.200     1.200 peak   252 spectrum    1 weight  0.10000E+01 volume  0.22326E-02 ppm1      8.835 ppm2      3.748 CV     1
 ASSI {  256}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 108  and name HN  ))
      4.000     2.000     2.000 peak   256 spectrum    1 weight  0.10000E+01 volume  0.22766E-02 ppm1      7.816 ppm2      8.519 CV     1
 ASSI {  269}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 107  and name HB1 ))
      3.600     1.600     1.600 peak   269 spectrum    1 weight  0.10000E+01 volume  0.21448E-02 ppm1      7.816 ppm2      2.554 CV     1
 ASSI {  270}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 107  and name HB2 ))
      4.100     2.100     1.900 peak   270 spectrum    1 weight  0.10000E+01 volume  0.20497E-02 ppm1      7.814 ppm2      2.323 CV     1
 ASSI {  271}
   (( segid "    " and resid 57   and name HN  ))
   (  segid "    " and resid 108  and name HG1%)
      4.000     2.000     2.000 peak   271 spectrum    1 weight  0.10000E+01 volume  0.21888E-02 ppm1      7.812 ppm2      0.966 CV     1
 ASSI {  272}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 109  and name HN  ))
      4.100     2.100     1.900 peak   272 spectrum    1 weight  0.10000E+01 volume  0.22693E-02 ppm1      8.196 ppm2      8.866 CV     1
 ASSI {  275}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 59   and name HN  ))
      3.500     1.500     1.500 peak   275 spectrum    1 weight  0.10000E+01 volume  0.17788E-02 ppm1      8.204 ppm2      8.040 CV     1
 ASSI {  277}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 57   and name HN  ))
      3.400     1.400     1.400 peak   277 spectrum    1 weight  0.10000E+01 volume  0.24157E-02 ppm1      8.205 ppm2      7.806 CV     1
 ASSI {  285}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 57   and name HB1 ))
      2.800     1.000     1.000 peak   285 spectrum    1 weight  0.10000E+01 volume  0.14860E-02 ppm1      8.203 ppm2      4.040 CV     1
 OR {  285}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 57   and name HB2 ))
 ASSI {  288}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 108  and name HA  ))
      3.700     1.700     1.700 peak   288 spectrum    1 weight  0.10000E+01 volume  0.22546E-02 ppm1      8.199 ppm2      3.313 CV     1
 ASSI {  289}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 107  and name HB1 ))
      3.500     1.500     1.500 peak   289 spectrum    1 weight  0.10000E+01 volume  0.20643E-02 ppm1      8.205 ppm2      2.547 CV     1
 ASSI {  290}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 107  and name HB2 ))
      4.700     2.800     1.300 peak   290 spectrum    1 weight  0.10000E+01 volume  0.21375E-02 ppm1      8.208 ppm2      2.285 CV     1
 ASSI {  292}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 59   and name HG2 ))
      3.200     3.200     2.800 peak   292 spectrum    1 weight  0.10000E+01 volume  0.23132E-02 ppm1      8.207 ppm2      1.607 CV     1
 OR {  292}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 59   and name HB2 ))
 ASSI {  293}
   (( segid "    " and resid 58   and name HN  ))
   (  segid "    " and resid 108  and name HG1%)
      3.900     1.900     1.900 peak   293 spectrum    1 weight  0.10000E+01 volume  0.17422E-02 ppm1      8.202 ppm2      0.928 CV     1
 ASSI {  294}
   (( segid "    " and resid 58   and name HN  ))
   (  segid "    " and resid 108  and name HG2%)
      3.700     1.700     1.700 peak   294 spectrum    1 weight  0.10000E+01 volume  0.18812E-02 ppm1      8.213 ppm2      0.821 CV     1
 ASSI {  301}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 57   and name HB2 ))
      3.800     1.800     1.800 peak   301 spectrum    1 weight  0.10000E+01 volume  0.17861E-02 ppm1      8.021 ppm2      4.006 CV     1
 OR {  301}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 57   and name HB1 ))
 ASSI {  305}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 59   and name HD1 ))
      4.100     2.100     1.900 peak   305 spectrum    1 weight  0.10000E+01 volume  0.20716E-02 ppm1      8.026 ppm2      3.183 CV     1
 ASSI {  306}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 59   and name HD2 ))
      4.200     2.200     1.800 peak   306 spectrum    1 weight  0.10000E+01 volume  0.19544E-02 ppm1      8.034 ppm2      3.061 CV     1
 ASSI {  312}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 62   and name HN  ))
      3.500     1.500     1.500 peak   312 spectrum    1 weight  0.10000E+01 volume  0.18960E-02 ppm1      7.941 ppm2      8.249 CV     1
 ASSI {  314}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 64   and name HE22))
      4.300     2.300     1.700 peak   314 spectrum    1 weight  0.10000E+01 volume  0.19692E-02 ppm1      7.933 ppm2      7.294 CV     1
 ASSI {  315}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 64   and name HE21))
      4.000     2.000     2.000 peak   315 spectrum    1 weight  0.10000E+01 volume  0.21009E-02 ppm1      7.935 ppm2      6.343 CV     1
 ASSI {  316}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 149  and name HA  ))
      4.400     2.400     1.600 peak   316 spectrum    1 weight  0.10000E+01 volume  0.21302E-02 ppm1      7.933 ppm2      4.836 CV     1
 ASSI {  320}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 64   and name HG1 ))
      2.500     0.800     0.800 peak   320 spectrum    1 weight  0.10000E+01 volume  0.17202E-02 ppm1      7.938 ppm2      2.472 CV     1
 ASSI {  321}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 64   and name HG2 ))
      3.000     1.100     1.100 peak   321 spectrum    1 weight  0.10000E+01 volume  0.16178E-02 ppm1      7.939 ppm2      2.166 CV     1
 OR {  321}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 64   and name HB1 ))
 ASSI {  322}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 60   and name HG1 ))
      4.000     2.000     2.000 peak   322 spectrum    1 weight  0.10000E+01 volume  0.16543E-02 ppm1      7.940 ppm2      1.970 CV     1
 ASSI {  324}
   (( segid "    " and resid 61   and name HN  ))
   (  segid "    " and resid 61   and name HG1%)
      3.200     1.300     1.300 peak   324 spectrum    1 weight  0.10000E+01 volume  0.16616E-02 ppm1      7.940 ppm2      0.899 CV     1
 ASSI {  325}
   (( segid "    " and resid 61   and name HN  ))
   (  segid "    " and resid 61   and name HG2%)
      3.100     1.200     1.200 peak   325 spectrum    1 weight  0.10000E+01 volume  0.13982E-02 ppm1      7.939 ppm2      0.762 CV     1
 ASSI {  327}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 63   and name HN  ))
      3.600     1.600     1.600 peak   327 spectrum    1 weight  0.10000E+01 volume  0.18447E-02 ppm1      8.252 ppm2      8.739 CV     1
 ASSI {  333}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 104  and name HD1 ))
      3.400     3.400     2.600 peak   333 spectrum    1 weight  0.10000E+01 volume  0.21156E-02 ppm1      8.251 ppm2      3.705 CV     1
 ASSI {  335}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 62   and name HE2 ))
      4.000     2.000     2.000 peak   335 spectrum    1 weight  0.10000E+01 volume  0.23205E-02 ppm1      8.253 ppm2      3.063 CV     1
 ASSI {  337}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 62   and name HB1 ))
      3.900     1.900     1.900 peak   337 spectrum    1 weight  0.10000E+01 volume  0.13030E-02 ppm1      8.254 ppm2      1.816 CV     1
 ASSI {  338}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 62   and name HB2 ))
      2.900     1.100     1.100 peak   338 spectrum    1 weight  0.10000E+01 volume  0.13396E-02 ppm1      8.254 ppm2      1.698 CV     1
 ASSI {  340}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 62   and name HG2 ))
      3.700     1.700     1.700 peak   340 spectrum    1 weight  0.10000E+01 volume  0.19471E-02 ppm1      8.256 ppm2      1.324 CV     1
 ASSI {  343}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 90   and name HN  ))
      3.200     1.300     1.300 peak   343 spectrum    1 weight  0.10000E+01 volume  0.19544E-02 ppm1      8.736 ppm2      8.967 CV     1
 ASSI {  346}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 89   and name HA  ))
      3.600     1.600     1.600 peak   346 spectrum    1 weight  0.10000E+01 volume  0.23864E-02 ppm1      8.741 ppm2      4.647 CV     1
 ASSI {  351}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 62   and name HB1 ))
      3.200     1.300     1.300 peak   351 spectrum    1 weight  0.10000E+01 volume  0.18447E-02 ppm1      8.735 ppm2      1.819 CV     1
 ASSI {  352}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 62   and name HB2 ))
      3.700     1.700     1.700 peak   352 spectrum    1 weight  0.10000E+01 volume  0.18301E-02 ppm1      8.735 ppm2      1.694 CV     1
 ASSI {  353}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 90   and name HB2 ))
      3.900     1.900     1.900 peak   353 spectrum    1 weight  0.10000E+01 volume  0.18080E-02 ppm1      8.735 ppm2      1.438 CV     1
 ASSI {  354}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 62   and name HG2 ))
      4.000     2.000     2.000 peak   354 spectrum    1 weight  0.10000E+01 volume  0.18666E-02 ppm1      8.739 ppm2      1.335 CV     1
 ASSI {  355}
   (( segid "    " and resid 63   and name HN  ))
   (  segid "    " and resid 61   and name HG1%)
      3.500     1.500     1.500 peak   355 spectrum    1 weight  0.10000E+01 volume  0.22985E-02 ppm1      8.737 ppm2      0.968 CV     1
 ASSI {  356}
   (( segid "    " and resid 63   and name HN  ))
   (  segid "    " and resid 90   and name HD2%)
      3.800     1.800     1.800 peak   356 spectrum    1 weight  0.10000E+01 volume  0.18593E-02 ppm1      8.733 ppm2      0.733 CV     1
 ASSI {  358}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 90   and name HN  ))
      3.300     1.300     1.300 peak   358 spectrum    1 weight  0.10000E+01 volume  0.19033E-02 ppm1      8.056 ppm2      8.970 CV     1
 ASSI {  361}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 62   and name HN  ))
      3.300     1.300     1.300 peak   361 spectrum    1 weight  0.10000E+01 volume  0.21521E-02 ppm1      8.058 ppm2      8.288 CV     1
 ASSI {  362}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 64   and name HE22))
      3.700     1.700     1.700 peak   362 spectrum    1 weight  0.10000E+01 volume  0.20935E-02 ppm1      8.053 ppm2      7.314 CV     1
 ASSI {  364}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 62   and name HA  ))
      3.500     1.500     1.500 peak   364 spectrum    1 weight  0.10000E+01 volume  0.17129E-02 ppm1      8.061 ppm2      3.590 CV     1
 ASSI {  365}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 63   and name HA2 ))
      3.200     1.300     1.300 peak   365 spectrum    1 weight  0.10000E+01 volume  0.19838E-02 ppm1      8.059 ppm2      3.509 CV     1
 ASSI {  368}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 64   and name HB1 ))
      3.800     1.800     1.800 peak   368 spectrum    1 weight  0.10000E+01 volume  0.14055E-02 ppm1      8.060 ppm2      2.180 CV     1
 ASSI {  371}
   (( segid "    " and resid 64   and name HN  ))
   (  segid "    " and resid 66   and name HG1%)
      3.400     3.400     2.600 peak   371 spectrum    1 weight  0.10000E+01 volume  0.25401E-02 ppm1      8.057 ppm2      0.642 CV     1
 ASSI {  373}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 66   and name HN  ))
      3.600     1.600     1.600 peak   373 spectrum    1 weight  0.10000E+01 volume  0.19252E-02 ppm1      8.825 ppm2      9.128 CV     1
 ASSI {  375}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 64   and name HN  ))
      3.500     1.500     1.500 peak   375 spectrum    1 weight  0.10000E+01 volume  0.20424E-02 ppm1      8.827 ppm2      8.069 CV     1
 ASSI {  376}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 64   and name HE22))
      4.800     2.900     1.200 peak   376 spectrum    1 weight  0.10000E+01 volume  0.22034E-02 ppm1      8.832 ppm2      7.269 CV     1
 ASSI {  378}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 149  and name HA  ))
      3.400     1.500     1.500 peak   378 spectrum    1 weight  0.10000E+01 volume  0.19618E-02 ppm1      8.818 ppm2      4.837 CV     1
 ASSI {  380}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 65   and name HA  ))
      2.900     1.000     1.000 peak   380 spectrum    1 weight  0.10000E+01 volume  0.17202E-02 ppm1      8.825 ppm2      4.260 CV     1
 ASSI {  381}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 64   and name HG1 ))
      4.200     2.200     1.800 peak   381 spectrum    1 weight  0.10000E+01 volume  0.18301E-02 ppm1      8.822 ppm2      2.467 CV     1
 ASSI {  385}
   (( segid "    " and resid 65   and name HN  ))
   (  segid "    " and resid 147  and name HB% )
      3.500     3.500     2.500 peak   385 spectrum    1 weight  0.10000E+01 volume  0.22326E-02 ppm1      8.817 ppm2      1.127 CV     1
 ASSI {  387}
   (( segid "    " and resid 65   and name HN  ))
   (  segid "    " and resid 66   and name HG1%)
      3.100     1.200     1.200 peak   387 spectrum    1 weight  0.10000E+01 volume  0.20057E-02 ppm1      8.817 ppm2      0.671 CV     1
 ASSI {  388}
   (( segid "    " and resid 65   and name HN  ))
   (  segid "    " and resid 65   and name HG2%)
      3.600     1.700     1.700 peak   388 spectrum    1 weight  0.10000E+01 volume  0.19544E-02 ppm1      8.825 ppm2      0.469 CV     1
 ASSI {  389}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 68   and name HN  ))
      3.400     3.400     2.600 peak   389 spectrum    1 weight  0.10000E+01 volume  0.24010E-02 ppm1      9.128 ppm2      9.584 CV     1
 ASSI {  391}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 148  and name HN  ))
      3.300     1.300     1.300 peak   391 spectrum    1 weight  0.10000E+01 volume  0.21156E-02 ppm1      9.128 ppm2      8.719 CV     1
 ASSI {  395}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 66   and name HA  ))
      2.800     1.000     1.000 peak   395 spectrum    1 weight  0.10000E+01 volume  0.17202E-02 ppm1      9.130 ppm2      5.053 CV     1
 ASSI {  398}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 64   and name HA  ))
      3.700     3.700     2.300 peak   398 spectrum    1 weight  0.10000E+01 volume  0.20789E-02 ppm1      9.127 ppm2      4.445 CV     1
 ASSI {  400}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 66   and name HB  ))
      3.300     1.400     1.400 peak   400 spectrum    1 weight  0.10000E+01 volume  0.19765E-02 ppm1      9.125 ppm2      1.699 CV     1
 ASSI {  401}
   (( segid "    " and resid 66   and name HN  ))
   (  segid "    " and resid 103  and name HG1%)
      4.100     2.100     1.900 peak   401 spectrum    1 weight  0.10000E+01 volume  0.24742E-02 ppm1      9.133 ppm2      1.280 CV     1
 ASSI {  402}
   (( segid "    " and resid 66   and name HN  ))
   (  segid "    " and resid 87   and name HG1%)
      3.600     1.600     1.600 peak   402 spectrum    1 weight  0.10000E+01 volume  0.20203E-02 ppm1      9.125 ppm2      0.969 CV     1
 ASSI {  406}
   (( segid "    " and resid 66   and name HN  ))
   (  segid "    " and resid 66   and name HG2%)
      2.800     1.000     1.000 peak   406 spectrum    1 weight  0.10000E+01 volume  0.18739E-02 ppm1      9.128 ppm2      0.079 CV     1
 ASSI {  408}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 68   and name HN  ))
      3.300     1.400     1.400 peak   408 spectrum    1 weight  0.10000E+01 volume  0.19398E-02 ppm1      7.826 ppm2      9.586 CV     1
 ASSI {  409}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 66   and name HN  ))
      3.500     1.500     1.500 peak   409 spectrum    1 weight  0.10000E+01 volume  0.22107E-02 ppm1      7.836 ppm2      9.138 CV     1
 ASSI {  410}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 145  and name HN  ))
      3.300     1.400     1.400 peak   410 spectrum    1 weight  0.10000E+01 volume  0.20350E-02 ppm1      7.825 ppm2      8.937 CV     1
 ASSI {  411}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 148  and name HN  ))
      4.000     2.000     2.000 peak   411 spectrum    1 weight  0.10000E+01 volume  0.21375E-02 ppm1      7.825 ppm2      8.712 CV     1
 ASSI {  418}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 146  and name HA  ))
      3.500     1.500     1.500 peak   418 spectrum    1 weight  0.10000E+01 volume  0.20935E-02 ppm1      7.818 ppm2      4.513 CV     1
 ASSI {  424}
   (( segid "    " and resid 67   and name HN  ))
   (  segid "    " and resid 66   and name HG2%)
      3.600     1.600     1.600 peak   424 spectrum    1 weight  0.10000E+01 volume  0.18739E-02 ppm1      7.828 ppm2      0.002 CV     1
 ASSI {  430}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 146  and name HN  ))
      3.300     3.300     2.700 peak   430 spectrum    1 weight  0.10000E+01 volume  0.25621E-02 ppm1      9.584 ppm2      7.368 CV     1
 ASSI {  431}
   (( segid "    " and resid 68   and name HN  ))
   (  segid "    " and resid 88   and name HE% )
      3.500     1.600     1.600 peak   431 spectrum    1 weight  0.10000E+01 volume  0.23644E-02 ppm1      9.583 ppm2      7.140 CV     1
 ASSI {  432}
   (( segid "    " and resid 68   and name HN  ))
   (  segid "    " and resid 88   and name HD% )
      3.100     1.200     1.200 peak   432 spectrum    1 weight  0.10000E+01 volume  0.23790E-02 ppm1      9.578 ppm2      6.921 CV     1
 ASSI {  436}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 66   and name HA  ))
      3.600     3.600     2.400 peak   436 spectrum    1 weight  0.10000E+01 volume  0.21521E-02 ppm1      9.576 ppm2      5.116 CV     1
 ASSI {  437}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 85   and name HA  ))
      3.700     1.700     1.700 peak   437 spectrum    1 weight  0.10000E+01 volume  0.21229E-02 ppm1      9.585 ppm2      4.393 CV     1
 ASSI {  438}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 67   and name HB  ))
      3.200     1.300     1.300 peak   438 spectrum    1 weight  0.10000E+01 volume  0.21156E-02 ppm1      9.579 ppm2      3.972 CV     1
 ASSI {  439}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 68   and name HB  ))
      3.300     1.300     1.300 peak   439 spectrum    1 weight  0.10000E+01 volume  0.19544E-02 ppm1      9.579 ppm2      2.198 CV     1
 ASSI {  441}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 86   and name HG  ))
      3.600     1.700     1.700 peak   441 spectrum    1 weight  0.10000E+01 volume  0.22985E-02 ppm1      9.577 ppm2      1.550 CV     1
 ASSI {  442}
   (( segid "    " and resid 68   and name HN  ))
   (  segid "    " and resid 68   and name HG1%)
      3.200     1.300     1.300 peak   442 spectrum    1 weight  0.10000E+01 volume  0.15226E-02 ppm1      9.579 ppm2      1.065 CV     1
 ASSI {  444}
   (( segid "    " and resid 68   and name HN  ))
   (  segid "    " and resid 66   and name HG2%)
      3.100     1.200     1.200 peak   444 spectrum    1 weight  0.10000E+01 volume  0.22326E-02 ppm1      9.583 ppm2      0.008 CV     1
 ASSI {  445}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 68   and name HN  ))
      3.300     1.300     1.300 peak   445 spectrum    1 weight  0.10000E+01 volume  0.23058E-02 ppm1      8.729 ppm2      9.583 CV     1
 ASSI {  449}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 69   and name HA  ))
      2.900     1.000     1.000 peak   449 spectrum    1 weight  0.10000E+01 volume  0.17715E-02 ppm1      8.725 ppm2      5.378 CV     1
 ASSI {  450}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 69   and name HB1 ))
      2.700     0.900     0.900 peak   450 spectrum    1 weight  0.10000E+01 volume  0.16983E-02 ppm1      8.728 ppm2      3.175 CV     1
 ASSI {  451}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 69   and name HB2 ))
      3.400     1.400     1.400 peak   451 spectrum    1 weight  0.10000E+01 volume  0.17275E-02 ppm1      8.727 ppm2      3.086 CV     1
 ASSI {  454}
   (( segid "    " and resid 69   and name HN  ))
   (  segid "    " and resid 143  and name HG2%)
      3.600     1.600     1.600 peak   454 spectrum    1 weight  0.10000E+01 volume  0.17496E-02 ppm1      8.726 ppm2      1.057 CV     1
 ASSI {  455}
   (( segid "    " and resid 69   and name HN  ))
   (  segid "    " and resid 68   and name HG2%)
      3.500     1.500     1.500 peak   455 spectrum    1 weight  0.10000E+01 volume  0.17569E-02 ppm1      8.727 ppm2      0.941 CV     1
 ASSI {  456}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 86   and name HN  ))
      3.800     1.800     1.800 peak   456 spectrum    1 weight  0.10000E+01 volume  0.21521E-02 ppm1      9.005 ppm2      8.826 CV     1
 ASSI {  457}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 69   and name HN  ))
      3.500     1.500     1.500 peak   457 spectrum    1 weight  0.10000E+01 volume  0.21229E-02 ppm1      9.000 ppm2      8.730 CV     1
 ASSI {  458}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 69   and name HD2 ))
      2.900     1.100     1.100 peak   458 spectrum    1 weight  0.10000E+01 volume  0.19252E-02 ppm1      9.004 ppm2      6.910 CV     1
 ASSI {  459}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 68   and name HA  ))
      3.700     3.700     2.300 peak   459 spectrum    1 weight  0.10000E+01 volume  0.22399E-02 ppm1      9.015 ppm2      5.617 CV     1
 ASSI {  460}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 69   and name HA  ))
      2.900     1.000     1.000 peak   460 spectrum    1 weight  0.10000E+01 volume  0.15152E-02 ppm1      9.003 ppm2      5.373 CV     1
 ASSI {  461}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 69   and name HB1 ))
      3.500     1.600     1.600 peak   461 spectrum    1 weight  0.10000E+01 volume  0.22473E-02 ppm1      9.004 ppm2      3.168 CV     1
 ASSI {  462}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 69   and name HB2 ))
      3.700     1.700     1.700 peak   462 spectrum    1 weight  0.10000E+01 volume  0.21594E-02 ppm1      9.001 ppm2      3.081 CV     1
 ASSI {  463}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 82   and name HG2 ))
      3.500     3.500     2.500 peak   463 spectrum    1 weight  0.10000E+01 volume  0.19838E-02 ppm1      8.999 ppm2      2.073 CV     1
 ASSI {  464}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 83   and name HB2 ))
      4.000     2.000     2.000 peak   464 spectrum    1 weight  0.10000E+01 volume  0.16837E-02 ppm1      8.998 ppm2      1.884 CV     1
 ASSI {  465}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 70   and name HG  ))
      3.400     1.400     1.400 peak   465 spectrum    1 weight  0.10000E+01 volume  0.22620E-02 ppm1      8.997 ppm2      1.458 CV     1
 ASSI {  466}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 70   and name HB2 ))
      3.600     1.600     1.600 peak   466 spectrum    1 weight  0.10000E+01 volume  0.17642E-02 ppm1      8.997 ppm2      1.223 CV     1
 ASSI {  467}
   (( segid "    " and resid 70   and name HN  ))
   (  segid "    " and resid 70   and name HD1%)
      4.000     2.000     2.000 peak   467 spectrum    1 weight  0.10000E+01 volume  0.20057E-02 ppm1      8.998 ppm2      0.932 CV     1
 ASSI {  469}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 71   and name HE22))
      3.200     3.200     2.800 peak   469 spectrum    1 weight  0.10000E+01 volume  0.25181E-02 ppm1      9.065 ppm2      6.655 CV     1
 ASSI {  471}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 72   and name HA  ))
      3.000     3.000     3.000 peak   471 spectrum    1 weight  0.10000E+01 volume  0.21814E-02 ppm1      9.060 ppm2      4.899 CV     1
 ASSI {  472}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 71   and name HG1 ))
      2.600     0.900     0.900 peak   472 spectrum    1 weight  0.10000E+01 volume  0.21082E-02 ppm1      9.060 ppm2      2.306 CV     1
 ASSI {  473}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 71   and name HB1 ))
      3.700     1.700     1.700 peak   473 spectrum    1 weight  0.10000E+01 volume  0.16470E-02 ppm1      9.065 ppm2      2.176 CV     1
 ASSI {  475}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 141  and name HB2 ))
      4.900     3.100     1.100 peak   475 spectrum    1 weight  0.10000E+01 volume  0.18812E-02 ppm1      9.062 ppm2      1.933 CV     1
 ASSI {  476}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 70   and name HG  ))
      2.600     0.800     0.800 peak   476 spectrum    1 weight  0.10000E+01 volume  0.19398E-02 ppm1      9.061 ppm2      1.470 CV     1
 ASSI {  477}
   (( segid "    " and resid 71   and name HN  ))
   (  segid "    " and resid 140  and name HD1%)
      3.700     1.700     1.700 peak   477 spectrum    1 weight  0.10000E+01 volume  0.15519E-02 ppm1      9.065 ppm2      0.929 CV     1
 ASSI {  480}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 81   and name HE21))
      3.700     1.700     1.700 peak   480 spectrum    1 weight  0.10000E+01 volume  0.22253E-02 ppm1      9.113 ppm2      7.681 CV     1
 ASSI {  484}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 79   and name HD1 ))
      2.700     0.900     0.900 peak   484 spectrum    1 weight  0.10000E+01 volume  0.24449E-02 ppm1      9.119 ppm2      3.232 CV     1
 ASSI {  485}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 71   and name HG1 ))
      3.900     1.900     1.900 peak   485 spectrum    1 weight  0.10000E+01 volume  0.20276E-02 ppm1      9.122 ppm2      2.310 CV     1
 ASSI {  486}
   (( segid "    " and resid 72   and name HN  ))
   (  segid "    " and resid 72   and name HG2%)
      3.500     1.600     1.600 peak   486 spectrum    1 weight  0.10000E+01 volume  0.18666E-02 ppm1      9.115 ppm2      1.163 CV     1
 ASSI {  487}
   (( segid "    " and resid 72   and name HN  ))
   (  segid "    " and resid 140  and name HD1%)
      4.100     2.100     1.900 peak   487 spectrum    1 weight  0.10000E+01 volume  0.20203E-02 ppm1      9.114 ppm2      0.937 CV     1
 ASSI {  488}
   (( segid "    " and resid 72   and name HN  ))
   (  segid "    " and resid 70   and name HD2%)
      3.300     1.400     1.400 peak   488 spectrum    1 weight  0.10000E+01 volume  0.19692E-02 ppm1      9.118 ppm2      0.811 CV     1
 ASSI {  490}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 74   and name HN  ))
      3.400     1.400     1.400 peak   490 spectrum    1 weight  0.10000E+01 volume  0.20130E-02 ppm1      9.169 ppm2      8.652 CV     1
 ASSI {  491}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 79   and name HE  ))
      3.200     1.300     1.300 peak   491 spectrum    1 weight  0.10000E+01 volume  0.23425E-02 ppm1      9.180 ppm2      7.246 CV     1
 ASSI {  494}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 72   and name HB  ))
      3.400     1.500     1.500 peak   494 spectrum    1 weight  0.10000E+01 volume  0.19618E-02 ppm1      9.170 ppm2      4.011 CV     1
 ASSI {  497}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 139  and name HB2 ))
      3.500     1.500     1.500 peak   497 spectrum    1 weight  0.10000E+01 volume  0.19838E-02 ppm1      9.172 ppm2      2.678 CV     1
 ASSI {  499}
   (( segid "    " and resid 73   and name HN  ))
   (  segid "    " and resid 140  and name HD1%)
      4.400     2.500     1.600 peak   499 spectrum    1 weight  0.10000E+01 volume  0.17056E-02 ppm1      9.175 ppm2      0.925 CV     1
 ASSI {  500}
   (( segid "    " and resid 73   and name HN  ))
   (  segid "    " and resid 74   and name HD2%)
      3.400     1.400     1.400 peak   500 spectrum    1 weight  0.10000E+01 volume  0.18080E-02 ppm1      9.171 ppm2      0.831 CV     1
 ASSI {  501}
   (( segid "    " and resid 73   and name HN  ))
   (  segid "    " and resid 140  and name HD2%)
      3.600     1.700     1.700 peak   501 spectrum    1 weight  0.10000E+01 volume  0.24742E-02 ppm1      9.175 ppm2      0.707 CV     1
 ASSI {  504}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 80   and name HN  ))
      3.700     1.700     1.700 peak   504 spectrum    1 weight  0.10000E+01 volume  0.17129E-02 ppm1      8.640 ppm2      8.915 CV     1
 ASSI {  505}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 77   and name HN  ))
      3.300     1.400     1.400 peak   505 spectrum    1 weight  0.10000E+01 volume  0.20057E-02 ppm1      8.643 ppm2      8.194 CV     1
 ASSI {  506}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 78   and name HN  ))
      2.700     0.900     0.900 peak   506 spectrum    1 weight  0.10000E+01 volume  0.18886E-02 ppm1      8.642 ppm2      7.770 CV     1
 ASSI {  508}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 74   and name HA  ))
      2.800     1.000     1.000 peak   508 spectrum    1 weight  0.10000E+01 volume  0.17934E-02 ppm1      8.640 ppm2      4.715 CV     1
 ASSI {  509}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 78   and name HA  ))
      3.300     1.300     1.300 peak   509 spectrum    1 weight  0.10000E+01 volume  0.17056E-02 ppm1      8.639 ppm2      4.051 CV     1
 ASSI {  510}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 75   and name HA  ))
      3.300     3.300     2.700 peak   510 spectrum    1 weight  0.10000E+01 volume  0.23205E-02 ppm1      8.644 ppm2      3.925 CV     1
 ASSI {  513}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 74   and name HB1 ))
      3.700     1.700     1.700 peak   513 spectrum    1 weight  0.10000E+01 volume  0.15373E-02 ppm1      8.639 ppm2      1.940 CV     1
 ASSI {  514}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 79   and name HG1 ))
      4.200     2.200     1.800 peak   514 spectrum    1 weight  0.10000E+01 volume  0.14128E-02 ppm1      8.640 ppm2      1.714 CV     1
 ASSI {  515}
   (( segid "    " and resid 74   and name HN  ))
   (  segid "    " and resid 78   and name HG2%)
      3.600     1.600     1.600 peak   515 spectrum    1 weight  0.10000E+01 volume  0.19692E-02 ppm1      8.643 ppm2      1.221 CV     1
 ASSI {  521}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 76   and name HN  ))
      2.700     0.900     0.900 peak   521 spectrum    1 weight  0.10000E+01 volume  0.17715E-02 ppm1      8.659 ppm2      7.724 CV     1
 ASSI {  522}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 138  and name HA  ))
      2.900     1.100     1.100 peak   522 spectrum    1 weight  0.10000E+01 volume  0.19325E-02 ppm1      8.659 ppm2      5.229 CV     1
 ASSI {  525}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 75   and name HG2 ))
      3.000     1.100     1.100 peak   525 spectrum    1 weight  0.10000E+01 volume  0.17202E-02 ppm1      8.658 ppm2      2.214 CV     1
 ASSI {  526}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 74   and name HB2 ))
      3.800     1.800     1.800 peak   526 spectrum    1 weight  0.10000E+01 volume  0.13542E-02 ppm1      8.660 ppm2      1.930 CV     1
 ASSI {  527}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 75   and name HB1 ))
      2.800     1.000     1.000 peak   527 spectrum    1 weight  0.10000E+01 volume  0.14274E-02 ppm1      8.661 ppm2      2.010 CV     1
 ASSI {  532}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 77   and name HN  ))
      2.700     0.900     0.900 peak   532 spectrum    1 weight  0.10000E+01 volume  0.17642E-02 ppm1      7.723 ppm2      8.204 CV     1
 ASSI {  535}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 74   and name HA  ))
      3.400     1.500     1.500 peak   535 spectrum    1 weight  0.10000E+01 volume  0.17715E-02 ppm1      7.721 ppm2      4.720 CV     1
 ASSI {  536}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 76   and name HA  ))
      3.000     1.100     1.100 peak   536 spectrum    1 weight  0.10000E+01 volume  0.18080E-02 ppm1      7.722 ppm2      4.561 CV     1
 ASSI {  537}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 77   and name HA1 ))
      4.000     2.000     2.000 peak   537 spectrum    1 weight  0.10000E+01 volume  0.24596E-02 ppm1      7.714 ppm2      4.445 CV     1
 ASSI {  538}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 78   and name HB  ))
      3.800     1.800     1.800 peak   538 spectrum    1 weight  0.10000E+01 volume  0.26499E-02 ppm1      7.716 ppm2      4.096 CV     1
 ASSI {  539}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 75   and name HA  ))
      3.000     1.100     1.100 peak   539 spectrum    1 weight  0.10000E+01 volume  0.19471E-02 ppm1      7.720 ppm2      3.980 CV     1
 ASSI {  540}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 77   and name HA2 ))
      3.900     1.900     1.900 peak   540 spectrum    1 weight  0.10000E+01 volume  0.23132E-02 ppm1      7.714 ppm2      3.733 CV     1
 ASSI {  541}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 76   and name HB1 ))
      3.300     1.400     1.400 peak   541 spectrum    1 weight  0.10000E+01 volume  0.20497E-02 ppm1      7.722 ppm2      3.311 CV     1
 ASSI {  542}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 76   and name HB2 ))
      2.800     1.000     1.000 peak   542 spectrum    1 weight  0.10000E+01 volume  0.18886E-02 ppm1      7.724 ppm2      2.872 CV     1
 ASSI {  543}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 75   and name HG1 ))
      2.700     0.900     0.900 peak   543 spectrum    1 weight  0.10000E+01 volume  0.22693E-02 ppm1      7.710 ppm2      2.200 CV     1
 ASSI {  544}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 74   and name HG  ))
      3.900     1.900     1.900 peak   544 spectrum    1 weight  0.10000E+01 volume  0.22620E-02 ppm1      7.717 ppm2      1.679 CV     1
 ASSI {  545}
   (( segid "    " and resid 76   and name HN  ))
   (  segid "    " and resid 80   and name HG1%)
      4.200     2.200     1.800 peak   545 spectrum    1 weight  0.10000E+01 volume  0.24742E-02 ppm1      7.721 ppm2      0.934 CV     1
 ASSI {  546}
   (( segid "    " and resid 76   and name HN  ))
   (  segid "    " and resid 74   and name HD2%)
      3.800     1.800     1.800 peak   546 spectrum    1 weight  0.10000E+01 volume  0.25401E-02 ppm1      7.716 ppm2      0.814 CV     1
 ASSI {  554}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 74   and name HA  ))
      3.400     1.500     1.500 peak   554 spectrum    1 weight  0.10000E+01 volume  0.18447E-02 ppm1      8.198 ppm2      4.720 CV     1
 ASSI {  557}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 78   and name HB  ))
      4.000     2.000     2.000 peak   557 spectrum    1 weight  0.10000E+01 volume  0.18301E-02 ppm1      8.198 ppm2      4.049 CV     1
 OR {  557}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 78   and name HA  ))
 ASSI {  558}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 75   and name HA  ))
      3.000     1.200     1.200 peak   558 spectrum    1 weight  0.10000E+01 volume  0.17861E-02 ppm1      8.197 ppm2      3.979 CV     1
 ASSI {  560}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 76   and name HB2 ))
      3.100     1.200     1.200 peak   560 spectrum    1 weight  0.10000E+01 volume  0.20130E-02 ppm1      8.197 ppm2      2.848 CV     1
 ASSI {  561}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 74   and name HB2 ))
      3.300     1.300     1.300 peak   561 spectrum    1 weight  0.10000E+01 volume  0.17496E-02 ppm1      8.195 ppm2      1.965 CV     1
 ASSI {  563}
   (( segid "    " and resid 77   and name HN  ))
   (  segid "    " and resid 80   and name HG1%)
      4.200     2.200     1.800 peak   563 spectrum    1 weight  0.10000E+01 volume  0.22399E-02 ppm1      8.200 ppm2      0.982 CV     1
 ASSI {  575}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 76   and name HB1 ))
      3.300     1.400     1.400 peak   575 spectrum    1 weight  0.10000E+01 volume  0.22107E-02 ppm1      7.771 ppm2      3.342 CV     1
 ASSI {  577}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 79   and name HG1 ))
      3.800     3.800     2.200 peak   577 spectrum    1 weight  0.10000E+01 volume  0.18228E-02 ppm1      7.772 ppm2      1.702 CV     1
 ASSI {  580}
   (( segid "    " and resid 81   and name HN  ))
   (  segid "    " and resid 80   and name HG2%)
      3.100     1.200     1.200 peak   580 spectrum    1 weight  0.10000E+01 volume  0.16910E-02 ppm1      7.773 ppm2      0.838 CV     1
 ASSI {  583}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 74   and name HN  ))
      3.100     1.200     1.200 peak   583 spectrum    1 weight  0.10000E+01 volume  0.21082E-02 ppm1      8.931 ppm2      8.671 CV     1
 ASSI {  584}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 78   and name HN  ))
      3.400     1.400     1.400 peak   584 spectrum    1 weight  0.10000E+01 volume  0.19325E-02 ppm1      8.934 ppm2      7.779 CV     1
 ASSI {  585}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 73   and name HA  ))
      3.100     1.200     1.200 peak   585 spectrum    1 weight  0.10000E+01 volume  0.23571E-02 ppm1      8.935 ppm2      5.522 CV     1
 ASSI {  588}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 79   and name HD1 ))
      4.100     2.100     1.900 peak   588 spectrum    1 weight  0.10000E+01 volume  0.22473E-02 ppm1      8.930 ppm2      3.227 CV     1
 ASSI {  589}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 79   and name HB1 ))
      4.000     2.000     2.000 peak   589 spectrum    1 weight  0.10000E+01 volume  0.13762E-02 ppm1      8.932 ppm2      1.875 CV     1
 ASSI {  590}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 79   and name HG1 ))
      2.800     1.000     1.000 peak   590 spectrum    1 weight  0.10000E+01 volume  0.16764E-02 ppm1      8.929 ppm2      1.689 CV     1
 ASSI {  595}
   (( segid "    " and resid 79   and name HN  ))
   (  segid "    " and resid 80   and name HG1%)
      3.300     1.400     1.400 peak   595 spectrum    1 weight  0.10000E+01 volume  0.24962E-02 ppm1      8.926 ppm2      1.006 CV     1
 ASSI {  597}
   (( segid "    " and resid 79   and name HN  ))
   (  segid "    " and resid 80   and name HG2%)
      4.000     2.000     2.000 peak   597 spectrum    1 weight  0.10000E+01 volume  0.24084E-02 ppm1      8.920 ppm2      0.760 CV     1
 ASSI {  601}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 81   and name HE21))
      3.400     1.500     1.500 peak   601 spectrum    1 weight  0.10000E+01 volume  0.23571E-02 ppm1      8.903 ppm2      7.628 CV     1
 ASSI {  604}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 72   and name HA  ))
      3.300     3.300     2.700 peak   604 spectrum    1 weight  0.10000E+01 volume  0.24157E-02 ppm1      8.902 ppm2      4.880 CV     1
 ASSI {  607}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 72   and name HB  ))
      3.600     1.600     1.600 peak   607 spectrum    1 weight  0.10000E+01 volume  0.19692E-02 ppm1      8.905 ppm2      4.017 CV     1
 ASSI {  608}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 73   and name HB1 ))
      4.300     2.300     1.700 peak   608 spectrum    1 weight  0.10000E+01 volume  0.19033E-02 ppm1      8.903 ppm2      3.714 CV     1
 OR {  608}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 73   and name HB2 ))
 ASSI {  610}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 79   and name HD2 ))
      1.800     1.800     4.200 peak   610 spectrum    1 weight  0.10000E+01 volume  0.20716E-02 ppm1      8.902 ppm2      3.231 CV     1
 ASSI {  612}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 79   and name HB1 ))
      3.100     1.200     1.200 peak   612 spectrum    1 weight  0.10000E+01 volume  0.16983E-02 ppm1      8.905 ppm2      1.873 CV     1
 ASSI {  613}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 79   and name HG2 ))
      3.700     1.800     1.800 peak   613 spectrum    1 weight  0.10000E+01 volume  0.17642E-02 ppm1      8.905 ppm2      1.676 CV     1
 ASSI {  614}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 81   and name HB1 ))
      3.800     1.800     1.800 peak   614 spectrum    1 weight  0.10000E+01 volume  0.24084E-02 ppm1      8.902 ppm2      2.051 CV     1
 ASSI {  615}
   (( segid "    " and resid 80   and name HN  ))
   (  segid "    " and resid 80   and name HG1%)
      2.900     1.100     1.100 peak   615 spectrum    1 weight  0.10000E+01 volume  0.22326E-02 ppm1      8.896 ppm2      1.010 CV     1
 ASSI {  616}
   (( segid "    " and resid 80   and name HN  ))
   (  segid "    " and resid 74   and name HD2%)
      3.400     1.400     1.400 peak   616 spectrum    1 weight  0.10000E+01 volume  0.14787E-02 ppm1      8.901 ppm2      0.873 CV     1
 ASSI {  622}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 72   and name HA  ))
      3.600     1.600     1.600 peak   622 spectrum    1 weight  0.10000E+01 volume  0.22399E-02 ppm1      7.782 ppm2      4.888 CV     1
 ASSI {  624}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 80   and name HA  ))
      3.200     1.300     1.300 peak   624 spectrum    1 weight  0.10000E+01 volume  0.16178E-02 ppm1      7.775 ppm2      4.378 CV     1
 ASSI {  626}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 77   and name HA2 ))
      3.000     1.100     1.100 peak   626 spectrum    1 weight  0.10000E+01 volume  0.23058E-02 ppm1      7.769 ppm2      3.749 CV     1
 ASSI {  627}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 81   and name HG1 ))
      3.700     1.700     1.700 peak   627 spectrum    1 weight  0.10000E+01 volume  0.21814E-02 ppm1      7.776 ppm2      2.377 CV     1
 ASSI {  628}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 81   and name HG2 ))
      2.400     0.700     0.700 peak   628 spectrum    1 weight  0.10000E+01 volume  0.18812E-02 ppm1      7.773 ppm2      2.170 CV     1
 ASSI {  629}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 81   and name HB1 ))
      3.400     1.400     1.400 peak   629 spectrum    1 weight  0.10000E+01 volume  0.16983E-02 ppm1      7.772 ppm2      2.063 CV     1
 ASSI {  634}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 83   and name HN  ))
      3.400     1.500     1.500 peak   634 spectrum    1 weight  0.10000E+01 volume  0.24230E-02 ppm1      8.701 ppm2      9.026 CV     1
 ASSI {  635}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 82   and name HA  ))
      2.900     1.000     1.000 peak   635 spectrum    1 weight  0.10000E+01 volume  0.21667E-02 ppm1      8.697 ppm2      5.048 CV     1
 ASSI {  636}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 81   and name HA  ))
      2.900     1.100     1.100 peak   636 spectrum    1 weight  0.10000E+01 volume  0.17496E-02 ppm1      8.701 ppm2      4.652 CV     1
 ASSI {  637}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 81   and name HG1 ))
      3.800     1.800     1.800 peak   637 spectrum    1 weight  0.10000E+01 volume  0.21302E-02 ppm1      8.706 ppm2      2.360 CV     1
 ASSI {  638}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 81   and name HG2 ))
      3.700     1.700     1.700 peak   638 spectrum    1 weight  0.10000E+01 volume  0.20276E-02 ppm1      8.700 ppm2      2.173 CV     1
 ASSI {  639}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 82   and name HG2 ))
      3.800     1.800     1.800 peak   639 spectrum    1 weight  0.10000E+01 volume  0.19252E-02 ppm1      8.702 ppm2      2.049 CV     1
 ASSI {  647}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 81   and name HG1 ))
      1.800     1.800     4.200 peak   647 spectrum    1 weight  0.10000E+01 volume  0.23352E-02 ppm1      9.065 ppm2      2.388 CV     1
 ASSI {  649}
   (( segid "    " and resid 71   and name HN  ))
   (  segid "    " and resid 70   and name HD1%)
      3.600     1.600     1.600 peak   649 spectrum    1 weight  0.10000E+01 volume  0.21156E-02 ppm1      9.065 ppm2      0.933 CV     1
 ASSI {  650}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 70   and name HN  ))
      3.200     1.300     1.300 peak   650 spectrum    1 weight  0.10000E+01 volume  0.19618E-02 ppm1      8.310 ppm2      8.998 CV     1
 ASSI {  652}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 69   and name HA  ))
      2.800     1.000     1.000 peak   652 spectrum    1 weight  0.10000E+01 volume  0.19911E-02 ppm1      8.303 ppm2      5.357 CV     1
 ASSI {  653}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 83   and name HA  ))
      3.600     1.600     1.600 peak   653 spectrum    1 weight  0.10000E+01 volume  0.18228E-02 ppm1      8.309 ppm2      5.003 CV     1
 ASSI {  654}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 86   and name HA  ))
      3.400     1.400     1.400 peak   654 spectrum    1 weight  0.10000E+01 volume  0.21156E-02 ppm1      8.308 ppm2      4.618 CV     1
 ASSI {  657}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 83   and name HG2 ))
      2.800     2.800     3.200 peak   657 spectrum    1 weight  0.10000E+01 volume  0.16032E-02 ppm1      8.310 ppm2      2.143 CV     1
 OR {  657}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 83   and name HG1 ))
 ASSI {  669}
   (( segid "    " and resid 86   and name HN  ))
   (  segid "    " and resid 88   and name HD% )
      3.700     1.800     1.800 peak   669 spectrum    1 weight  0.10000E+01 volume  0.21961E-02 ppm1      8.810 ppm2      6.905 CV     1
 ASSI {  675}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 85   and name HG1 ))
      4.100     2.100     1.900 peak   675 spectrum    1 weight  0.10000E+01 volume  0.13835E-02 ppm1      8.805 ppm2      2.024 CV     1
 ASSI {  676}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 85   and name HB2 ))
      3.900     1.900     1.900 peak   676 spectrum    1 weight  0.10000E+01 volume  0.20350E-02 ppm1      8.806 ppm2      1.734 CV     1
 ASSI {  680}
   (( segid "    " and resid 86   and name HN  ))
   (  segid "    " and resid 67   and name HG2%)
      3.800     1.800     1.800 peak   680 spectrum    1 weight  0.10000E+01 volume  0.15300E-02 ppm1      8.805 ppm2      1.064 CV     1
 ASSI {  681}
   (( segid "    " and resid 86   and name HN  ))
   (  segid "    " and resid 68   and name HG2%)
      3.500     1.500     1.500 peak   681 spectrum    1 weight  0.10000E+01 volume  0.16983E-02 ppm1      8.805 ppm2      0.969 CV     1
 ASSI {  682}
   (( segid "    " and resid 86   and name HN  ))
   (  segid "    " and resid 86   and name HD2%)
      4.100     2.100     1.900 peak   682 spectrum    1 weight  0.10000E+01 volume  0.18593E-02 ppm1      8.805 ppm2      0.767 CV     1
 ASSI {  685}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 88   and name HN  ))
      3.600     1.700     1.700 peak   685 spectrum    1 weight  0.10000E+01 volume  0.20935E-02 ppm1      8.348 ppm2      8.878 CV     1
 ASSI {  695}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 86   and name HG  ))
      3.300     1.400     1.400 peak   695 spectrum    1 weight  0.10000E+01 volume  0.18960E-02 ppm1      8.335 ppm2      1.577 CV     1
 ASSI {  697}
   (( segid "    " and resid 87   and name HN  ))
   (  segid "    " and resid 87   and name HG1%)
      3.600     1.700     1.700 peak   697 spectrum    1 weight  0.10000E+01 volume  0.13689E-02 ppm1      8.334 ppm2      0.954 CV     1
 ASSI {  698}
   (( segid "    " and resid 87   and name HN  ))
   (  segid "    " and resid 87   and name HG2%)
      3.600     1.600     1.600 peak   698 spectrum    1 weight  0.10000E+01 volume  0.16764E-02 ppm1      8.332 ppm2      0.727 CV     1
 ASSI {  699}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 68   and name HN  ))
      3.600     1.600     1.600 peak   699 spectrum    1 weight  0.10000E+01 volume  0.20862E-02 ppm1      8.886 ppm2      9.575 CV     1
 ASSI {  702}
   (( segid "    " and resid 88   and name HN  ))
   (  segid "    " and resid 88   and name HE% )
      3.300     1.400     1.400 peak   702 spectrum    1 weight  0.10000E+01 volume  0.22399E-02 ppm1      8.893 ppm2      7.157 CV     1
 ASSI {  704}
   (( segid "    " and resid 88   and name HN  ))
   (  segid "    " and resid 88   and name HD% )
      2.900     1.000     1.000 peak   704 spectrum    1 weight  0.10000E+01 volume  0.16616E-02 ppm1      8.893 ppm2      6.940 CV     1
 ASSI {  707}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 66   and name HA  ))
      3.300     1.400     1.400 peak   707 spectrum    1 weight  0.10000E+01 volume  0.19765E-02 ppm1      8.887 ppm2      5.077 CV     1
 ASSI {  709}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 89   and name HA  ))
      3.300     3.300     2.700 peak   709 spectrum    1 weight  0.10000E+01 volume  0.21888E-02 ppm1      8.887 ppm2      4.594 CV     1
 ASSI {  710}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 65   and name HA  ))
      3.400     1.400     1.400 peak   710 spectrum    1 weight  0.10000E+01 volume  0.19033E-02 ppm1      8.889 ppm2      4.236 CV     1
 ASSI {  712}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 88   and name HB1 ))
      3.000     1.100     1.100 peak   712 spectrum    1 weight  0.10000E+01 volume  0.17056E-02 ppm1      8.894 ppm2      3.123 CV     1
 ASSI {  713}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 87   and name HB  ))
      3.800     1.800     1.800 peak   713 spectrum    1 weight  0.10000E+01 volume  0.18812E-02 ppm1      8.894 ppm2      1.886 CV     1
 ASSI {  716}
   (( segid "    " and resid 88   and name HN  ))
   (  segid "    " and resid 65   and name HG1%)
      4.000     2.000     2.000 peak   716 spectrum    1 weight  0.10000E+01 volume  0.17642E-02 ppm1      8.893 ppm2      0.820 CV     1
 ASSI {  717}
   (( segid "    " and resid 88   and name HN  ))
   (  segid "    " and resid 87   and name HG2%)
      3.900     1.900     1.900 peak   717 spectrum    1 weight  0.10000E+01 volume  0.14347E-02 ppm1      8.890 ppm2      0.718 CV     1
 ASSI {  719}
   (( segid "    " and resid 88   and name HN  ))
   (  segid "    " and resid 65   and name HG2%)
      3.100     1.200     1.200 peak   719 spectrum    1 weight  0.10000E+01 volume  0.17056E-02 ppm1      8.891 ppm2      0.473 CV     1
 ASSI {  720}
   (( segid "    " and resid 88   and name HN  ))
   (  segid "    " and resid 66   and name HG2%)
      3.300     1.400     1.400 peak   720 spectrum    1 weight  0.10000E+01 volume  0.16178E-02 ppm1      8.893 ppm2     -0.001 CV     1
 ASSI {  721}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 90   and name HN  ))
      3.600     1.600     1.600 peak   721 spectrum    1 weight  0.10000E+01 volume  0.18155E-02 ppm1      9.138 ppm2      8.955 CV     1
 ASSI {  728}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 94   and name HA  ))
      4.200     2.200     1.800 peak   728 spectrum    1 weight  0.10000E+01 volume  0.19911E-02 ppm1      9.139 ppm2      4.706 CV     1
 ASSI {  730}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 65   and name HA  ))
      3.400     1.500     1.500 peak   730 spectrum    1 weight  0.10000E+01 volume  0.18739E-02 ppm1      9.139 ppm2      4.244 CV     1
 ASSI {  733}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 88   and name HB2 ))
      3.100     1.200     1.200 peak   733 spectrum    1 weight  0.10000E+01 volume  0.13323E-02 ppm1      9.140 ppm2      3.121 CV     1
 ASSI {  734}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 94   and name HB1 ))
      2.800     1.000     1.000 peak   734 spectrum    1 weight  0.10000E+01 volume  0.20276E-02 ppm1      9.144 ppm2      2.807 CV     1
 ASSI {  736}
   (( segid "    " and resid 89   and name HN  ))
   (  segid "    " and resid 89   and name HG2%)
      3.900     1.900     1.900 peak   736 spectrum    1 weight  0.10000E+01 volume  0.17275E-02 ppm1      9.140 ppm2      0.973 CV     1
 ASSI {  737}
   (( segid "    " and resid 89   and name HN  ))
   (  segid "    " and resid 65   and name HG1%)
      3.600     3.600     2.400 peak   737 spectrum    1 weight  0.10000E+01 volume  0.20057E-02 ppm1      9.143 ppm2      0.887 CV     1
 ASSI {  738}
   (( segid "    " and resid 89   and name HN  ))
   (  segid "    " and resid 95   and name HG1%)
      4.100     2.100     1.900 peak   738 spectrum    1 weight  0.10000E+01 volume  0.20350E-02 ppm1      9.131 ppm2      0.294 CV     1
 ASSI {  739}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 91   and name HN  ))
      3.700     1.700     1.700 peak   739 spectrum    1 weight  0.10000E+01 volume  0.19692E-02 ppm1      8.967 ppm2     10.639 CV     1
 ASSI {  743}
   (( segid "    " and resid 90   and name HN  ))
   (  segid "    " and resid 88   and name HD% )
      3.000     1.200     1.200 peak   743 spectrum    1 weight  0.10000E+01 volume  0.21302E-02 ppm1      8.971 ppm2      6.961 CV     1
 ASSI {  744}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 88   and name HZ  ))
      3.400     3.400     2.600 peak   744 spectrum    1 weight  0.10000E+01 volume  0.24376E-02 ppm1      8.967 ppm2      6.843 CV     1
 ASSI {  745}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 64   and name HE21))
      1.800     1.800     4.200 peak   745 spectrum    1 weight  0.10000E+01 volume  0.23205E-02 ppm1      8.956 ppm2      6.341 CV     1
 ASSI {  748}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 65   and name HA ))
      3.800     3.800     2.200 peak   748 spectrum    1 weight  0.10000E+01 volume  0.16251E-02 ppm1      8.965 ppm2      4.263 CV     1
 ASSI {  749}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 89   and name HB  ))
      3.600     1.600     1.600 peak   749 spectrum    1 weight  0.10000E+01 volume  0.19692E-02 ppm1      8.967 ppm2      4.136 CV     1
 ASSI {  754}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 90   and name HB2 ))
      2.700     0.900     0.900 peak   754 spectrum    1 weight  0.10000E+01 volume  0.15300E-02 ppm1      8.965 ppm2      1.418 CV     1
 ASSI {  757}
   (( segid "    " and resid 90   and name HN  ))
   (  segid "    " and resid 65   and name HG2%)
      1.800     1.800     4.200 peak   757 spectrum    1 weight  0.10000E+01 volume  0.23498E-02 ppm1      8.964 ppm2      0.483 CV     1
 ASSI {  758}
   (( segid "    " and resid 90   and name HN  ))
   (  segid "    " and resid 66   and name HG2%)
      3.300     1.400     1.400 peak   758 spectrum    1 weight  0.10000E+01 volume  0.20130E-02 ppm1      8.964 ppm2     -0.010 CV     1
 ASSI {  764}
   (( segid "    " and resid 91   and name HN  ))
   (  segid "    " and resid 88   and name HE% )
      3.200     1.300     1.300 peak   764 spectrum    1 weight  0.10000E+01 volume  0.20057E-02 ppm1     10.634 ppm2      7.162 CV     1
 ASSI {  765}
   (( segid "    " and resid 91   and name HN  ))
   (  segid "    " and resid 88   and name HD% )
      3.400     1.500     1.500 peak   765 spectrum    1 weight  0.10000E+01 volume  0.21302E-02 ppm1     10.633 ppm2      6.938 CV     1
 ASSI {  766}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 95   and name HN  ))
      3.500     3.500     2.500 peak   766 spectrum    1 weight  0.10000E+01 volume  0.24157E-02 ppm1     10.632 ppm2      6.739 CV     1
 ASSI {  770}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 92   and name HB2 ))
      3.700     1.700     1.700 peak   770 spectrum    1 weight  0.10000E+01 volume  0.22107E-02 ppm1     10.623 ppm2      2.677 CV     1
 ASSI {  771}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 90   and name HB1 ))
      3.300     1.400     1.400 peak   771 spectrum    1 weight  0.10000E+01 volume  0.19838E-02 ppm1     10.634 ppm2      1.938 CV     1
 ASSI {  772}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 90   and name HB2 ))
      3.700     1.700     1.700 peak   772 spectrum    1 weight  0.10000E+01 volume  0.19911E-02 ppm1     10.630 ppm2      1.437 CV     1
 ASSI {  773}
   (( segid "    " and resid 91   and name HN  ))
   (  segid "    " and resid 90   and name HD1%)
      2.900     1.100     1.100 peak   773 spectrum    1 weight  0.10000E+01 volume  0.16397E-02 ppm1     10.629 ppm2      1.041 CV     1
 ASSI {  774}
   (( segid "    " and resid 91   and name HN  ))
   (  segid "    " and resid 90   and name HD2%)
      3.900     1.900     1.900 peak   774 spectrum    1 weight  0.10000E+01 volume  0.20424E-02 ppm1     10.627 ppm2      0.734 CV     1
 ASSI {  777}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 89   and name HN  ))
      3.500     3.500     2.500 peak   777 spectrum    1 weight  0.10000E+01 volume  0.22693E-02 ppm1      7.800 ppm2      9.180 CV     1
 ASSI {  779}
   (( segid "    " and resid 92   and name HN  ))
   (  segid "    " and resid 88   and name HE% )
      3.400     1.500     1.500 peak   779 spectrum    1 weight  0.10000E+01 volume  0.20643E-02 ppm1      7.803 ppm2      7.160 CV     1
 ASSI {  780}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 95   and name HN  ))
      3.700     1.700     1.700 peak   780 spectrum    1 weight  0.10000E+01 volume  0.22620E-02 ppm1      7.797 ppm2      6.733 CV     1
 ASSI {  786}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 91   and name HA2 ))
      3.100     1.200     1.200 peak   786 spectrum    1 weight  0.10000E+01 volume  0.17129E-02 ppm1      7.801 ppm2      3.923 CV     1
 ASSI {  788}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 92   and name HB2 ))
      3.200     1.300     1.300 peak   788 spectrum    1 weight  0.10000E+01 volume  0.13542E-02 ppm1      7.804 ppm2      2.666 CV     1
 ASSI {  789}
   (( segid "    " and resid 92   and name HN  ))
   (  segid "    " and resid 89   and name HG2%)
      3.500     1.500     1.500 peak   789 spectrum    1 weight  0.10000E+01 volume  0.17861E-02 ppm1      7.803 ppm2      0.978 CV     1
 ASSI {  790}
   (( segid "    " and resid 92   and name HN  ))
   (  segid "    " and resid 95   and name HG2%)
      3.300     1.400     1.400 peak   790 spectrum    1 weight  0.10000E+01 volume  0.21888E-02 ppm1      7.809 ppm2      0.030 CV     1
 ASSI {  791}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 91   and name HN  ))
      3.200     1.300     1.300 peak   791 spectrum    1 weight  0.10000E+01 volume  0.19618E-02 ppm1      8.952 ppm2     10.642 CV     1
 ASSI {  797}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 95   and name HN  ))
      3.600     1.600     1.600 peak   797 spectrum    1 weight  0.10000E+01 volume  0.19325E-02 ppm1      8.948 ppm2      6.766 CV     1
 ASSI {  799}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 94   and name HA  ))
      4.000     2.000     2.000 peak   799 spectrum    1 weight  0.10000E+01 volume  0.17129E-02 ppm1      8.947 ppm2      4.730 CV     1
 ASSI {  801}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 91   and name HA2 ))
      2.900     1.100     1.100 peak   801 spectrum    1 weight  0.10000E+01 volume  0.21009E-02 ppm1      8.949 ppm2      3.945 CV     1
 ASSI {  802}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 93   and name HB1 ))
      3.400     1.500     1.500 peak   802 spectrum    1 weight  0.10000E+01 volume  0.16251E-02 ppm1      8.946 ppm2      3.197 CV     1
 ASSI {  803}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 92   and name HB1 ))
      3.400     1.400     1.400 peak   803 spectrum    1 weight  0.10000E+01 volume  0.19325E-02 ppm1      8.948 ppm2      2.893 CV     1
 ASSI {  804}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 92   and name HB2 ))
      3.900     1.900     1.900 peak   804 spectrum    1 weight  0.10000E+01 volume  0.18374E-02 ppm1      8.949 ppm2      2.676 CV     1
 ASSI {  805}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 100  and name HB2 ))
      3.000     1.100     1.100 peak   805 spectrum    1 weight  0.10000E+01 volume  0.20862E-02 ppm1      8.949 ppm2      2.404 CV     1
 ASSI {  806}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 100  and name HB1 ))
      3.600     1.600     1.600 peak   806 spectrum    1 weight  0.10000E+01 volume  0.22912E-02 ppm1      8.942 ppm2      2.550 CV     1
 ASSI {  807}
   (( segid "    " and resid 93   and name HN  ))
   (  segid "    " and resid 101  and name HD2%)
      3.400     3.400     2.600 peak   807 spectrum    1 weight  0.10000E+01 volume  0.22839E-02 ppm1      8.952 ppm2      0.471 CV     1
 ASSI {  811}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 92   and name HN  ))
      3.000     1.100     1.100 peak   811 spectrum    1 weight  0.10000E+01 volume  0.21961E-02 ppm1      9.093 ppm2      7.806 CV     1
 ASSI {  814}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 88   and name HA  ))
      4.400     2.400     1.600 peak   814 spectrum    1 weight  0.10000E+01 volume  0.22253E-02 ppm1      9.093 ppm2      4.955 CV     1
 ASSI {  815}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 92   and name HA  ))
      3.400     1.500     1.500 peak   815 spectrum    1 weight  0.10000E+01 volume  0.19325E-02 ppm1      9.095 ppm2      4.834 CV     1
 ASSI {  818}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 93   and name HB2 ))
      3.400     1.400     1.400 peak   818 spectrum    1 weight  0.10000E+01 volume  0.18666E-02 ppm1      9.097 ppm2      3.162 CV     1
 ASSI {  822}
   (( segid "    " and resid 94   and name HN  ))
   (  segid "    " and resid 95   and name HG1%)
      3.800     1.800     1.800 peak   822 spectrum    1 weight  0.10000E+01 volume  0.20424E-02 ppm1      9.092 ppm2      0.312 CV     1
 ASSI {  823}
   (( segid "    " and resid 94   and name HN  ))
   (  segid "    " and resid 95   and name HG2%)
      3.300     1.400     1.400 peak   823 spectrum    1 weight  0.10000E+01 volume  0.19033E-02 ppm1      9.093 ppm2      0.055 CV     1
 ASSI {  828}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 97   and name HE21))
      4.200     2.200     1.800 peak   828 spectrum    1 weight  0.10000E+01 volume  0.15300E-02 ppm1      6.773 ppm2      7.749 CV     1
 ASSI {  831}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 94   and name HB1 ))
      3.000     1.100     1.100 peak   831 spectrum    1 weight  0.10000E+01 volume  0.18812E-02 ppm1      6.761 ppm2      2.812 CV     1
 ASSI {  832}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 94   and name HB2 ))
      3.700     1.800     1.800 peak   832 spectrum    1 weight  0.10000E+01 volume  0.16983E-02 ppm1      6.765 ppm2      2.706 CV     1
 ASSI {  833}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 95   and name HB  ))
      3.700     1.700     1.700 peak   833 spectrum    1 weight  0.10000E+01 volume  0.18520E-02 ppm1      6.766 ppm2      1.813 CV     1
 ASSI {  835}
   (( segid "    " and resid 95   and name HN  ))
   (  segid "    " and resid 95   and name HG2%)
      2.800     1.000     1.000 peak   835 spectrum    1 weight  0.10000E+01 volume  0.14055E-02 ppm1      6.764 ppm2      0.061 CV     1
 ASSI {  836}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 97   and name HN  ))
      3.100     1.200     1.200 peak   836 spectrum    1 weight  0.10000E+01 volume  0.20276E-02 ppm1      7.636 ppm2      9.061 CV     1
 ASSI {  837}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 99   and name HN  ))
      3.100     1.200     1.200 peak   837 spectrum    1 weight  0.10000E+01 volume  0.20716E-02 ppm1      7.633 ppm2      7.256 CV     1
 ASSI {  839}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 95   and name HN  ))
      3.400     1.500     1.500 peak   839 spectrum    1 weight  0.10000E+01 volume  0.18228E-02 ppm1      7.636 ppm2      6.766 CV     1
 ASSI {  842}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 99   and name HA  ))
      3.900     1.900     1.900 peak   842 spectrum    1 weight  0.10000E+01 volume  0.22253E-02 ppm1      7.634 ppm2      4.143 CV     1
 ASSI {  844}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 96   and name HB  ))
      3.100     1.200     1.200 peak   844 spectrum    1 weight  0.10000E+01 volume  0.19544E-02 ppm1      7.640 ppm2      2.084 CV     1
 ASSI {  846}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 99   and name HB1 ))
      2.800     1.000     1.000 peak   846 spectrum    1 weight  0.10000E+01 volume  0.22034E-02 ppm1      7.641 ppm2      1.488 CV     1
 ASSI {  847}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 96   and name HG11))
      3.000     1.100     1.100 peak   847 spectrum    1 weight  0.10000E+01 volume  0.15519E-02 ppm1      7.638 ppm2      1.240 CV     1
 ASSI {  850}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 98   and name HN  ))
      3.000     1.100     1.100 peak   850 spectrum    1 weight  0.10000E+01 volume  0.13689E-02 ppm1      9.050 ppm2      8.982 CV     1
 ASSI {  851}
   (( segid "    " and resid 97   and name HN  ))
   (  segid "    " and resid 120  and name HD% )
      3.900     1.900     1.900 peak   851 spectrum    1 weight  0.10000E+01 volume  0.22180E-02 ppm1      9.056 ppm2      6.916 CV     1
 ASSI {  852}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 97   and name HE22))
      3.800     1.800     1.800 peak   852 spectrum    1 weight  0.10000E+01 volume  0.23352E-02 ppm1      9.053 ppm2      6.763 CV     1
 ASSI {  853}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 120  and name HA  ))
      3.000     1.100     1.100 peak   853 spectrum    1 weight  0.10000E+01 volume  0.21156E-02 ppm1      9.049 ppm2      4.708 CV     1
 ASSI {  854}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 98   and name HA  ))
      3.600     1.700     1.700 peak   854 spectrum    1 weight  0.10000E+01 volume  0.19544E-02 ppm1      9.049 ppm2      3.892 CV     1
 ASSI {  855}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 97   and name HA  ))
      2.600     0.900     0.900 peak   855 spectrum    1 weight  0.10000E+01 volume  0.20935E-02 ppm1      9.050 ppm2      4.007 CV     1
 ASSI {  856}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 121  and name HA  ))
      4.000     2.000     2.000 peak   856 spectrum    1 weight  0.10000E+01 volume  0.20862E-02 ppm1      9.050 ppm2      4.450 CV     1
 ASSI {  857}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 120  and name HB1 ))
      3.300     1.400     1.400 peak   857 spectrum    1 weight  0.10000E+01 volume  0.22180E-02 ppm1      9.047 ppm2      3.263 CV     1
 ASSI {  862}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 96   and name HG11))
      3.200     1.300     1.300 peak   862 spectrum    1 weight  0.10000E+01 volume  0.20862E-02 ppm1      9.056 ppm2      1.254 CV     1
 ASSI {  863}
   (( segid "    " and resid 97   and name HN  ))
   (  segid "    " and resid 98   and name HB% )
      3.800     1.800     1.800 peak   863 spectrum    1 weight  0.10000E+01 volume  0.18960E-02 ppm1      9.046 ppm2      1.130 CV     1
 ASSI {  867}
   (( segid "    " and resid 98   and name HN  ))
   (  segid "    " and resid 120  and name HD% )
      3.000     1.100     1.100 peak   867 spectrum    1 weight  0.10000E+01 volume  0.22839E-02 ppm1      8.972 ppm2      6.888 CV     1
 ASSI {  868}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 120  and name HA  ))
      3.100     1.200     1.200 peak   868 spectrum    1 weight  0.10000E+01 volume  0.20862E-02 ppm1      8.959 ppm2      4.684 CV     1
 ASSI {  869}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 121  and name HA  ))
      3.800     1.800     1.800 peak   869 spectrum    1 weight  0.10000E+01 volume  0.20935E-02 ppm1      8.961 ppm2      4.446 CV     1
 ASSI {  871}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 120  and name HB1 ))
      2.800     1.000     1.000 peak   871 spectrum    1 weight  0.10000E+01 volume  0.18007E-02 ppm1      8.966 ppm2      3.255 CV     1
 ASSI {  872}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 97   and name HG1 ))
      3.500     1.500     1.500 peak   872 spectrum    1 weight  0.10000E+01 volume  0.20203E-02 ppm1      8.964 ppm2      2.629 CV     1
 ASSI {  873}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 120  and name HB2 ))
      4.000     2.000     2.000 peak   873 spectrum    1 weight  0.10000E+01 volume  0.18593E-02 ppm1      8.968 ppm2      2.534 CV     1
 ASSI {  875}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 96   and name HB  ))
      2.900     1.000     1.000 peak   875 spectrum    1 weight  0.10000E+01 volume  0.17422E-02 ppm1      8.963 ppm2      2.100 CV     1
 ASSI {  876}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 99   and name HB1 ))
      3.900     1.900     1.900 peak   876 spectrum    1 weight  0.10000E+01 volume  0.23717E-02 ppm1      8.968 ppm2      1.487 CV     1
 ASSI {  878}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 96   and name HG11))
      2.500     0.800     0.800 peak   878 spectrum    1 weight  0.10000E+01 volume  0.25548E-02 ppm1      8.965 ppm2      1.213 CV     1
 OR {  878}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 96   and name HG12))
 ASSI {  879}
   (( segid "    " and resid 98   and name HN  ))
   (  segid "    " and resid 96   and name HG2%)
      4.100     2.100     1.900 peak   879 spectrum    1 weight  0.10000E+01 volume  0.19911E-02 ppm1      8.961 ppm2      0.253 CV     1
 ASSI {  880}
   (( segid "    " and resid 98   and name HN  ))
   (  segid "    " and resid 95   and name HG2%)
      3.800     1.800     1.800 peak   880 spectrum    1 weight  0.10000E+01 volume  0.24303E-02 ppm1      8.967 ppm2      0.050 CV     1
 ASSI {  885}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 100  and name HA  ))
      3.600     1.600     1.600 peak   885 spectrum    1 weight  0.10000E+01 volume  0.21302E-02 ppm1      7.247 ppm2      4.607 CV     1
 ASSI {  887}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 98   and name HA  ))
      3.100     1.200     1.200 peak   887 spectrum    1 weight  0.10000E+01 volume  0.18886E-02 ppm1      7.251 ppm2      3.823 CV     1
 ASSI {  888}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 100  and name HB1 ))
      3.400     1.400     1.400 peak   888 spectrum    1 weight  0.10000E+01 volume  0.20716E-02 ppm1      7.253 ppm2      2.583 CV     1
 ASSI {  889}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 100  and name HB2 ))
      3.700     1.700     1.700 peak   889 spectrum    1 weight  0.10000E+01 volume  0.20276E-02 ppm1      7.253 ppm2      2.380 CV     1
 ASSI {  890}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 96   and name HB  ))
      3.800     1.800     1.800 peak   890 spectrum    1 weight  0.10000E+01 volume  0.20350E-02 ppm1      7.256 ppm2      2.076 CV     1
 ASSI {  891}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 95   and name HB  ))
      3.600     1.600     1.600 peak   891 spectrum    1 weight  0.10000E+01 volume  0.23717E-02 ppm1      7.260 ppm2      1.805 CV     1
 ASSI {  897}
   (( segid "    " and resid 99   and name HN  ))
   (  segid "    " and resid 95   and name HG2%)
      3.500     1.600     1.600 peak   897 spectrum    1 weight  0.10000E+01 volume  0.19911E-02 ppm1      7.252 ppm2      0.053 CV     1
 ASSI {  898}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 91   and name HN  ))
      3.600     3.600     2.400 peak   898 spectrum    1 weight  0.10000E+01 volume  0.22546E-02 ppm1      7.207 ppm2     10.574 CV     1
 ASSI {  900}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 98   and name HN  ))
      3.200     1.200     1.200 peak   900 spectrum    1 weight  0.10000E+01 volume  0.21594E-02 ppm1      7.205 ppm2      8.968 CV     1
 ASSI {  905}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 95   and name HN  ))
      3.900     1.900     1.900 peak   905 spectrum    1 weight  0.10000E+01 volume  0.23278E-02 ppm1      7.198 ppm2      6.757 CV     1
 ASSI {  908}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 99   and name HA  ))
      2.900     1.100     1.100 peak   908 spectrum    1 weight  0.10000E+01 volume  0.19471E-02 ppm1      7.205 ppm2      4.188 CV     1
 ASSI {  910}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 98   and name HA  ))
      3.000     3.000     3.000 peak   910 spectrum    1 weight  0.10000E+01 volume  0.23937E-02 ppm1      7.201 ppm2      3.810 CV     1
 ASSI {  913}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 103  and name HB  ))
      3.700     3.700     2.300 peak   913 spectrum    1 weight  0.10000E+01 volume  0.14055E-02 ppm1      7.201 ppm2      2.312 CV     1
 ASSI {  915}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 95   and name HB  ))
      3.600     1.600     1.600 peak   915 spectrum    1 weight  0.10000E+01 volume  0.19325E-02 ppm1      7.201 ppm2      1.797 CV     1
 ASSI {  918}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 99   and name HB2 ))
      3.600     1.600     1.600 peak   918 spectrum    1 weight  0.10000E+01 volume  0.19618E-02 ppm1      7.201 ppm2      1.330 CV     1
 ASSI {  920}
   (( segid "    " and resid 100  and name HN  ))
   (  segid "    " and resid 95   and name HG1%)
      1.800     1.800     4.200 peak   920 spectrum    1 weight  0.10000E+01 volume  0.22620E-02 ppm1      7.203 ppm2      0.278 CV     1
 ASSI {  921}
   (( segid "    " and resid 100  and name HN  ))
   (  segid "    " and resid 95   and name HG2%)
      2.900     1.100     1.100 peak   921 spectrum    1 weight  0.10000E+01 volume  0.16470E-02 ppm1      7.203 ppm2      0.057 CV     1
 ASSI {  924}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 103  and name HN  ))
      3.400     1.400     1.400 peak   924 spectrum    1 weight  0.10000E+01 volume  0.19325E-02 ppm1      8.227 ppm2      7.954 CV     1
 ASSI {  929}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 100  and name HA  ))
      3.000     1.100     1.100 peak   929 spectrum    1 weight  0.10000E+01 volume  0.20130E-02 ppm1      8.226 ppm2      4.610 CV     1
 ASSI {  931}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 99   and name HA  ))
      3.300     1.300     1.300 peak   931 spectrum    1 weight  0.10000E+01 volume  0.20130E-02 ppm1      8.222 ppm2      4.177 CV     1
 ASSI {  932}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 97   and name HA  ))
      3.400     1.400     1.400 peak   932 spectrum    1 weight  0.10000E+01 volume  0.18447E-02 ppm1      8.220 ppm2      4.022 CV     1
 ASSI {  935}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 100  and name HB2 ))
      3.700     1.700     1.700 peak   935 spectrum    1 weight  0.10000E+01 volume  0.17496E-02 ppm1      8.224 ppm2      2.387 CV     1
 ASSI {  938}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 101  and name HB2 ))
      2.600     0.900     0.900 peak   938 spectrum    1 weight  0.10000E+01 volume  0.20497E-02 ppm1      8.224 ppm2      1.153 CV     1
 ASSI {  939}
   (( segid "    " and resid 101  and name HN  ))
   (  segid "    " and resid 103  and name HG2%)
      3.500     1.600     1.600 peak   939 spectrum    1 weight  0.10000E+01 volume  0.20350E-02 ppm1      8.217 ppm2      1.045 CV     1
 ASSI {  940}
   (( segid "    " and resid 101  and name HN  ))
   (  segid "    " and resid 101  and name HD1%)
      3.800     1.800     1.800 peak   940 spectrum    1 weight  0.10000E+01 volume  0.16616E-02 ppm1      8.224 ppm2      0.675 CV     1
 ASSI {  946}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 88   and name HZ  ))
      3.900     3.900     2.100 peak   946 spectrum    1 weight  0.10000E+01 volume  0.18447E-02 ppm1      7.172 ppm2      6.833 CV     1
 ASSI {  947}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 100  and name HA  ))
      3.200     1.300     1.300 peak   947 spectrum    1 weight  0.10000E+01 volume  0.20789E-02 ppm1      7.167 ppm2      4.599 CV     1
 ASSI {  950}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 103  and name HA  ))
      3.700     1.700     1.700 peak   950 spectrum    1 weight  0.10000E+01 volume  0.20203E-02 ppm1      7.162 ppm2      3.948 CV     1
 ASSI {  954}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 104  and name HD2 ))
      3.100     1.200     1.200 peak   954 spectrum    1 weight  0.10000E+01 volume  0.19471E-02 ppm1      7.164 ppm2      3.108 CV     1
 ASSI {  956}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 103  and name HB  ))
      3.700     1.700     1.700 peak   956 spectrum    1 weight  0.10000E+01 volume  0.19106E-02 ppm1      7.162 ppm2      2.283 CV     1
 ASSI {  957}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 99   and name HB1 ))
      3.600     1.600     1.600 peak   957 spectrum    1 weight  0.10000E+01 volume  0.20350E-02 ppm1      7.161 ppm2      1.466 CV     1
 ASSI {  958}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 101  and name HB2 ))
      2.800     1.000     1.000 peak   958 spectrum    1 weight  0.10000E+01 volume  0.18301E-02 ppm1      7.162 ppm2      1.145 CV     1
 ASSI {  959}
   (( segid "    " and resid 102  and name HN  ))
   (  segid "    " and resid 99   and name HD2%)
      4.000     2.000     2.000 peak   959 spectrum    1 weight  0.10000E+01 volume  0.17422E-02 ppm1      7.163 ppm2      0.767 CV     1
 ASSI {  963}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 105  and name HN  ))
      3.000     1.100     1.100 peak   963 spectrum    1 weight  0.10000E+01 volume  0.21741E-02 ppm1      7.933 ppm2      7.398 CV     1
 ASSI {  965}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 100  and name HA  ))
      3.100     1.200     1.200 peak   965 spectrum    1 weight  0.10000E+01 volume  0.20570E-02 ppm1      7.938 ppm2      4.650 CV     1
 ASSI {  966}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 102  and name HA  ))
      2.800     1.000     1.000 peak   966 spectrum    1 weight  0.10000E+01 volume  0.19838E-02 ppm1      7.933 ppm2      4.460 CV     1
 ASSI {  967}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 99   and name HA  ))
      3.000     1.100     1.100 peak   967 spectrum    1 weight  0.10000E+01 volume  0.19911E-02 ppm1      7.934 ppm2      4.184 CV     1
 ASSI {  969}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 102  and name HB1 ))
      3.100     1.200     1.200 peak   969 spectrum    1 weight  0.10000E+01 volume  0.15006E-02 ppm1      7.933 ppm2      3.545 CV     1
 OR {  969}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 102  and name HB2 ))
 ASSI {  975}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 104  and name HG1 ))
      4.200     2.200     1.800 peak   975 spectrum    1 weight  0.10000E+01 volume  0.22766E-02 ppm1      7.943 ppm2      2.102 CV     1
 ASSI {  976}
   (( segid "    " and resid 103  and name HN  ))
   (  segid "    " and resid 114  and name HG2%)
      3.600     1.600     1.600 peak   976 spectrum    1 weight  0.10000E+01 volume  0.20570E-02 ppm1      7.941 ppm2      0.881 CV     1
 OR {  976}
   (( segid "    " and resid 103  and name HN  ))
   (  segid "    " and resid 114  and name HG1%)
 ASSI {  977}
   (( segid "    " and resid 103  and name HN  ))
   (  segid "    " and resid 99   and name HD2%)
      4.000     2.000     2.000 peak   977 spectrum    1 weight  0.10000E+01 volume  0.18666E-02 ppm1      7.935 ppm2      0.738 CV     1
 ASSI {  982}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 104  and name HA  ))
      3.100     1.200     1.200 peak   982 spectrum    1 weight  0.10000E+01 volume  0.15079E-02 ppm1      7.379 ppm2      4.280 CV     1
 ASSI {  984}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 103  and name HA  ))
      3.200     1.300     1.300 peak   984 spectrum    1 weight  0.10000E+01 volume  0.19033E-02 ppm1      7.381 ppm2      3.953 CV     1
 ASSI {  985}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 104  and name HD1 ))
      3.100     1.200     1.200 peak   985 spectrum    1 weight  0.10000E+01 volume  0.18739E-02 ppm1      7.380 ppm2      3.625 CV     1
 ASSI {  987}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 104  and name HD2 ))
      2.700     0.900     0.900 peak   987 spectrum    1 weight  0.10000E+01 volume  0.17348E-02 ppm1      7.378 ppm2      3.105 CV     1
 ASSI {  988}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 47   and name HE1 ))
      4.100     2.100     1.900 peak   988 spectrum    1 weight  0.10000E+01 volume  0.20643E-02 ppm1      7.377 ppm2      2.542 CV     1
 OR {  988}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 47   and name HE2 ))
 ASSI {  991}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 104  and name HG1 ))
      3.500     1.500     1.500 peak   991 spectrum    1 weight  0.10000E+01 volume  0.19984E-02 ppm1      7.378 ppm2      2.095 CV     1
 ASSI {  994}
   (( segid "    " and resid 105  and name HN  ))
   (  segid "    " and resid 103  and name HG1%)
      3.300     1.300     1.300 peak   994 spectrum    1 weight  0.10000E+01 volume  0.21375E-02 ppm1      7.383 ppm2      1.300 CV     1
 ASSI {  996}
   (( segid "    " and resid 105  and name HN  ))
   (  segid "    " and resid 105  and name HD2%)
      3.900     1.900     1.900 peak   996 spectrum    1 weight  0.10000E+01 volume  0.17422E-02 ppm1      7.380 ppm2      0.870 CV     1
 ASSI {  997}
   (( segid "    " and resid 105  and name HN  ))
   (  segid "    " and resid 39   and name HD1%)
      3.900     1.900     1.900 peak   997 spectrum    1 weight  0.10000E+01 volume  0.18960E-02 ppm1      7.382 ppm2      0.749 CV     1
 OR {  997}
   (( segid "    " and resid 105  and name HN  ))
   (  segid "    " and resid 39   and name HG2%)
 ASSI { 1000}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 107  and name HN  ))
      3.700     1.700     1.700 peak  1000 spectrum    1 weight  0.10000E+01 volume  0.19765E-02 ppm1      7.861 ppm2      7.668 CV     1
 ASSI { 1002}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 89   and name HB  ))
      3.600     1.600     1.600 peak  1002 spectrum    1 weight  0.10000E+01 volume  0.23864E-02 ppm1      7.863 ppm2      4.157 CV     1
 ASSI { 1005}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 106  and name HG1 ))
      3.900     1.900     1.900 peak  1005 spectrum    1 weight  0.10000E+01 volume  0.19471E-02 ppm1      7.865 ppm2      2.347 CV     1
 ASSI { 1008}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 47   and name HG2 ))
      3.800     1.800     1.800 peak  1008 spectrum    1 weight  0.10000E+01 volume  0.21594E-02 ppm1      7.866 ppm2      1.377 CV     1
 OR { 1008}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 47   and name HG1 ))
 ASSI { 1009}
   (( segid "    " and resid 106  and name HN  ))
   (  segid "    " and resid 103  and name HG1%)
      3.200     1.300     1.300 peak  1009 spectrum    1 weight  0.10000E+01 volume  0.23644E-02 ppm1      7.866 ppm2      1.301 CV     1
 ASSI { 1017}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 110  and name HG1 ))
      3.100     1.200     1.200 peak  1017 spectrum    1 weight  0.10000E+01 volume  0.20716E-02 ppm1      7.658 ppm2      2.686 CV     1
 OR { 1017}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 110  and name HG2 ))
 ASSI { 1020}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 110  and name HB2 ))
      3.200     1.300     1.300 peak  1020 spectrum    1 weight  0.10000E+01 volume  0.17715E-02 ppm1      7.650 ppm2      2.069 CV     1
 ASSI { 1021}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 106  and name HB2 ))
      3.000     1.100     1.100 peak  1021 spectrum    1 weight  0.10000E+01 volume  0.16470E-02 ppm1      7.651 ppm2      1.863 CV     1
 ASSI { 1022}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 109  and name HN  ))
      3.500     1.500     1.500 peak  1022 spectrum    1 weight  0.10000E+01 volume  0.22399E-02 ppm1      8.466 ppm2      8.832 CV     1
 ASSI { 1024}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 59   and name HN  ))
      3.200     1.300     1.300 peak  1024 spectrum    1 weight  0.10000E+01 volume  0.22399E-02 ppm1      8.466 ppm2      8.017 CV     1
 ASSI { 1025}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 107  and name HN  ))
      3.500     1.500     1.500 peak  1025 spectrum    1 weight  0.10000E+01 volume  0.22546E-02 ppm1      8.466 ppm2      7.659 CV     1
 ASSI { 1026}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 59   and name HA  ))
      3.000     1.100     1.100 peak  1026 spectrum    1 weight  0.10000E+01 volume  0.18447E-02 ppm1      8.467 ppm2      5.186 CV     1
 ASSI { 1029}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 57   and name HB2 ))
      3.000     1.100     1.100 peak  1029 spectrum    1 weight  0.10000E+01 volume  0.18593E-02 ppm1      8.465 ppm2      4.022 CV     1
 OR { 1029}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 57   and name HB1 ))
 ASSI { 1031}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 108  and name HA  ))
      2.600     0.800     0.800 peak  1031 spectrum    1 weight  0.10000E+01 volume  0.23571E-02 ppm1      8.468 ppm2      3.325 CV     1
 ASSI { 1032}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 53   and name HA2 ))
      3.900     1.900     1.900 peak  1032 spectrum    1 weight  0.10000E+01 volume  0.20643E-02 ppm1      8.466 ppm2      3.417 CV     1
 ASSI { 1034}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 107  and name HB2 ))
      3.800     1.800     1.800 peak  1034 spectrum    1 weight  0.10000E+01 volume  0.18593E-02 ppm1      8.467 ppm2      2.275 CV     1
 ASSI { 1040}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 53   and name HN  ))
      3.800     3.800     2.200 peak  1040 spectrum    1 weight  0.10000E+01 volume  0.26499E-02 ppm1      8.827 ppm2      9.240 CV     1
 ASSI { 1049}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 60   and name HD2 ))
      4.200     2.200     1.800 peak  1049 spectrum    1 weight  0.10000E+01 volume  0.21961E-02 ppm1      8.827 ppm2      3.509 CV     1
 ASSI { 1050}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 53   and name HA2 ))
      3.500     1.500     1.500 peak  1050 spectrum    1 weight  0.10000E+01 volume  0.18301E-02 ppm1      8.825 ppm2      3.410 CV     1
 ASSI { 1053}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 108  and name HB  ))
      3.500     1.500     1.500 peak  1053 spectrum    1 weight  0.10000E+01 volume  0.20862E-02 ppm1      8.830 ppm2      2.046 CV     1
 ASSI { 1055}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 144  and name HB2 ))
      4.000     2.000     2.000 peak  1055 spectrum    1 weight  0.10000E+01 volume  0.18812E-02 ppm1      8.827 ppm2      1.314 CV     1
 ASSI { 1059}
   (( segid "    " and resid 109  and name HN  ))
   (  segid "    " and resid 108  and name HG2%)
      3.800     1.800     1.800 peak  1059 spectrum    1 weight  0.10000E+01 volume  0.16543E-02 ppm1      8.829 ppm2      0.825 CV     1
 ASSI { 1061}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 53   and name HN  ))
      3.500     1.500     1.500 peak  1061 spectrum    1 weight  0.10000E+01 volume  0.21521E-02 ppm1      8.486 ppm2      9.204 CV     1
 ASSI { 1062}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 111  and name HN  ))
      3.700     1.700     1.700 peak  1062 spectrum    1 weight  0.10000E+01 volume  0.18228E-02 ppm1      8.481 ppm2      8.975 CV     1
 ASSI { 1066}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 107  and name HN  ))
      3.400     1.400     1.400 peak  1066 spectrum    1 weight  0.10000E+01 volume  0.20130E-02 ppm1      8.482 ppm2      7.655 CV     1
 ASSI { 1067}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 143  and name HA  ))
      3.600     1.600     1.600 peak  1067 spectrum    1 weight  0.10000E+01 volume  0.21814E-02 ppm1      8.481 ppm2      5.603 CV     1
 ASSI { 1069}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 109  and name HA1 ))
      3.400     1.500     1.500 peak  1069 spectrum    1 weight  0.10000E+01 volume  0.17348E-02 ppm1      8.479 ppm2      4.388 CV     1
 ASSI { 1070}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 53   and name HA1 ))
      3.300     1.400     1.400 peak  1070 spectrum    1 weight  0.10000E+01 volume  0.19838E-02 ppm1      8.479 ppm2      3.987 CV     1
 ASSI { 1071}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 109  and name HA2 ))
      3.300     1.300     1.300 peak  1071 spectrum    1 weight  0.10000E+01 volume  0.16983E-02 ppm1      8.478 ppm2      3.715 CV     1
 ASSI { 1072}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 108  and name HA  ))
      3.500     1.500     1.500 peak  1072 spectrum    1 weight  0.10000E+01 volume  0.17861E-02 ppm1      8.478 ppm2      3.326 CV     1
 ASSI { 1073}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 110  and name HG1 ))
      3.300     1.400     1.400 peak  1073 spectrum    1 weight  0.10000E+01 volume  0.17422E-02 ppm1      8.477 ppm2      2.716 CV     1
 OR { 1073}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 110  and name HG2 ))
 ASSI { 1074}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 107  and name HB1 ))
      3.500     3.500     2.500 peak  1074 spectrum    1 weight  0.10000E+01 volume  0.15446E-02 ppm1      8.476 ppm2      2.574 CV     1
 ASSI { 1075}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 110  and name HB1 ))
      2.800     1.000     1.000 peak  1075 spectrum    1 weight  0.10000E+01 volume  0.14347E-02 ppm1      8.479 ppm2      2.239 CV     1
 ASSI { 1076}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 51   and name HB  ))
      3.900     3.900     2.100 peak  1076 spectrum    1 weight  0.10000E+01 volume  0.19033E-02 ppm1      8.480 ppm2      2.109 CV     1
 ASSI { 1077}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 144  and name HB2 ))
      3.900     1.900     1.900 peak  1077 spectrum    1 weight  0.10000E+01 volume  0.21375E-02 ppm1      8.478 ppm2      1.292 CV     1
 ASSI { 1078}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 144  and name HG  ))
      3.500     1.600     1.600 peak  1078 spectrum    1 weight  0.10000E+01 volume  0.23425E-02 ppm1      8.479 ppm2      1.415 CV     1
 ASSI { 1079}
   (( segid "    " and resid 110  and name HN  ))
   (  segid "    " and resid 108  and name HG1%)
      4.000     2.000     2.000 peak  1079 spectrum    1 weight  0.10000E+01 volume  0.20935E-02 ppm1      8.479 ppm2      0.900 CV     1
 OR { 1079}
   (( segid "    " and resid 110  and name HN  ))
   (  segid "    " and resid 108  and name HG2%)
 ASSI { 1080}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 112  and name HN  ))
      3.300     1.400     1.400 peak  1080 spectrum    1 weight  0.10000E+01 volume  0.21082E-02 ppm1      8.982 ppm2      9.975 CV     1
 ASSI { 1086}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 111  and name HA  ))
      2.900     1.000     1.000 peak  1086 spectrum    1 weight  0.10000E+01 volume  0.16690E-02 ppm1      8.978 ppm2      5.600 CV     1
 ASSI { 1087}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 112  and name HA  ))
      3.100     3.100     2.900 peak  1087 spectrum    1 weight  0.10000E+01 volume  0.23132E-02 ppm1      8.973 ppm2      5.133 CV     1
 ASSI { 1089}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 52   and name HA  ))
      3.400     1.500     1.500 peak  1089 spectrum    1 weight  0.10000E+01 volume  0.21229E-02 ppm1      8.973 ppm2      4.368 CV     1
 ASSI { 1092}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 110  and name HG2 ))
      3.300     1.400     1.400 peak  1092 spectrum    1 weight  0.10000E+01 volume  0.16764E-02 ppm1      8.981 ppm2      2.705 CV     1
 ASSI { 1093}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 144  and name HB1 ))
      3.500     3.500     2.500 peak  1093 spectrum    1 weight  0.10000E+01 volume  0.20130E-02 ppm1      8.987 ppm2      2.408 CV     1
 ASSI { 1094}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 110  and name HB1 ))
      3.600     1.600     1.600 peak  1094 spectrum    1 weight  0.10000E+01 volume  0.19544E-02 ppm1      8.983 ppm2      2.208 CV     1
 ASSI { 1095}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 51   and name HB  ))
      2.900     1.000     1.000 peak  1095 spectrum    1 weight  0.10000E+01 volume  0.15738E-02 ppm1      8.980 ppm2      2.046 CV     1
 ASSI { 1096}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 50   and name HG  ))
      3.500     1.600     1.600 peak  1096 spectrum    1 weight  0.10000E+01 volume  0.22326E-02 ppm1      8.974 ppm2      1.623 CV     1
 ASSI { 1097}
   (( segid "    " and resid 111  and name HN  ))
   (  segid "    " and resid 112  and name HB% )
      3.200     1.200     1.200 peak  1097 spectrum    1 weight  0.10000E+01 volume  0.21961E-02 ppm1      8.978 ppm2      1.534 CV     1
 ASSI { 1098}
   (( segid "    " and resid 111  and name HN  ))
   (  segid "    " and resid 111  and name HG2%)
      3.700     1.700     1.700 peak  1098 spectrum    1 weight  0.10000E+01 volume  0.19252E-02 ppm1      8.976 ppm2      1.174 CV     1
 ASSI { 1099}
   (( segid "    " and resid 111  and name HN  ))
   (  segid "    " and resid 51   and name HG1%)
      4.000     2.000     2.000 peak  1099 spectrum    1 weight  0.10000E+01 volume  0.16690E-02 ppm1      8.981 ppm2      1.043 CV     1
 ASSI { 1101}
   (( segid "    " and resid 111  and name HN  ))
   (  segid "    " and resid 50   and name HD1%)
      3.700     1.700     1.700 peak  1101 spectrum    1 weight  0.10000E+01 volume  0.20789E-02 ppm1      8.980 ppm2      0.782 CV     1
 ASSI { 1103}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 114  and name HN  ))
      3.500     3.500     2.500 peak  1103 spectrum    1 weight  0.10000E+01 volume  0.23205E-02 ppm1      9.977 ppm2      9.715 CV     1
 ASSI { 1104}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 142  and name HN  ))
      3.000     1.100     1.100 peak  1104 spectrum    1 weight  0.10000E+01 volume  0.17056E-02 ppm1      9.968 ppm2      9.369 CV     1
 ASSI { 1107}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 144  and name HN  ))
      3.600     1.600     1.600 peak  1107 spectrum    1 weight  0.10000E+01 volume  0.20716E-02 ppm1      9.969 ppm2      8.436 CV     1
 ASSI { 1111}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 113  and name HA  ))
      3.200     3.200     2.800 peak  1111 spectrum    1 weight  0.10000E+01 volume  0.21594E-02 ppm1      9.964 ppm2      5.516 CV     1
 ASSI { 1112}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 112  and name HA  ))
      2.800     0.900     0.900 peak  1112 spectrum    1 weight  0.10000E+01 volume  0.17275E-02 ppm1      9.967 ppm2      5.178 CV     1
 ASSI { 1113}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 142  and name HA  ))
      3.200     3.200     2.800 peak  1113 spectrum    1 weight  0.10000E+01 volume  0.22620E-02 ppm1      9.960 ppm2      5.061 CV     1
 ASSI { 1115}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 110  and name HA  ))
      1.800     1.800     4.200 peak  1115 spectrum    1 weight  0.10000E+01 volume  0.24816E-02 ppm1      9.971 ppm2      4.581 CV     1
 ASSI { 1116}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 49   and name HA  ))
      3.700     1.700     1.700 peak  1116 spectrum    1 weight  0.10000E+01 volume  0.23498E-02 ppm1      9.967 ppm2      3.944 CV     1
 ASSI { 1117}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 111  and name HB  ))
      3.500     1.500     1.500 peak  1117 spectrum    1 weight  0.10000E+01 volume  0.21667E-02 ppm1      9.971 ppm2      3.768 CV     1
 ASSI { 1118}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 110  and name HG2 ))
      3.000     1.200     1.200 peak  1118 spectrum    1 weight  0.10000E+01 volume  0.24084E-02 ppm1      9.975 ppm2      2.693 CV     1
 OR { 1118}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 110  and name HG1 ))
 ASSI { 1120}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 106  and name HB1 ))
      3.600     3.600     2.400 peak  1120 spectrum    1 weight  0.10000E+01 volume  0.22839E-02 ppm1      9.965 ppm2      2.155 CV     1
 ASSI { 1121}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 142  and name HB  ))
      3.500     1.600     1.600 peak  1121 spectrum    1 weight  0.10000E+01 volume  0.15811E-02 ppm1      9.967 ppm2      1.953 CV     1
 ASSI { 1122}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 50   and name HG  ))
      3.500     1.500     1.500 peak  1122 spectrum    1 weight  0.10000E+01 volume  0.20862E-02 ppm1      9.967 ppm2      1.620 CV     1
 ASSI { 1125}
   (( segid "    " and resid 112  and name HN  ))
   (  segid "    " and resid 50   and name HD2%)
      4.200     2.200     1.800 peak  1125 spectrum    1 weight  0.10000E+01 volume  0.17569E-02 ppm1      9.966 ppm2      0.745 CV     1
 ASSI { 1128}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 112  and name HN  ))
      3.300     1.400     1.400 peak  1128 spectrum    1 weight  0.10000E+01 volume  0.23790E-02 ppm1      9.107 ppm2      9.960 CV     1
 ASSI { 1131}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 142  and name HN  ))
      3.400     1.500     1.500 peak  1131 spectrum    1 weight  0.10000E+01 volume  0.22693E-02 ppm1      9.104 ppm2      9.408 CV     1
 ASSI { 1135}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 47   and name HA  ))
      3.400     1.500     1.500 peak  1135 spectrum    1 weight  0.10000E+01 volume  0.21448E-02 ppm1      9.108 ppm2      5.920 CV     1
 ASSI { 1136}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 113  and name HA  ))
      2.700     0.900     0.900 peak  1136 spectrum    1 weight  0.10000E+01 volume  0.17569E-02 ppm1      9.103 ppm2      5.505 CV     1
 ASSI { 1141}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 49   and name HA  ))
      3.900     1.900     1.900 peak  1141 spectrum    1 weight  0.10000E+01 volume  0.18520E-02 ppm1      9.104 ppm2      3.954 CV     1
 ASSI { 1142}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 113  and name HG1 ))
      3.800     1.800     1.800 peak  1142 spectrum    1 weight  0.10000E+01 volume  0.21375E-02 ppm1      9.102 ppm2      2.646 CV     1
 ASSI { 1143}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 113  and name HG2 ))
      3.500     1.500     1.500 peak  1143 spectrum    1 weight  0.10000E+01 volume  0.21888E-02 ppm1      9.109 ppm2      2.530 CV     1
 ASSI { 1148}
   (( segid "    " and resid 113  and name HN  ))
   (  segid "    " and resid 114  and name HG2%)
      3.300     1.400     1.400 peak  1148 spectrum    1 weight  0.10000E+01 volume  0.20862E-02 ppm1      9.106 ppm2      0.912 CV     1
 OR { 1148}
   (( segid "    " and resid 113  and name HN  ))
   (  segid "    " and resid 114  and name HG1%)
 ASSI { 1149}
   (( segid "    " and resid 113  and name HN  ))
   (  segid "    " and resid 50   and name HD1%)
      3.200     1.300     1.300 peak  1149 spectrum    1 weight  0.10000E+01 volume  0.18080E-02 ppm1      9.103 ppm2      0.824 CV     1
 ASSI { 1151}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 48   and name HN  ))
      3.300     1.300     1.300 peak  1151 spectrum    1 weight  0.10000E+01 volume  0.21156E-02 ppm1      9.711 ppm2      9.574 CV     1
 ASSI { 1152}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 115  and name HN  ))
      3.400     1.500     1.500 peak  1152 spectrum    1 weight  0.10000E+01 volume  0.21741E-02 ppm1      9.710 ppm2      9.289 CV     1
 ASSI { 1153}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 113  and name HN  ))
      3.400     1.400     1.400 peak  1153 spectrum    1 weight  0.10000E+01 volume  0.20057E-02 ppm1      9.714 ppm2      9.112 CV     1
 ASSI { 1157}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 47   and name HA  ))
      3.500     1.500     1.500 peak  1157 spectrum    1 weight  0.10000E+01 volume  0.24303E-02 ppm1      9.713 ppm2      5.921 CV     1
 ASSI { 1159}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 114  and name HA  ))
      2.700     0.900     0.900 peak  1159 spectrum    1 weight  0.10000E+01 volume  0.17861E-02 ppm1      9.710 ppm2      5.574 CV     1
 ASSI { 1160}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 141  and name HA  ))
      3.500     1.500     1.500 peak  1160 spectrum    1 weight  0.10000E+01 volume  0.17861E-02 ppm1      9.713 ppm2      5.222 CV     1
 ASSI { 1162}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 113  and name HG1 ))
      2.900     1.100     1.100 peak  1162 spectrum    1 weight  0.10000E+01 volume  0.18666E-02 ppm1      9.714 ppm2      2.651 CV     1
 ASSI { 1163}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 113  and name HG2 ))
      3.500     1.500     1.500 peak  1163 spectrum    1 weight  0.10000E+01 volume  0.17348E-02 ppm1      9.713 ppm2      2.514 CV     1
 ASSI { 1165}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 113  and name HB2 ))
      3.900     1.900     1.900 peak  1165 spectrum    1 weight  0.10000E+01 volume  0.16470E-02 ppm1      9.710 ppm2      1.903 CV     1
 ASSI { 1166}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 140  and name HG  ))
      2.800     1.000     1.000 peak  1166 spectrum    1 weight  0.10000E+01 volume  0.21448E-02 ppm1      9.712 ppm2      1.620 CV     1
 ASSI { 1167}
   (( segid "    " and resid 114  and name HN  ))
   (  segid "    " and resid 112  and name HB% )
      3.400     1.400     1.400 peak  1167 spectrum    1 weight  0.10000E+01 volume  0.22180E-02 ppm1      9.710 ppm2      1.561 CV     1
 ASSI { 1168}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 140  and name HB2 ))
      3.300     1.400     1.400 peak  1168 spectrum    1 weight  0.10000E+01 volume  0.19325E-02 ppm1      9.710 ppm2      1.285 CV     1
 ASSI { 1169}
   (( segid "    " and resid 114  and name HN  ))
   (  segid "    " and resid 114  and name HG2%)
      2.900     1.000     1.000 peak  1169 spectrum    1 weight  0.10000E+01 volume  0.15519E-02 ppm1      9.712 ppm2      0.902 CV     1
 ASSI { 1170}
   (( segid "    " and resid 114  and name HN  ))
   (  segid "    " and resid 140  and name HD2%)
      3.800     1.800     1.800 peak  1170 spectrum    1 weight  0.10000E+01 volume  0.19106E-02 ppm1      9.706 ppm2      0.704 CV     1
 ASSI { 1171}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 140  and name HN  ))
      3.200     3.200     2.800 peak  1171 spectrum    1 weight  0.10000E+01 volume  0.22693E-02 ppm1      9.298 ppm2      9.911 CV     1
 ASSI { 1178}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 36   and name HE3 ))
      3.200     1.300     1.300 peak  1178 spectrum    1 weight  0.10000E+01 volume  0.21667E-02 ppm1      9.290 ppm2      7.201 CV     1
 ASSI { 1179}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 36   and name HZ3 ))
      2.100     0.600     0.600 peak  1179 spectrum    1 weight  0.10000E+01 volume  0.16837E-02 ppm1      9.294 ppm2      6.999 CV     1
 OR { 1179}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 36   and name HH2 ))
 ASSI { 1181}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 47   and name HA  ))
      3.800     1.800     1.800 peak  1181 spectrum    1 weight  0.10000E+01 volume  0.16910E-02 ppm1      9.294 ppm2      5.927 CV     1
 ASSI { 1184}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 116  and name HA  ))
      3.100     3.100     2.900 peak  1184 spectrum    1 weight  0.10000E+01 volume  0.22034E-02 ppm1      9.294 ppm2      5.376 CV     1
 ASSI { 1185}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 115  and name HA  ))
      2.600     0.900     0.900 peak  1185 spectrum    1 weight  0.10000E+01 volume  0.19984E-02 ppm1      9.294 ppm2      5.118 CV     1
 ASSI { 1188}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 115  and name HB  ))
      2.700     0.900     0.900 peak  1188 spectrum    1 weight  0.10000E+01 volume  0.17861E-02 ppm1      9.296 ppm2      4.113 CV     1
 ASSI { 1189}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 113  and name HG1 ))
      3.800     1.800     1.800 peak  1189 spectrum    1 weight  0.10000E+01 volume  0.22034E-02 ppm1      9.288 ppm2      2.637 CV     1
 ASSI { 1190}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 114  and name HB  ))
      3.400     1.400     1.400 peak  1190 spectrum    1 weight  0.10000E+01 volume  0.19106E-02 ppm1      9.294 ppm2      2.023 CV     1
 ASSI { 1191}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 46   and name HB2 ))
      3.200     1.300     1.300 peak  1191 spectrum    1 weight  0.10000E+01 volume  0.18007E-02 ppm1      9.294 ppm2      1.763 CV     1
 OR { 1191}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 46   and name HB1 ))
 ASSI { 1192}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 46   and name HG2 ))
      1.800     1.800     4.200 peak  1192 spectrum    1 weight  0.10000E+01 volume  0.19984E-02 ppm1      9.290 ppm2      1.340 CV     1
 ASSI { 1194}
   (( segid "    " and resid 115  and name HN  ))
   (  segid "    " and resid 114  and name HG2%)
      4.100     2.100     1.900 peak  1194 spectrum    1 weight  0.10000E+01 volume  0.15006E-02 ppm1      9.294 ppm2      0.858 CV     1
 ASSI { 1195}
   (( segid "    " and resid 115  and name HN  ))
   (  segid "    " and resid 45   and name HD1%)
      3.300     1.300     1.300 peak  1195 spectrum    1 weight  0.10000E+01 volume  0.21156E-02 ppm1      9.291 ppm2      0.776 CV     1
 ASSI { 1199}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 114  and name HN  ))
      3.500     3.500     2.500 peak  1199 spectrum    1 weight  0.10000E+01 volume  0.22693E-02 ppm1      8.635 ppm2      9.687 CV     1
 ASSI { 1200}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 115  and name HN  ))
      3.000     1.200     1.200 peak  1200 spectrum    1 weight  0.10000E+01 volume  0.27231E-02 ppm1      8.641 ppm2      9.318 CV     1
 ASSI { 1201}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 138  and name HN  ))
      3.000     1.100     1.100 peak  1201 spectrum    1 weight  0.10000E+01 volume  0.16543E-02 ppm1      8.643 ppm2      8.266 CV     1
 ASSI { 1202}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 117  and name HN  ))
      3.500     1.500     1.500 peak  1202 spectrum    1 weight  0.10000E+01 volume  0.18739E-02 ppm1      8.637 ppm2      8.164 CV     1
 ASSI { 1203}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 36   and name HH2 ))
      3.500     3.500     2.500 peak  1203 spectrum    1 weight  0.10000E+01 volume  0.23571E-02 ppm1      8.648 ppm2      7.016 CV     1
 ASSI { 1204}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 138  and name HA  ))
      3.400     1.500     1.500 peak  1204 spectrum    1 weight  0.10000E+01 volume  0.15958E-02 ppm1      8.641 ppm2      5.208 CV     1
 ASSI { 1206}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 116  and name HA  ))
      2.900     1.000     1.000 peak  1206 spectrum    1 weight  0.10000E+01 volume  0.16543E-02 ppm1      8.640 ppm2      5.334 CV     1
 ASSI { 1207}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 137  and name HA  ))
      3.300     3.300     2.700 peak  1207 spectrum    1 weight  0.10000E+01 volume  0.22399E-02 ppm1      8.638 ppm2      4.644 CV     1
 ASSI { 1208}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 115  and name HB  ))
      3.900     1.900     1.900 peak  1208 spectrum    1 weight  0.10000E+01 volume  0.15738E-02 ppm1      8.641 ppm2      4.115 CV     1
 ASSI { 1210}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 138  and name HB1 ))
      2.900     1.000     1.000 peak  1210 spectrum    1 weight  0.10000E+01 volume  0.20276E-02 ppm1      8.642 ppm2      1.878 CV     1
 ASSI { 1211}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 138  and name HB2 ))
      3.200     1.300     1.300 peak  1211 spectrum    1 weight  0.10000E+01 volume  0.20350E-02 ppm1      8.640 ppm2      1.384 CV     1
 ASSI { 1212}
   (( segid "    " and resid 116  and name HN  ))
   (  segid "    " and resid 115  and name HG2%)
      3.400     1.400     1.400 peak  1212 spectrum    1 weight  0.10000E+01 volume  0.18155E-02 ppm1      8.639 ppm2      1.162 CV     1
 ASSI { 1213}
   (( segid "    " and resid 116  and name HN  ))
   (  segid "    " and resid 138  and name HD2%)
      3.600     1.600     1.600 peak  1213 spectrum    1 weight  0.10000E+01 volume  0.18374E-02 ppm1      8.643 ppm2      0.851 CV     1
 ASSI { 1215}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 119  and name HN  ))
      4.200     2.200     1.800 peak  1215 spectrum    1 weight  0.10000E+01 volume  0.21082E-02 ppm1      8.162 ppm2      9.138 CV     1
 ASSI { 1217}
   (( segid "    " and resid 117  and name HN  ))
   (  segid "    " and resid 120  and name HD% )
      2.900     1.000     1.000 peak  1217 spectrum    1 weight  0.10000E+01 volume  0.21521E-02 ppm1      8.159 ppm2      6.908 CV     1
 ASSI { 1219}
   (( segid "    " and resid 117  and name HN  ))
   (  segid "    " and resid 120  and name HE% )
      3.900     1.900     1.900 peak  1219 spectrum    1 weight  0.10000E+01 volume  0.19471E-02 ppm1      8.156 ppm2      6.691 CV     1
 ASSI { 1221}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 115  and name HA  ))
      4.000     2.000     2.000 peak  1221 spectrum    1 weight  0.10000E+01 volume  0.16690E-02 ppm1      8.163 ppm2      5.088 CV     1
 ASSI { 1222}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 45   and name HA  ))
      3.400     1.400     1.400 peak  1222 spectrum    1 weight  0.10000E+01 volume  0.23717E-02 ppm1      8.166 ppm2      5.237 CV     1
 ASSI { 1233}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 137  and name HN  ))
      3.200     1.300     1.300 peak  1233 spectrum    1 weight  0.10000E+01 volume  0.20570E-02 ppm1      8.611 ppm2      8.388 CV     1
 ASSI { 1234}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 138  and name HN  ))
      3.400     1.400     1.400 peak  1234 spectrum    1 weight  0.10000E+01 volume  0.22326E-02 ppm1      8.620 ppm2      8.267 CV     1
 ASSI { 1235}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 117  and name HN  ))
      3.600     1.600     1.600 peak  1235 spectrum    1 weight  0.10000E+01 volume  0.22399E-02 ppm1      8.612 ppm2      8.158 CV     1
 ASSI { 1236}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 120  and name HN  ))
      3.200     1.300     1.300 peak  1236 spectrum    1 weight  0.10000E+01 volume  0.21375E-02 ppm1      8.608 ppm2      7.587 CV     1
 ASSI { 1237}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 136  and name HN  ))
      3.300     1.300     1.300 peak  1237 spectrum    1 weight  0.10000E+01 volume  0.23717E-02 ppm1      8.616 ppm2      7.414 CV     1
 ASSI { 1238}
   (( segid "    " and resid 118  and name HN  ))
   (  segid "    " and resid 120  and name HD% )
      3.800     1.800     1.800 peak  1238 spectrum    1 weight  0.10000E+01 volume  0.24376E-02 ppm1      8.613 ppm2      6.912 CV     1
 ASSI { 1242}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 137  and name HA  ))
      3.300     1.400     1.400 peak  1242 spectrum    1 weight  0.10000E+01 volume  0.17056E-02 ppm1      8.616 ppm2      4.628 CV     1
 ASSI { 1252}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 119  and name HD2 ))
      4.100     2.100     1.900 peak  1252 spectrum    1 weight  0.10000E+01 volume  0.21229E-02 ppm1      8.619 ppm2      1.348 CV     1
 ASSI { 1254}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 123  and name HN  ))
      2.900     1.000     1.000 peak  1254 spectrum    1 weight  0.10000E+01 volume  0.25181E-02 ppm1      9.138 ppm2      8.020 CV     1
 ASSI { 1255}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 121  and name HN  ))
      3.200     1.200     1.200 peak  1255 spectrum    1 weight  0.10000E+01 volume  0.18739E-02 ppm1      9.139 ppm2      7.724 CV     1
 ASSI { 1260}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 119  and name HA  ))
      2.900     1.100     1.100 peak  1260 spectrum    1 weight  0.10000E+01 volume  0.13469E-02 ppm1      9.139 ppm2      3.956 CV     1
 ASSI { 1262}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 118  and name HB1 ))
      2.600     0.900     0.900 peak  1262 spectrum    1 weight  0.10000E+01 volume  0.18739E-02 ppm1      9.139 ppm2      3.567 CV     1
 ASSI { 1263}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 118  and name HB2 ))
      3.200     1.300     1.300 peak  1263 spectrum    1 weight  0.10000E+01 volume  0.19252E-02 ppm1      9.143 ppm2      3.510 CV     1
 ASSI { 1265}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 117  and name HB1 ))
      2.700     0.900     0.900 peak  1265 spectrum    1 weight  0.10000E+01 volume  0.18739E-02 ppm1      9.143 ppm2      2.969 CV     1
 ASSI { 1266}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 119  and name HE2 ))
      3.200     1.300     1.300 peak  1266 spectrum    1 weight  0.10000E+01 volume  0.16690E-02 ppm1      9.142 ppm2      2.745 CV     1
 ASSI { 1269}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 119  and name HD1 ))
      4.000     2.000     2.000 peak  1269 spectrum    1 weight  0.10000E+01 volume  0.21961E-02 ppm1      9.141 ppm2      1.461 CV     1
 ASSI { 1270}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 119  and name HD2 ))
      4.000     2.000     2.000 peak  1270 spectrum    1 weight  0.10000E+01 volume  0.19106E-02 ppm1      9.137 ppm2      1.369 CV     1
 ASSI { 1273}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 119  and name HG1 ))
      3.500     1.500     1.500 peak  1273 spectrum    1 weight  0.10000E+01 volume  0.19471E-02 ppm1      9.140 ppm2      0.902 CV     1
 ASSI { 1274}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 119  and name HG2 ))
      2.100     0.500     0.500 peak  1274 spectrum    1 weight  0.10000E+01 volume  0.18155E-02 ppm1      9.138 ppm2      0.591 CV     1
 ASSI { 1278}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 117  and name HN  ))
      3.200     1.300     1.300 peak  1278 spectrum    1 weight  0.10000E+01 volume  0.21302E-02 ppm1      7.591 ppm2      8.161 CV     1
 ASSI { 1279}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 123  and name HN  ))
      3.300     3.300     2.700 peak  1279 spectrum    1 weight  0.10000E+01 volume  0.22034E-02 ppm1      7.595 ppm2      8.021 CV     1
 ASSI { 1285}
   (( segid "    " and resid 120  and name HN  ))
   (  segid "    " and resid 120  and name HE% )
      3.900     1.900     1.900 peak  1285 spectrum    1 weight  0.10000E+01 volume  0.20130E-02 ppm1      7.596 ppm2      6.675 CV     1
 ASSI { 1287}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 116  and name HA  ))
      3.700     1.700     1.700 peak  1287 spectrum    1 weight  0.10000E+01 volume  0.22034E-02 ppm1      7.584 ppm2      5.365 CV     1
 ASSI { 1289}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 121  and name HA  ))
      3.500     1.500     1.500 peak  1289 spectrum    1 weight  0.10000E+01 volume  0.20424E-02 ppm1      7.596 ppm2      4.461 CV     1
 ASSI { 1290}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 120  and name HB1 ))
      3.500     1.500     1.500 peak  1290 spectrum    1 weight  0.10000E+01 volume  0.22034E-02 ppm1      7.591 ppm2      3.262 CV     1
 ASSI { 1292}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 117  and name HB1 ))
      3.100     1.200     1.200 peak  1292 spectrum    1 weight  0.10000E+01 volume  0.22253E-02 ppm1      7.595 ppm2      2.992 CV     1
 ASSI { 1295}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 119  and name HB1 ))
      3.600     1.600     1.600 peak  1295 spectrum    1 weight  0.10000E+01 volume  0.19544E-02 ppm1      7.597 ppm2      1.636 CV     1
 ASSI { 1296}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 119  and name HD2 ))
      3.800     1.800     1.800 peak  1296 spectrum    1 weight  0.10000E+01 volume  0.21009E-02 ppm1      7.591 ppm2      1.359 CV     1
 ASSI { 1297}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 119  and name HB2 ))
      3.400     1.500     1.500 peak  1297 spectrum    1 weight  0.10000E+01 volume  0.17422E-02 ppm1      7.593 ppm2      1.241 CV     1
 ASSI { 1298}
   (( segid "    " and resid 120  and name HN  ))
   (  segid "    " and resid 116  and name HB% )
      3.700     1.700     1.700 peak  1298 spectrum    1 weight  0.10000E+01 volume  0.18960E-02 ppm1      7.595 ppm2      1.112 CV     1
 ASSI { 1299}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 119  and name HG1 ))
      2.600     0.800     0.800 peak  1299 spectrum    1 weight  0.10000E+01 volume  0.22473E-02 ppm1      7.595 ppm2      0.907 CV     1
 ASSI { 1300}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 119  and name HG2 ))
      2.500     0.800     0.800 peak  1300 spectrum    1 weight  0.10000E+01 volume  0.19911E-02 ppm1      7.597 ppm2      0.586 CV     1
 ASSI { 1304}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 98   and name HN  ))
      3.300     3.300     2.700 peak  1304 spectrum    1 weight  0.10000E+01 volume  0.23717E-02 ppm1      7.722 ppm2      8.979 CV     1
 ASSI { 1311}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 120  and name HA  ))
      3.100     1.200     1.200 peak  1311 spectrum    1 weight  0.10000E+01 volume  0.17422E-02 ppm1      7.719 ppm2      4.694 CV     1
 ASSI { 1313}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 123  and name HA1 ))
      3.400     3.400     2.600 peak  1313 spectrum    1 weight  0.10000E+01 volume  0.21961E-02 ppm1      7.730 ppm2      4.156 CV     1
 ASSI { 1315}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 118  and name HB2 ))
      3.700     3.700     2.300 peak  1315 spectrum    1 weight  0.10000E+01 volume  0.20276E-02 ppm1      7.719 ppm2      3.494 CV     1
 ASSI { 1318}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 121  and name HB2 ))
      2.900     1.000     1.000 peak  1318 spectrum    1 weight  0.10000E+01 volume  0.17056E-02 ppm1      7.720 ppm2      2.645 CV     1
 ASSI { 1319}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 120  and name HB2 ))
      3.300     1.300     1.300 peak  1319 spectrum    1 weight  0.10000E+01 volume  0.18007E-02 ppm1      7.726 ppm2      2.549 CV     1
 ASSI { 1321}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 119  and name HB2 ))
      3.500     1.500     1.500 peak  1321 spectrum    1 weight  0.10000E+01 volume  0.22473E-02 ppm1      7.726 ppm2      1.249 CV     1
 ASSI { 1322}
   (( segid "    " and resid 121  and name HN  ))
   (  segid "    " and resid 96   and name HD1%)
      3.600     1.600     1.600 peak  1322 spectrum    1 weight  0.10000E+01 volume  0.22473E-02 ppm1      7.734 ppm2      0.806 CV     1
 ASSI { 1324}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 138  and name HN  ))
      3.800     3.800     2.200 peak  1324 spectrum    1 weight  0.10000E+01 volume  0.24522E-02 ppm1      9.381 ppm2      8.254 CV     1
 ASSI { 1326}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 121  and name HN  ))
      3.000     1.100     1.100 peak  1326 spectrum    1 weight  0.10000E+01 volume  0.19984E-02 ppm1      9.377 ppm2      7.730 CV     1
 ASSI { 1327}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 125  and name HE21))
      3.100     1.200     1.200 peak  1327 spectrum    1 weight  0.10000E+01 volume  0.23571E-02 ppm1      9.373 ppm2      7.526 CV     1
 ASSI { 1328}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 136  and name HN  ))
      4.100     2.100     1.900 peak  1328 spectrum    1 weight  0.10000E+01 volume  0.23717E-02 ppm1      9.383 ppm2      7.405 CV     1
 ASSI { 1330}
   (( segid "    " and resid 122  and name HN  ))
   (  segid "    " and resid 122  and name HD% )
      3.000     1.100     1.100 peak  1330 spectrum    1 weight  0.10000E+01 volume  0.17422E-02 ppm1      9.379 ppm2      7.089 CV     1
 ASSI { 1332}
   (( segid "    " and resid 122  and name HN  ))
   (  segid "    " and resid 122  and name HE% )
      3.700     1.700     1.700 peak  1332 spectrum    1 weight  0.10000E+01 volume  0.22180E-02 ppm1      9.388 ppm2      6.616 CV     1
 ASSI { 1334}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 122  and name HA  ))
      2.800     1.000     1.000 peak  1334 spectrum    1 weight  0.10000E+01 volume  0.18007E-02 ppm1      9.381 ppm2      4.495 CV     1
 ASSI { 1337}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 122  and name HB1 ))
      3.400     1.500     1.500 peak  1337 spectrum    1 weight  0.10000E+01 volume  0.19984E-02 ppm1      9.374 ppm2      3.058 CV     1
 ASSI { 1338}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 121  and name HB2 ))
      2.700     0.900     0.900 peak  1338 spectrum    1 weight  0.10000E+01 volume  0.20057E-02 ppm1      9.379 ppm2      2.645 CV     1
 ASSI { 1339}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 96   and name HB  ))
      3.700     3.700     2.300 peak  1339 spectrum    1 weight  0.10000E+01 volume  0.23790E-02 ppm1      9.378 ppm2      2.122 CV     1
 ASSI { 1340}
   (( segid "    " and resid 122  and name HN  ))
   (  segid "    " and resid 136  and name HB% )
      3.500     3.500     2.500 peak  1340 spectrum    1 weight  0.10000E+01 volume  0.24449E-02 ppm1      9.374 ppm2      1.230 CV     1
 ASSI { 1343}
   (( segid "    " and resid 122  and name HN  ))
   (  segid "    " and resid 96   and name HG2%)
      3.600     1.700     1.700 peak  1343 spectrum    1 weight  0.10000E+01 volume  0.24230E-02 ppm1      9.385 ppm2      0.230 CV     1
 ASSI { 1346}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 118  and name HN  ))
      3.700     1.700     1.700 peak  1346 spectrum    1 weight  0.10000E+01 volume  0.21594E-02 ppm1      7.987 ppm2      8.628 CV     1
 ASSI { 1350}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 134  and name HA  ))
      4.000     2.000     2.000 peak  1350 spectrum    1 weight  0.10000E+01 volume  0.23132E-02 ppm1      7.994 ppm2      4.358 CV     1
 ASSI { 1351}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 123  and name HA1 ))
      2.500     0.800     0.800 peak  1351 spectrum    1 weight  0.10000E+01 volume  0.21521E-02 ppm1      7.988 ppm2      4.147 CV     1
 ASSI { 1352}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 135  and name HA  ))
      3.800     1.800     1.800 peak  1352 spectrum    1 weight  0.10000E+01 volume  0.15738E-02 ppm1      7.988 ppm2      3.850 CV     1
 ASSI { 1354}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 122  and name HB1 ))
      3.600     1.600     1.600 peak  1354 spectrum    1 weight  0.10000E+01 volume  0.20862E-02 ppm1      7.988 ppm2      3.055 CV     1
 ASSI { 1358}
   (( segid "    " and resid 123  and name HN  ))
   (  segid "    " and resid 132  and name HG2%)
      3.500     3.500     2.500 peak  1358 spectrum    1 weight  0.10000E+01 volume  0.21302E-02 ppm1      7.987 ppm2      0.944 CV     1
 OR { 1358}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 132  and name HG11))
 ASSI { 1362}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 123  and name HN  ))
      2.900     1.000     1.000 peak  1362 spectrum    1 weight  0.10000E+01 volume  0.22034E-02 ppm1      8.075 ppm2      8.019 CV     1
 ASSI { 1369}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 124  and name HD1 ))
      3.100     1.200     1.200 peak  1369 spectrum    1 weight  0.10000E+01 volume  0.19692E-02 ppm1      8.074 ppm2      3.926 CV     1
 OR { 1369}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 124  and name HA  ))
 ASSI { 1370}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 124  and name HD2 ))
      2.800     1.000     1.000 peak  1370 spectrum    1 weight  0.10000E+01 volume  0.16105E-02 ppm1      8.076 ppm2      3.559 CV     1
 ASSI { 1371}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 122  and name HB2 ))
      3.800     1.800     1.800 peak  1371 spectrum    1 weight  0.10000E+01 volume  0.21448E-02 ppm1      8.074 ppm2      2.668 CV     1
 ASSI { 1372}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 125  and name HG1 ))
      2.700     0.900     0.900 peak  1372 spectrum    1 weight  0.10000E+01 volume  0.17642E-02 ppm1      8.075 ppm2      2.537 CV     1
 ASSI { 1376}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 124  and name HB2 ))
      3.200     1.300     1.300 peak  1376 spectrum    1 weight  0.10000E+01 volume  0.17715E-02 ppm1      8.075 ppm2      1.895 CV     1
 OR { 1376}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 124  and name HG2 ))
 ASSI { 1377}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 127  and name HN  ))
      3.800     1.800     1.800 peak  1377 spectrum    1 weight  0.10000E+01 volume  0.18374E-02 ppm1      7.064 ppm2      8.493 CV     1
 ASSI { 1380}
   (( segid "    " and resid 126  and name HN  ))
   (  segid "    " and resid 131  and name HD% )
      3.400     3.400     2.600 peak  1380 spectrum    1 weight  0.10000E+01 volume  0.21009E-02 ppm1      7.060 ppm2      7.232 CV     1
 ASSI { 1381}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 125  and name HE22))
      1.800     1.800     4.200 peak  1381 spectrum    1 weight  0.10000E+01 volume  0.21521E-02 ppm1      7.060 ppm2      6.894 CV     1
 ASSI { 1383}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 125  and name HA  ))
      3.400     1.400     1.400 peak  1383 spectrum    1 weight  0.10000E+01 volume  0.17496E-02 ppm1      7.065 ppm2      4.139 CV     1
 ASSI { 1386}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 122  and name HB1 ))
      2.900     1.000     1.000 peak  1386 spectrum    1 weight  0.10000E+01 volume  0.19471E-02 ppm1      7.068 ppm2      3.063 CV     1
 ASSI { 1387}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 122  and name HB2 ))
      3.300     1.300     1.300 peak  1387 spectrum    1 weight  0.10000E+01 volume  0.15958E-02 ppm1      7.063 ppm2      2.677 CV     1
 ASSI { 1388}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 125  and name HG1 ))
      3.400     1.400     1.400 peak  1388 spectrum    1 weight  0.10000E+01 volume  0.18886E-02 ppm1      7.063 ppm2      2.559 CV     1
 ASSI { 1389}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 125  and name HG2 ))
      4.000     2.000     2.000 peak  1389 spectrum    1 weight  0.10000E+01 volume  0.19911E-02 ppm1      7.057 ppm2      2.383 CV     1
 ASSI { 1391}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 125  and name HB2 ))
      3.000     1.100     1.100 peak  1391 spectrum    1 weight  0.10000E+01 volume  0.17275E-02 ppm1      7.066 ppm2      2.116 CV     1
 ASSI { 1392}
   (( segid "    " and resid 126  and name HN  ))
   (  segid "    " and resid 132  and name HG2%)
      3.700     1.700     1.700 peak  1392 spectrum    1 weight  0.10000E+01 volume  0.22839E-02 ppm1      7.070 ppm2      0.944 CV     1
 OR { 1392}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 132  and name HG11))
 ASSI { 1393}
   (( segid "    " and resid 126  and name HN  ))
   (  segid "    " and resid 132  and name HD1%)
      3.800     3.800     2.200 peak  1393 spectrum    1 weight  0.10000E+01 volume  0.24522E-02 ppm1      7.074 ppm2      0.508 CV     1
 ASSI { 1397}
   (( segid "    " and resid 127  and name HN  ))
   (( segid "    " and resid 122  and name HN  ))
      3.500     3.500     2.500 peak  1397 spectrum    1 weight  0.10000E+01 volume  0.24010E-02 ppm1      8.489 ppm2      9.429 CV     1
 ASSI { 1406}
   (( segid "    " and resid 127  and name HN  ))
   (( segid "    " and resid 130  and name HA  ))
      3.600     1.600     1.600 peak  1406 spectrum    1 weight  0.10000E+01 volume  0.19692E-02 ppm1      8.488 ppm2      4.721 CV     1
 ASSI { 1408}
   (( segid "    " and resid 127  and name HN  ))
   (( segid "    " and resid 132  and name HA  ))
      3.700     1.700     1.700 peak  1408 spectrum    1 weight  0.10000E+01 volume  0.20276E-02 ppm1      8.486 ppm2      4.080 CV     1
 ASSI { 1411}
   (( segid "    " and resid 127  and name HN  ))
   (( segid "    " and resid 130  and name HD2 ))
      3.100     1.200     1.200 peak  1411 spectrum    1 weight  0.10000E+01 volume  0.20570E-02 ppm1      8.487 ppm2      3.425 CV     1
 ASSI { 1412}
   (( segid "    " and resid 127  and name HN  ))
   (( segid "    " and resid 131  and name HB1 ))
      4.600     2.600     1.400 peak  1412 spectrum    1 weight  0.10000E+01 volume  0.15592E-02 ppm1      8.488 ppm2      2.996 CV     1
 ASSI { 1415}
   (( segid "    " and resid 127  and name HN  ))
   (( segid "    " and resid 132  and name HG11))
      3.400     1.400     1.400 peak  1415 spectrum    1 weight  0.10000E+01 volume  0.18228E-02 ppm1      8.486 ppm2      1.008 CV     1
 ASSI { 1418}
   (( segid "    " and resid 127  and name HN  ))
   (  segid "    " and resid 132  and name HD1%)
      3.300     1.400     1.400 peak  1418 spectrum    1 weight  0.10000E+01 volume  0.20203E-02 ppm1      8.495 ppm2      0.441 CV     1
 ASSI { 1426}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 127  and name HN  ))
      3.700     1.700     1.700 peak  1426 spectrum    1 weight  0.10000E+01 volume  0.22985E-02 ppm1      8.657 ppm2      8.553 CV     1
 ASSI { 1427}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 77   and name HN  ))
      3.300     1.400     1.400 peak  1427 spectrum    1 weight  0.10000E+01 volume  0.22399E-02 ppm1      8.647 ppm2      8.208 CV     1
 ASSI { 1428}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 132  and name HN  ))
      3.700     1.700     1.700 peak  1428 spectrum    1 weight  0.10000E+01 volume  0.19544E-02 ppm1      8.655 ppm2      7.855 CV     1
 ASSI { 1429}
   (( segid "    " and resid 131  and name HN  ))
   (  segid "    " and resid 131  and name HD% )
      3.900     1.900     1.900 peak  1429 spectrum    1 weight  0.10000E+01 volume  0.21667E-02 ppm1      8.658 ppm2      7.162 CV     1
 ASSI { 1434}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 130  and name HB1 ))
      4.200     2.200     1.800 peak  1434 spectrum    1 weight  0.10000E+01 volume  0.17056E-02 ppm1      8.660 ppm2      2.332 CV     1
 ASSI { 1435}
   (( segid "    " and resid 75   and name HN  ))
   (  segid "    " and resid 137  and name HB% )
      3.900     1.900     1.900 peak  1435 spectrum    1 weight  0.10000E+01 volume  0.21156E-02 ppm1      8.659 ppm2      1.449 CV     1
 ASSI { 1442}
   (( segid "    " and resid 132  and name HN  ))
   (  segid "    " and resid 131  and name HD% )
      3.100     1.200     1.200 peak  1442 spectrum    1 weight  0.10000E+01 volume  0.21448E-02 ppm1      7.854 ppm2      7.181 CV     1
 ASSI { 1445}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 130  and name HA  ))
      1.800     1.800     4.200 peak  1445 spectrum    1 weight  0.10000E+01 volume  0.21521E-02 ppm1      7.854 ppm2      4.771 CV     1
 ASSI { 1449}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 132  and name HA  ))
      2.600     0.900     0.900 peak  1449 spectrum    1 weight  0.10000E+01 volume  0.18374E-02 ppm1      7.854 ppm2      4.094 CV     1
 ASSI { 1451}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 126  and name HA2 ))
      2.500     0.800     0.800 peak  1451 spectrum    1 weight  0.10000E+01 volume  0.23278E-02 ppm1      7.850 ppm2      3.487 CV     1
 ASSI { 1452}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 130  and name HD2 ))
      3.200     1.300     1.300 peak  1452 spectrum    1 weight  0.10000E+01 volume  0.22912E-02 ppm1      7.855 ppm2      3.379 CV     1
 ASSI { 1453}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 131  and name HB1 ))
      4.200     2.200     1.800 peak  1453 spectrum    1 weight  0.10000E+01 volume  0.16105E-02 ppm1      7.857 ppm2      2.990 CV     1
 ASSI { 1454}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 131  and name HB2 ))
      4.100     2.100     1.900 peak  1454 spectrum    1 weight  0.10000E+01 volume  0.19252E-02 ppm1      7.856 ppm2      2.799 CV     1
 ASSI { 1455}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 127  and name HB2 ))
      3.400     1.400     1.400 peak  1455 spectrum    1 weight  0.10000E+01 volume  0.19471E-02 ppm1      7.859 ppm2      2.739 CV     1
 ASSI { 1456}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 130  and name HB2 ))
      3.200     1.300     1.300 peak  1456 spectrum    1 weight  0.10000E+01 volume  0.23864E-02 ppm1      7.858 ppm2      1.807 CV     1
 OR { 1456}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 130  and name HG1 ))
 ASSI { 1459}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 132  and name HG11))
      3.000     1.200     1.200 peak  1459 spectrum    1 weight  0.10000E+01 volume  0.17934E-02 ppm1      7.856 ppm2      0.982 CV     1
 OR { 1459}
   (( segid "    " and resid 132  and name HN  ))
   (  segid "    " and resid 132  and name HG2%)
 ASSI { 1460}
   (( segid "    " and resid 132  and name HN  ))
   (  segid "    " and resid 132  and name HG2%)
      3.500     1.600     1.600 peak  1460 spectrum    1 weight  0.10000E+01 volume  0.18007E-02 ppm1      7.856 ppm2      0.948 CV     1
 ASSI { 1462}
   (( segid "    " and resid 132  and name HN  ))
   (  segid "    " and resid 132  and name HD1%)
      3.000     1.100     1.100 peak  1462 spectrum    1 weight  0.10000E+01 volume  0.20862E-02 ppm1      7.854 ppm2      0.440 CV     1
 ASSI { 1470}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 134  and name HA  ))
      2.400     0.700     0.700 peak  1470 spectrum    1 weight  0.10000E+01 volume  0.22253E-02 ppm1      7.667 ppm2      4.433 CV     1
 ASSI { 1472}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 135  and name HB2 ))
      3.600     1.700     1.700 peak  1472 spectrum    1 weight  0.10000E+01 volume  0.15519E-02 ppm1      7.662 ppm2      3.212 CV     1
 ASSI { 1473}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 135  and name HB1 ))
      2.900     1.100     1.100 peak  1473 spectrum    1 weight  0.10000E+01 volume  0.17934E-02 ppm1      7.662 ppm2      3.285 CV     1
 ASSI { 1475}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 134  and name HB1 ))
      3.500     1.500     1.500 peak  1475 spectrum    1 weight  0.10000E+01 volume  0.17569E-02 ppm1      7.660 ppm2      2.290 CV     1
 ASSI { 1478}
   (( segid "    " and resid 135  and name HN  ))
   (  segid "    " and resid 132  and name HG2%)
      3.800     1.800     1.800 peak  1478 spectrum    1 weight  0.10000E+01 volume  0.22473E-02 ppm1      7.661 ppm2      0.924 CV     1
 ASSI { 1482}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 137  and name HN  ))
      3.800     1.800     1.800 peak  1482 spectrum    1 weight  0.10000E+01 volume  0.17715E-02 ppm1      7.406 ppm2      8.409 CV     1
 ASSI { 1487}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 135  and name HA  ))
      3.100     1.200     1.200 peak  1487 spectrum    1 weight  0.10000E+01 volume  0.16543E-02 ppm1      7.406 ppm2      3.863 CV     1
 ASSI { 1488}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 118  and name HB1 ))
      2.700     0.900     0.900 peak  1488 spectrum    1 weight  0.10000E+01 volume  0.22985E-02 ppm1      7.407 ppm2      3.578 CV     1
 ASSI { 1489}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 134  and name HD2 ))
      1.800     1.800     4.200 peak  1489 spectrum    1 weight  0.10000E+01 volume  0.23937E-02 ppm1      7.406 ppm2      3.697 CV     1
 ASSI { 1490}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 135  and name HB2 ))
      3.300     1.300     1.300 peak  1490 spectrum    1 weight  0.10000E+01 volume  0.20424E-02 ppm1      7.403 ppm2      3.229 CV     1
 ASSI { 1491}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 135  and name HB1 ))
      3.200     1.300     1.300 peak  1491 spectrum    1 weight  0.10000E+01 volume  0.19984E-02 ppm1      7.404 ppm2      3.285 CV     1
 ASSI { 1492}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 132  and name HB  ))
      3.900     1.900     1.900 peak  1492 spectrum    1 weight  0.10000E+01 volume  0.13762E-02 ppm1      7.406 ppm2      1.189 CV     1
 ASSI { 1497}
   (( segid "    " and resid 137  and name HN  ))
   (( segid "    " and resid 138  and name HN  ))
      3.500     1.500     1.500 peak  1497 spectrum    1 weight  0.10000E+01 volume  0.22326E-02 ppm1      8.400 ppm2      8.236 CV     1
 ASSI { 1502}
   (( segid "    " and resid 137  and name HN  ))
   (( segid "    " and resid 135  and name HA  ))
      1.800     1.800     4.200 peak  1502 spectrum    1 weight  0.10000E+01 volume  0.24157E-02 ppm1      8.396 ppm2      3.871 CV     1
 ASSI { 1503}
   (( segid "    " and resid 137  and name HN  ))
   (( segid "    " and resid 118  and name HB2 ))
      3.300     1.400     1.400 peak  1503 spectrum    1 weight  0.10000E+01 volume  0.21888E-02 ppm1      8.404 ppm2      3.554 CV     1
 ASSI { 1510}
   (( segid "    " and resid 138  and name HN  ))
   (( segid "    " and resid 139  and name HN  ))
      3.700     1.700     1.700 peak  1510 spectrum    1 weight  0.10000E+01 volume  0.19911E-02 ppm1      8.267 ppm2      8.851 CV     1
 ASSI { 1514}
   (( segid "    " and resid 138  and name HN  ))
   (( segid "    " and resid 138  and name HA  ))
      3.000     1.100     1.100 peak  1514 spectrum    1 weight  0.10000E+01 volume  0.16324E-02 ppm1      8.259 ppm2      5.231 CV     1
 ASSI { 1515}
   (( segid "    " and resid 138  and name HN  ))
   (( segid "    " and resid 139  and name HA  ))
      3.400     3.400     2.600 peak  1515 spectrum    1 weight  0.10000E+01 volume  0.19544E-02 ppm1      8.259 ppm2      5.118 CV     1
 ASSI { 1517}
   (( segid "    " and resid 138  and name HN  ))
   (( segid "    " and resid 117  and name HA  ))
      3.500     1.500     1.500 peak  1517 spectrum    1 weight  0.10000E+01 volume  0.20276E-02 ppm1      8.259 ppm2      4.474 CV     1
 ASSI { 1518}
   (( segid "    " and resid 138  and name HN  ))
   (( segid "    " and resid 75   and name HA  ))
      3.400     3.400     2.600 peak  1518 spectrum    1 weight  0.10000E+01 volume  0.20276E-02 ppm1      8.260 ppm2      3.937 CV     1
 ASSI { 1519}
   (( segid "    " and resid 138  and name HN  ))
   (( segid "    " and resid 117  and name HB1 ))
      1.800     1.800     4.200 peak  1519 spectrum    1 weight  0.10000E+01 volume  0.24157E-02 ppm1      8.261 ppm2      3.051 CV     1
 ASSI { 1522}
   (( segid "    " and resid 138  and name HN  ))
   (  segid "    " and resid 137  and name HB% )
      3.900     1.900     1.900 peak  1522 spectrum    1 weight  0.10000E+01 volume  0.13762E-02 ppm1      8.258 ppm2      1.436 CV     1
 ASSI { 1523}
   (( segid "    " and resid 138  and name HN  ))
   (  segid "    " and resid 116  and name HB% )
      3.200     1.200     1.200 peak  1523 spectrum    1 weight  0.10000E+01 volume  0.17202E-02 ppm1      8.258 ppm2      1.089 CV     1
 ASSI { 1524}
   (( segid "    " and resid 138  and name HN  ))
   (  segid "    " and resid 74   and name HD2%)
      3.900     1.900     1.900 peak  1524 spectrum    1 weight  0.10000E+01 volume  0.18666E-02 ppm1      8.257 ppm2      0.838 CV     1
 ASSI { 1530}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 73   and name HA  ))
      2.800     2.800     3.200 peak  1530 spectrum    1 weight  0.10000E+01 volume  0.22473E-02 ppm1      8.836 ppm2      5.515 CV     1
 ASSI { 1533}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 72   and name HA  ))
      3.600     1.700     1.700 peak  1533 spectrum    1 weight  0.10000E+01 volume  0.20424E-02 ppm1      8.823 ppm2      4.880 CV     1
 ASSI { 1534}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 74   and name HA  ))
      3.100     1.200     1.200 peak  1534 spectrum    1 weight  0.10000E+01 volume  0.21156E-02 ppm1      8.826 ppm2      4.723 CV     1
 ASSI { 1535}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 75   and name HA  ))
      3.100     3.100     2.900 peak  1535 spectrum    1 weight  0.10000E+01 volume  0.22399E-02 ppm1      8.834 ppm2      3.975 CV     1
 ASSI { 1536}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 73   and name HB2 ))
      3.100     1.200     1.200 peak  1536 spectrum    1 weight  0.10000E+01 volume  0.18960E-02 ppm1      8.829 ppm2      3.718 CV     1
 OR { 1536}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 73   and name HB1 ))
 ASSI { 1540}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 138  and name HB1 ))
      3.100     1.200     1.200 peak  1540 spectrum    1 weight  0.10000E+01 volume  0.22034E-02 ppm1      8.828 ppm2      1.883 CV     1
 ASSI { 1545}
   (( segid "    " and resid 139  and name HN  ))
   (  segid "    " and resid 72   and name HG2%)
      3.200     1.300     1.300 peak  1545 spectrum    1 weight  0.10000E+01 volume  0.18155E-02 ppm1      8.828 ppm2      1.155 CV     1
 ASSI { 1550}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 141  and name HN  ))
      3.500     1.500     1.500 peak  1550 spectrum    1 weight  0.10000E+01 volume  0.19471E-02 ppm1      9.910 ppm2      9.191 CV     1
 ASSI { 1551}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 139  and name HN  ))
      3.200     1.300     1.300 peak  1551 spectrum    1 weight  0.10000E+01 volume  0.20424E-02 ppm1      9.913 ppm2      8.839 CV     1
 ASSI { 1552}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 116  and name HN  ))
      3.600     1.600     1.600 peak  1552 spectrum    1 weight  0.10000E+01 volume  0.21375E-02 ppm1      9.911 ppm2      8.641 CV     1
 ASSI { 1553}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 113  and name HA  ))
      3.300     1.300     1.300 peak  1553 spectrum    1 weight  0.10000E+01 volume  0.20643E-02 ppm1      9.914 ppm2      5.502 CV     1
 ASSI { 1554}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 140  and name HA  ))
      2.700     0.900     0.900 peak  1554 spectrum    1 weight  0.10000E+01 volume  0.21375E-02 ppm1      9.911 ppm2      5.268 CV     1
 ASSI { 1557}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 72   and name HA  ))
      3.600     1.600     1.600 peak  1557 spectrum    1 weight  0.10000E+01 volume  0.23132E-02 ppm1      9.905 ppm2      4.866 CV     1
 ASSI { 1558}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 139  and name HB1 ))
      3.600     1.600     1.600 peak  1558 spectrum    1 weight  0.10000E+01 volume  0.19106E-02 ppm1      9.910 ppm2      2.883 CV     1
 ASSI { 1559}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 139  and name HB2 ))
      3.800     1.800     1.800 peak  1559 spectrum    1 weight  0.10000E+01 volume  0.19252E-02 ppm1      9.910 ppm2      2.675 CV     1
 ASSI { 1560}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 113  and name HG2 ))
      3.400     1.500     1.500 peak  1560 spectrum    1 weight  0.10000E+01 volume  0.23644E-02 ppm1      9.916 ppm2      2.521 CV     1
 ASSI { 1561}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 114  and name HB  ))
      3.500     1.500     1.500 peak  1561 spectrum    1 weight  0.10000E+01 volume  0.17202E-02 ppm1      9.909 ppm2      2.025 CV     1
 ASSI { 1564}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 140  and name HB2 ))
      3.500     1.500     1.500 peak  1564 spectrum    1 weight  0.10000E+01 volume  0.17348E-02 ppm1      9.910 ppm2      1.284 CV     1
 ASSI { 1565}
   (( segid "    " and resid 140  and name HN  ))
   (  segid "    " and resid 72   and name HG2%)
      3.600     1.600     1.600 peak  1565 spectrum    1 weight  0.10000E+01 volume  0.18739E-02 ppm1      9.910 ppm2      1.139 CV     1
 ASSI { 1566}
   (( segid "    " and resid 140  and name HN  ))
   (  segid "    " and resid 114  and name HG1%)
      3.700     1.700     1.700 peak  1566 spectrum    1 weight  0.10000E+01 volume  0.16690E-02 ppm1      9.912 ppm2      0.917 CV     1
 ASSI { 1567}
   (( segid "    " and resid 140  and name HN  ))
   (  segid "    " and resid 114  and name HG2%)
      3.800     1.800     1.800 peak  1567 spectrum    1 weight  0.10000E+01 volume  0.18080E-02 ppm1      9.911 ppm2      0.833 CV     1
 ASSI { 1568}
   (( segid "    " and resid 140  and name HN  ))
   (  segid "    " and resid 140  and name HD2%)
      3.800     1.800     1.800 peak  1568 spectrum    1 weight  0.10000E+01 volume  0.17496E-02 ppm1      9.911 ppm2      0.694 CV     1
 ASSI { 1571}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 114  and name HN  ))
      3.500     1.500     1.500 peak  1571 spectrum    1 weight  0.10000E+01 volume  0.21521E-02 ppm1      9.193 ppm2      9.695 CV     1
 ASSI { 1572}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 142  and name HN  ))
      3.500     1.500     1.500 peak  1572 spectrum    1 weight  0.10000E+01 volume  0.18447E-02 ppm1      9.187 ppm2      9.338 CV     1
 ASSI { 1574}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 113  and name HA  ))
      3.600     1.600     1.600 peak  1574 spectrum    1 weight  0.10000E+01 volume  0.20570E-02 ppm1      9.191 ppm2      5.491 CV     1
 ASSI { 1575}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 141  and name HA  ))
      2.900     1.100     1.100 peak  1575 spectrum    1 weight  0.10000E+01 volume  0.13542E-02 ppm1      9.189 ppm2      5.279 CV     1
 ASSI { 1577}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 72   and name HA  ))
      3.600     1.700     1.700 peak  1577 spectrum    1 weight  0.10000E+01 volume  0.17569E-02 ppm1      9.188 ppm2      4.881 CV     1
 ASSI { 1581}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 141  and name HG2 ))
      3.900     1.900     1.900 peak  1581 spectrum    1 weight  0.10000E+01 volume  0.14421E-02 ppm1      9.189 ppm2      1.953 CV     1
 ASSI { 1582}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 141  and name HG1 ))
      4.000     2.000     2.000 peak  1582 spectrum    1 weight  0.10000E+01 volume  0.16764E-02 ppm1      9.189 ppm2      2.008 CV     1
 ASSI { 1584}
   (( segid "    " and resid 141  and name HN  ))
   (  segid "    " and resid 142  and name HG2%)
      4.100     2.100     1.900 peak  1584 spectrum    1 weight  0.10000E+01 volume  0.15006E-02 ppm1      9.188 ppm2      0.827 CV     1
 ASSI { 1585}
   (( segid "    " and resid 141  and name HN  ))
   (  segid "    " and resid 140  and name HD1%)
      3.400     1.400     1.400 peak  1585 spectrum    1 weight  0.10000E+01 volume  0.18593E-02 ppm1      9.190 ppm2      0.926 CV     1
 ASSI { 1586}
   (( segid "    " and resid 141  and name HN  ))
   (  segid "    " and resid 140  and name HD2%)
      1.800     1.800     4.200 peak  1586 spectrum    1 weight  0.10000E+01 volume  0.21448E-02 ppm1      9.186 ppm2      0.711 CV     1
 ASSI { 1589}
   (( segid "    " and resid 142  and name HN  ))
   (( segid "    " and resid 114  and name HN  ))
      3.400     1.500     1.500 peak  1589 spectrum    1 weight  0.10000E+01 volume  0.22034E-02 ppm1      9.365 ppm2      9.703 CV     1
 ASSI { 1592}
   (( segid "    " and resid 142  and name HN  ))
   (( segid "    " and resid 143  and name HN  ))
      3.300     1.400     1.400 peak  1592 spectrum    1 weight  0.10000E+01 volume  0.21814E-02 ppm1      9.364 ppm2      9.162 CV     1
 ASSI { 1594}
   (( segid "    " and resid 142  and name HN  ))
   (( segid "    " and resid 143  and name HA  ))
      3.100     3.100     2.900 peak  1594 spectrum    1 weight  0.10000E+01 volume  0.21448E-02 ppm1      9.360 ppm2      5.581 CV     1
 ASSI { 1595}
   (( segid "    " and resid 142  and name HN  ))
   (( segid "    " and resid 113  and name HA  ))
      3.400     1.500     1.500 peak  1595 spectrum    1 weight  0.10000E+01 volume  0.17934E-02 ppm1      9.359 ppm2      5.507 CV     1
 ASSI { 1599}
   (( segid "    " and resid 142  and name HN  ))
   (( segid "    " and resid 68   and name HB  ))
      3.700     3.700     2.300 peak  1599 spectrum    1 weight  0.10000E+01 volume  0.23058E-02 ppm1      9.364 ppm2      2.181 CV     1
 ASSI { 1600}
   (( segid "    " and resid 142  and name HN  ))
   (( segid "    " and resid 141  and name HG1 ))
      3.000     1.200     1.200 peak  1600 spectrum    1 weight  0.10000E+01 volume  0.14421E-02 ppm1      9.362 ppm2      2.013 CV     1
 ASSI { 1602}
   (( segid "    " and resid 142  and name HN  ))
   (  segid "    " and resid 112  and name HB% )
      3.200     1.300     1.300 peak  1602 spectrum    1 weight  0.10000E+01 volume  0.23571E-02 ppm1      9.365 ppm2      1.524 CV     1
 ASSI { 1603}
   (( segid "    " and resid 142  and name HN  ))
   (  segid "    " and resid 111  and name HG2%)
      3.400     1.400     1.400 peak  1603 spectrum    1 weight  0.10000E+01 volume  0.19692E-02 ppm1      9.359 ppm2      1.181 CV     1
 ASSI { 1606}
   (( segid "    " and resid 143  and name HN  ))
   (( segid "    " and resid 112  and name HN  ))
      3.300     3.300     2.700 peak  1606 spectrum    1 weight  0.10000E+01 volume  0.23425E-02 ppm1      9.168 ppm2      9.948 CV     1
 ASSI { 1609}
   (( segid "    " and resid 143  and name HN  ))
   (( segid "    " and resid 144  and name HN  ))
      3.400     1.400     1.400 peak  1609 spectrum    1 weight  0.10000E+01 volume  0.19618E-02 ppm1      9.170 ppm2      8.419 CV     1
 ASSI { 1616}
   (( segid "    " and resid 143  and name HN  ))
   (( segid "    " and resid 69   and name HB1 ))
      3.400     1.400     1.400 peak  1616 spectrum    1 weight  0.10000E+01 volume  0.17569E-02 ppm1      9.174 ppm2      3.182 CV     1
 ASSI { 1617}
   (( segid "    " and resid 143  and name HN  ))
   (( segid "    " and resid 69   and name HB2 ))
      4.400     2.500     1.600 peak  1617 spectrum    1 weight  0.10000E+01 volume  0.18228E-02 ppm1      9.168 ppm2      3.080 CV     1
 ASSI { 1618}
   (( segid "    " and resid 143  and name HN  ))
   (( segid "    " and resid 68   and name HB  ))
      2.900     1.100     1.100 peak  1618 spectrum    1 weight  0.10000E+01 volume  0.18228E-02 ppm1      9.173 ppm2      2.218 CV     1
 ASSI { 1619}
   (( segid "    " and resid 143  and name HN  ))
   (( segid "    " and resid 141  and name HG1 ))
      3.100     1.200     1.200 peak  1619 spectrum    1 weight  0.10000E+01 volume  0.25474E-02 ppm1      9.168 ppm2      2.067 CV     1
 ASSI { 1620}
   (( segid "    " and resid 143  and name HN  ))
   (( segid "    " and resid 141  and name HG2 ))
      2.900     2.900     3.100 peak  1620 spectrum    1 weight  0.10000E+01 volume  0.22912E-02 ppm1      9.172 ppm2      1.936 CV     1
 ASSI { 1622}
   (( segid "    " and resid 143  and name HN  ))
   (  segid "    " and resid 111  and name HG2%)
      3.400     1.500     1.500 peak  1622 spectrum    1 weight  0.10000E+01 volume  0.20570E-02 ppm1      9.177 ppm2      1.159 CV     1
 ASSI { 1623}
   (( segid "    " and resid 143  and name HN  ))
   (  segid "    " and resid 68   and name HG1%)
      3.500     1.500     1.500 peak  1623 spectrum    1 weight  0.10000E+01 volume  0.17569E-02 ppm1      9.168 ppm2      1.046 CV     1
 ASSI { 1628}
   (( segid "    " and resid 144  and name HN  ))
   (( segid "    " and resid 109  and name HN  ))
      3.400     1.500     1.500 peak  1628 spectrum    1 weight  0.10000E+01 volume  0.22107E-02 ppm1      8.411 ppm2      8.838 CV     1
 ASSI { 1629}
   (( segid "    " and resid 144  and name HN  ))
   (( segid "    " and resid 145  and name HN  ))
      3.400     1.400     1.400 peak  1629 spectrum    1 weight  0.10000E+01 volume  0.20570E-02 ppm1      8.416 ppm2      8.973 CV     1
 ASSI { 1634}
   (( segid "    " and resid 144  and name HN  ))
   (( segid "    " and resid 144  and name HA  ))
      2.900     1.000     1.000 peak  1634 spectrum    1 weight  0.10000E+01 volume  0.18080E-02 ppm1      8.416 ppm2      4.647 CV     1
 ASSI { 1636}
   (( segid "    " and resid 144  and name HN  ))
   (( segid "    " and resid 143  and name HB  ))
      3.300     1.400     1.400 peak  1636 spectrum    1 weight  0.10000E+01 volume  0.21594E-02 ppm1      8.413 ppm2      4.047 CV     1
 ASSI { 1638}
   (( segid "    " and resid 144  and name HN  ))
   (  segid "    " and resid 106  and name HE% )
      3.100     1.200     1.200 peak  1638 spectrum    1 weight  0.10000E+01 volume  0.16251E-02 ppm1      8.414 ppm2      1.955 CV     1
 ASSI { 1642}
   (( segid "    " and resid 144  and name HN  ))
   (  segid "    " and resid 111  and name HG2%)
      1.800     1.800     4.200 peak  1642 spectrum    1 weight  0.10000E+01 volume  0.21082E-02 ppm1      8.413 ppm2      1.160 CV     1
 ASSI { 1644}
   (( segid "    " and resid 144  and name HN  ))
   (  segid "    " and resid 144  and name HD1%)
      3.900     1.900     1.900 peak  1644 spectrum    1 weight  0.10000E+01 volume  0.18080E-02 ppm1      8.416 ppm2      0.839 CV     1
 ASSI { 1645}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 69   and name HN  ))
      3.300     1.300     1.300 peak  1645 spectrum    1 weight  0.10000E+01 volume  0.18593E-02 ppm1      8.955 ppm2      8.737 CV     1
 ASSI { 1650}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 67   and name HA  ))
      3.200     3.200     2.800 peak  1650 spectrum    1 weight  0.10000E+01 volume  0.24376E-02 ppm1      8.969 ppm2      5.313 CV     1
 ASSI { 1652}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 146  and name HA  ))
      3.800     1.800     1.800 peak  1652 spectrum    1 weight  0.10000E+01 volume  0.20130E-02 ppm1      8.959 ppm2      4.524 CV     1
 ASSI { 1653}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 145  and name HA  ))
      2.900     1.100     1.100 peak  1653 spectrum    1 weight  0.10000E+01 volume  0.18301E-02 ppm1      8.957 ppm2      4.319 CV     1
 ASSI { 1654}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 67   and name HB  ))
      3.400     1.500     1.500 peak  1654 spectrum    1 weight  0.10000E+01 volume  0.20203E-02 ppm1      8.958 ppm2      3.987 CV     1
 ASSI { 1655}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 108  and name HA  ))
      1.700     1.700     4.300 peak  1655 spectrum    1 weight  0.10000E+01 volume  0.25328E-02 ppm1      8.959 ppm2      3.322 CV     1
 ASSI { 1656}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 145  and name HE1 ))
      3.800     1.800     1.800 peak  1656 spectrum    1 weight  0.10000E+01 volume  0.24376E-02 ppm1      8.954 ppm2      2.964 CV     1
 OR { 1656}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 145  and name HE2 ))
 ASSI { 1657}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 144  and name HB1 ))
      3.500     1.600     1.600 peak  1657 spectrum    1 weight  0.10000E+01 volume  0.21229E-02 ppm1      8.958 ppm2      2.331 CV     1
 ASSI { 1658}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 68   and name HB  ))
      1.800     1.800     4.200 peak  1658 spectrum    1 weight  0.10000E+01 volume  0.22766E-02 ppm1      8.959 ppm2      2.197 CV     1
 ASSI { 1659}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 145  and name HB1 ))
      3.200     1.300     1.300 peak  1659 spectrum    1 weight  0.10000E+01 volume  0.23278E-02 ppm1      8.957 ppm2      1.869 CV     1
 ASSI { 1660}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 66   and name HB  ))
      3.800     1.800     1.800 peak  1660 spectrum    1 weight  0.10000E+01 volume  0.16543E-02 ppm1      8.957 ppm2      1.670 CV     1
 ASSI { 1662}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 144  and name HG  ))
      3.200     1.300     1.300 peak  1662 spectrum    1 weight  0.10000E+01 volume  0.18447E-02 ppm1      8.957 ppm2      1.407 CV     1
 ASSI { 1663}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 144  and name HB2 ))
      3.800     1.800     1.800 peak  1663 spectrum    1 weight  0.10000E+01 volume  0.20057E-02 ppm1      8.958 ppm2      1.295 CV     1
 ASSI { 1664}
   (( segid "    " and resid 145  and name HN  ))
   (  segid "    " and resid 143  and name HG2%)
      3.400     1.400     1.400 peak  1664 spectrum    1 weight  0.10000E+01 volume  0.18301E-02 ppm1      8.956 ppm2      1.053 CV     1
 ASSI { 1667}
   (( segid "    " and resid 145  and name HN  ))
   (  segid "    " and resid 66   and name HG2%)
      1.800     1.800     4.200 peak  1667 spectrum    1 weight  0.10000E+01 volume  0.22546E-02 ppm1      8.960 ppm2      0.028 CV     1
 ASSI { 1671}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 147  and name HN  ))
      3.600     1.600     1.600 peak  1671 spectrum    1 weight  0.10000E+01 volume  0.19325E-02 ppm1      7.360 ppm2      8.290 CV     1
 ASSI { 1673}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 68   and name HA  ))
      3.600     1.600     1.600 peak  1673 spectrum    1 weight  0.10000E+01 volume  0.21448E-02 ppm1      7.356 ppm2      5.600 CV     1
 ASSI { 1676}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 145  and name HA  ))
      3.200     1.300     1.300 peak  1676 spectrum    1 weight  0.10000E+01 volume  0.18960E-02 ppm1      7.360 ppm2      4.312 CV     1
 ASSI { 1677}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 67   and name HB  ))
      3.700     1.700     1.700 peak  1677 spectrum    1 weight  0.10000E+01 volume  0.16470E-02 ppm1      7.360 ppm2      3.982 CV     1
 ASSI { 1678}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 144  and name HA  ))
      3.400     1.400     1.400 peak  1678 spectrum    1 weight  0.10000E+01 volume  0.20350E-02 ppm1      7.361 ppm2      4.653 CV     1
 ASSI { 1679}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 144  and name HB1 ))
      1.800     1.800     4.200 peak  1679 spectrum    1 weight  0.10000E+01 volume  0.22399E-02 ppm1      7.358 ppm2      2.362 CV     1
 ASSI { 1681}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 145  and name HG1 ))
      3.700     1.700     1.700 peak  1681 spectrum    1 weight  0.10000E+01 volume  0.14933E-02 ppm1      7.360 ppm2      1.596 CV     1
 ASSI { 1682}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 66   and name HB  ))
      3.400     1.400     1.400 peak  1682 spectrum    1 weight  0.10000E+01 volume  0.18080E-02 ppm1      7.361 ppm2      1.671 CV     1
 ASSI { 1685}
   (( segid "    " and resid 146  and name HN  ))
   (  segid "    " and resid 108  and name HG2%)
      3.400     1.400     1.400 peak  1685 spectrum    1 weight  0.10000E+01 volume  0.15665E-02 ppm1      7.360 ppm2      0.799 CV     1
 ASSI { 1690}
   (( segid "    " and resid 147  and name HN  ))
   (( segid "    " and resid 148  and name HN  ))
      3.500     1.600     1.600 peak  1690 spectrum    1 weight  0.10000E+01 volume  0.18886E-02 ppm1      8.279 ppm2      8.716 CV     1
 ASSI { 1691}
   (( segid "    " and resid 147  and name HN  ))
   (( segid "    " and resid 67   and name HN  ))
      3.400     1.500     1.500 peak  1691 spectrum    1 weight  0.10000E+01 volume  0.20643E-02 ppm1      8.285 ppm2      7.827 CV     1
 ASSI { 1698}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 22   and name HA  ))
      3.600     1.600     1.600 peak  1698 spectrum    1 weight  0.10000E+01 volume  0.20350E-02 ppm1      8.286 ppm2      4.252 CV     1
 ASSI { 1700}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 25   and name HD1 ))
      3.100     1.200     1.200 peak  1700 spectrum    1 weight  0.10000E+01 volume  0.21521E-02 ppm1      8.283 ppm2      3.787 CV     1
 ASSI { 1702}
   (( segid "    " and resid 24   and name HN  ))
   (  segid "    " and resid 22   and name HB% )
      3.300     1.400     1.400 peak  1702 spectrum    1 weight  0.10000E+01 volume  0.23058E-02 ppm1      8.279 ppm2      1.428 CV     1
 ASSI { 1704}
   (( segid "    " and resid 147  and name HN  ))
   (  segid "    " and resid 108  and name HG1%)
      1.900     1.900     4.100 peak  1704 spectrum    1 weight  0.10000E+01 volume  0.17056E-02 ppm1      8.281 ppm2      1.010 CV     1
 ASSI { 1706}
   (( segid "    " and resid 147  and name HN  ))
   (  segid "    " and resid 66   and name HG1%)
      4.000     2.000     2.000 peak  1706 spectrum    1 weight  0.10000E+01 volume  0.15738E-02 ppm1      8.282 ppm2      0.732 CV     1
 ASSI { 1707}
   (( segid "    " and resid 147  and name HN  ))
   (  segid "    " and resid 148  and name HG1%)
      3.500     1.600     1.600 peak  1707 spectrum    1 weight  0.10000E+01 volume  0.15006E-02 ppm1      8.283 ppm2      0.837 CV     1
 ASSI { 1712}
   (( segid "    " and resid 148  and name HN  ))
   (( segid "    " and resid 149  and name HN  ))
      3.500     1.500     1.500 peak  1712 spectrum    1 weight  0.10000E+01 volume  0.19106E-02 ppm1      8.705 ppm2      8.501 CV     1
 ASSI { 1717}
   (( segid "    " and resid 148  and name HN  ))
   (( segid "    " and resid 149  and name HA  ))
      3.300     1.400     1.400 peak  1717 spectrum    1 weight  0.10000E+01 volume  0.21667E-02 ppm1      8.707 ppm2      4.805 CV     1
 ASSI { 1720}
   (( segid "    " and resid 148  and name HN  ))
   (( segid "    " and resid 64   and name HA  ))
      3.300     1.300     1.300 peak  1720 spectrum    1 weight  0.10000E+01 volume  0.19692E-02 ppm1      8.701 ppm2      4.468 CV     1
 ASSI { 1721}
   (( segid "    " and resid 148  and name HN  ))
   (( segid "    " and resid 65   and name HA  ))
      3.100     3.100     2.900 peak  1721 spectrum    1 weight  0.10000E+01 volume  0.21888E-02 ppm1      8.708 ppm2      4.269 CV     1
 ASSI { 1722}
   (( segid "    " and resid 148  and name HN  ))
   (( segid "    " and resid 64   and name HB1 ))
      2.900     1.100     1.100 peak  1722 spectrum    1 weight  0.10000E+01 volume  0.17642E-02 ppm1      8.704 ppm2      2.190 CV     1
 ASSI { 1725}
   (( segid "    " and resid 148  and name HN  ))
   (( segid "    " and resid 64   and name HB2 ))
      3.000     1.100     1.100 peak  1725 spectrum    1 weight  0.10000E+01 volume  0.17422E-02 ppm1      8.703 ppm2      1.615 CV     1
 ASSI { 1728}
   (( segid "    " and resid 148  and name HN  ))
   (  segid "    " and resid 148  and name HG1%)
      3.900     1.900     1.900 peak  1728 spectrum    1 weight  0.10000E+01 volume  0.14347E-02 ppm1      8.704 ppm2      0.839 CV     1
 ASSI { 1730}
   (( segid "    " and resid 148  and name HN  ))
   (  segid "    " and resid 65   and name HG2%)
      3.200     1.300     1.300 peak  1730 spectrum    1 weight  0.10000E+01 volume  0.21448E-02 ppm1      8.707 ppm2      0.471 CV     1
 ASSI { 1731}
   (( segid "    " and resid 148  and name HN  ))
   (  segid "    " and resid 66   and name HG2%)
      1.800     1.800     4.200 peak  1731 spectrum    1 weight  0.10000E+01 volume  0.22546E-02 ppm1      8.706 ppm2      0.008 CV     1
 ASSI { 1737}
   (( segid "    " and resid 149  and name HN  ))
   (( segid "    " and resid 64   and name HE21))
      3.900     1.900     1.900 peak  1737 spectrum    1 weight  0.10000E+01 volume  0.20276E-02 ppm1      8.505 ppm2      6.335 CV     1
 ASSI { 1745}
   (( segid "    " and resid 149  and name HN  ))
   (( segid "    " and resid 150  and name HB1 ))
      3.500     1.500     1.500 peak  1745 spectrum    1 weight  0.10000E+01 volume  0.21594E-02 ppm1      8.496 ppm2      1.611 CV     1
 ASSI { 1746}
   (( segid "    " and resid 149  and name HN  ))
   (  segid "    " and resid 150  and name HD1%)
      3.600     1.700     1.700 peak  1746 spectrum    1 weight  0.10000E+01 volume  0.16105E-02 ppm1      8.506 ppm2      0.864 CV     1
 ASSI { 1748}
   (( segid "    " and resid 150  and name HN  ))
   (( segid "    " and resid 65   and name HN  ))
      3.300     1.300     1.300 peak  1748 spectrum    1 weight  0.10000E+01 volume  0.19398E-02 ppm1      8.676 ppm2      8.828 CV     1
 ASSI { 1750}
   (( segid "    " and resid 150  and name HN  ))
   (( segid "    " and resid 64   and name HN  ))
      3.700     1.700     1.700 peak  1750 spectrum    1 weight  0.10000E+01 volume  0.19618E-02 ppm1      8.700 ppm2      8.039 CV     1
 ASSI { 1754}
   (( segid "    " and resid 150  and name HN  ))
   (( segid "    " and resid 64   and name HA  ))
      2.800     1.000     1.000 peak  1754 spectrum    1 weight  0.10000E+01 volume  0.18080E-02 ppm1      8.702 ppm2      4.464 CV     1
 ASSI { 1755}
   (( segid "    " and resid 150  and name HN  ))
   (( segid "    " and resid 151  and name HA  ))
      3.800     1.800     1.800 peak  1755 spectrum    1 weight  0.10000E+01 volume  0.20862E-02 ppm1      8.710 ppm2      4.279 CV     1
 ASSI { 1759}
   (( segid "    " and resid 150  and name HN  ))
   (( segid "    " and resid 148  and name HB  ))
      3.100     3.100     2.900 peak  1759 spectrum    1 weight  0.10000E+01 volume  0.21009E-02 ppm1      8.696 ppm2      2.122 CV     1
 ASSI { 1760}
   (( segid "    " and resid 150  and name HN  ))
   (( segid "    " and resid 151  and name HG1 ))
      3.900     1.900     1.900 peak  1760 spectrum    1 weight  0.10000E+01 volume  0.21594E-02 ppm1      8.700 ppm2      2.238 CV     1
 ASSI { 1761}
   (( segid "    " and resid 150  and name HN  ))
   (( segid "    " and resid 150  and name HB1 ))
      3.000     1.100     1.100 peak  1761 spectrum    1 weight  0.10000E+01 volume  0.18960E-02 ppm1      8.703 ppm2      1.575 CV     1
 ASSI { 1762}
   (( segid "    " and resid 150  and name HN  ))
   (  segid "    " and resid 150  and name HD1%)
      3.700     1.700     1.700 peak  1762 spectrum    1 weight  0.10000E+01 volume  0.15226E-02 ppm1      8.702 ppm2      0.852 CV     1
 ASSI { 1767}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 32   and name HN  ))
      3.800     1.800     1.800 peak  1767 spectrum    1 weight  0.10000E+01 volume  0.17715E-02 ppm1      8.507 ppm2      8.339 CV     1
 ASSI { 1768}
   (( segid "    " and resid 151  and name HN  ))
   (( segid "    " and resid 149  and name HA  ))
      4.100     2.100     1.900 peak  1768 spectrum    1 weight  0.10000E+01 volume  0.13103E-02 ppm1      8.513 ppm2      4.805 CV     1
 ASSI { 1769}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 32   and name HA  ))
      3.600     1.600     1.600 peak  1769 spectrum    1 weight  0.10000E+01 volume  0.17129E-02 ppm1      8.516 ppm2      4.547 CV     1
 ASSI { 1770}
   (( segid "    " and resid 151  and name HN  ))
   (( segid "    " and resid 151  and name HA  ))
      3.100     1.200     1.200 peak  1770 spectrum    1 weight  0.10000E+01 volume  0.16324E-02 ppm1      8.510 ppm2      4.272 CV     1
 ASSI { 1773}
   (( segid "    " and resid 151  and name HN  ))
   (( segid "    " and resid 63   and name HA2 ))
      3.700     1.700     1.700 peak  1773 spectrum    1 weight  0.10000E+01 volume  0.20789E-02 ppm1      8.512 ppm2      3.552 CV     1
 ASSI { 1775}
   (( segid "    " and resid 151  and name HN  ))
   (( segid "    " and resid 149  and name HB1 ))
      3.900     1.900     1.900 peak  1775 spectrum    1 weight  0.10000E+01 volume  0.18666E-02 ppm1      8.520 ppm2      2.697 CV     1
 ASSI { 1776}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 33   and name HB1 ))
      3.800     1.800     1.800 peak  1776 spectrum    1 weight  0.10000E+01 volume  0.15592E-02 ppm1      8.512 ppm2      2.308 CV     1
 ASSI { 1777}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 33   and name HG2 ))
      3.200     1.300     1.300 peak  1777 spectrum    1 weight  0.10000E+01 volume  0.19252E-02 ppm1      8.513 ppm2      2.067 CV     1
 ASSI { 1778}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 34   and name HB1 ))
      3.500     1.500     1.500 peak  1778 spectrum    1 weight  0.10000E+01 volume  0.13250E-02 ppm1      8.512 ppm2      1.950 CV     1
 ASSI { 1779}
   (( segid "    " and resid 151  and name HN  ))
   (( segid "    " and resid 150  and name HB2 ))
      3.800     1.800     1.800 peak  1779 spectrum    1 weight  0.10000E+01 volume  0.14421E-02 ppm1      8.515 ppm2      1.574 CV     1
 ASSI { 1780}
   (( segid "    " and resid 151  and name HN  ))
   (  segid "    " and resid 150  and name HD1%)
      1.900     1.900     4.100 peak  1780 spectrum    1 weight  0.10000E+01 volume  0.16764E-02 ppm1      8.519 ppm2      0.859 CV     1
 ASSI {   29}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 44   and name HB1 ))
      3.500     1.500     1.500 peak    29 spectrum    1 weight  0.11000E+01 volume  0.76023E-03 ppm1      4.365 ppm2      1.962 CV     1
 OR {   29}
   (( segid "    " and resid 90   and name HA  ))
   (( segid "    " and resid 90   and name HB1 ))
 ASSI {   81}
   (  segid "    " and resid 99   and name HD1%)
   (( segid "    " and resid 99   and name HG  ))
      1.600     1.600     4.400 peak    81 spectrum    1 weight  0.11000E+01 volume  0.62951E-01 ppm1      1.305 ppm2      1.307 CV     1
 OR {   81}
   (  segid "    " and resid 99   and name HD1%)
   (  segid "    " and resid 103  and name HG1%)
 ASSI {   86}
   (( segid "    " and resid 99   and name HG  ))
   (  segid "    " and resid 99   and name HD2%)
      2.600     0.800     0.800 peak    86 spectrum    1 weight  0.11000E+01 volume  0.41771E-02 ppm1      1.375 ppm2      0.783 CV     1
 OR {   86}
   (( segid "    " and resid 40   and name HG  ))
   (  segid "    " and resid 40   and name HD1%)
 ASSI {  265}
   (  segid "    " and resid 45   and name HD2%)
   (  segid "    " and resid 45   and name HD1%)
      2.500     0.800     0.800 peak   265 spectrum    1 weight  0.11000E+01 volume  0.68806E-02 ppm1      0.525 ppm2      0.801 CV     1
 OR {  265}
   (  segid "    " and resid 45   and name HD2%)
   (  segid "    " and resid 39   and name HG2%)
 ASSI {  301}
   (  segid "    " and resid 44   and name HD1%)
   (( segid "    " and resid 44   and name HG  ))
      2.500     0.800     0.800 peak   301 spectrum    1 weight  0.11000E+01 volume  0.43102E-02 ppm1      0.958 ppm2      1.610 CV     1
 OR {  301}
   (  segid "    " and resid 140  and name HD1%)
   (( segid "    " and resid 140  and name HG  ))
 ASSI {  302}
   (  segid "    " and resid 140  and name HD1%)
   (( segid "    " and resid 140  and name HG  ))
      2.500     0.800     0.800 peak   302 spectrum    1 weight  0.11000E+01 volume  0.53195E-02 ppm1      0.952 ppm2      1.689 CV     1
 OR {  302}
   (  segid "    " and resid 44   and name HD1%)
   (( segid "    " and resid 44   and name HB2 ))
 ASSI {  303}
   (  segid "    " and resid 140  and name HD1%)
   (( segid "    " and resid 140  and name HB1 ))
      2.600     0.800     0.800 peak   303 spectrum    1 weight  0.11000E+01 volume  0.64174E-02 ppm1      0.968 ppm2      1.922 CV     1
 OR {  303}
   (  segid "    " and resid 44   and name HD1%)
   (( segid "    " and resid 44   and name HB1 ))
 ASSI {  329}
   (  segid "    " and resid 89   and name HG2%)
   (( segid "    " and resid 89   and name HA  ))
      3.800     1.800     1.800 peak   329 spectrum    1 weight  0.11000E+01 volume  0.77693E-03 ppm1      0.986 ppm2      4.586 CV     1
 OR {  329}
   (  segid "    " and resid 37   and name HD2%)
   (( segid "    " and resid 37   and name HA  ))
 ASSI {  393}
   (( segid "    " and resid 90   and name HB2 ))
   (  segid "    " and resid 90   and name HD2%)
      3.100     1.200     1.200 peak   393 spectrum    1 weight  0.11000E+01 volume  0.23136E-02 ppm1      1.471 ppm2      0.753 CV     1
 OR {  393}
   (( segid "    " and resid 50   and name HB2 ))
   (  segid "    " and resid 50   and name HD2%)
 ASSI {  477}
   (  segid "    " and resid 142  and name HG1%)
   (( segid "    " and resid 142  and name HB  ))
      2.300     0.700     0.700 peak   477 spectrum    1 weight  0.11000E+01 volume  0.89649E-02 ppm1      0.935 ppm2      1.993 CV     1
 OR {  477}
   (  segid "    " and resid 61   and name HG1%)
   (( segid "    " and resid 61   and name HB  ))
 ASSI {  516}
   (  segid "    " and resid 66   and name HG1%)
   (( segid "    " and resid 147  and name HA  ))
      2.600     0.800     0.800 peak   516 spectrum    1 weight  0.11000E+01 volume  0.30809E-02 ppm1      0.681 ppm2      5.057 CV     1
 OR {  516}
   (  segid "    " and resid 66   and name HG1%)
   (( segid "    " and resid 66   and name HA  ))
 ASSI {  522}
   (  segid "    " and resid 68   and name HG1%)
   (( segid "    " and resid 68   and name HA  ))
      2.800     1.000     1.000 peak   522 spectrum    1 weight  0.11000E+01 volume  0.27718E-02 ppm1      1.085 ppm2      5.607 CV     1
 OR {  522}
   (  segid "    " and resid 143  and name HG2%)
   (( segid "    " and resid 143  and name HA  ))
 ASSI {  563}
   (( segid "    " and resid 87   and name HA  ))
   (  segid "    " and resid 87   and name HG2%)
      3.100     1.200     1.200 peak   563 spectrum    1 weight  0.11000E+01 volume  0.16885E-02 ppm1      5.359 ppm2      0.731 CV     1
 OR {  563}
   (( segid "    " and resid 67   and name HA  ))
   (  segid "    " and resid 87   and name HG2%)
 ASSI {  666}
   (  segid "    " and resid 67   and name HG2%)
   (( segid "    " and resid 67   and name HA  ))
      3.000     1.100     1.100 peak   666 spectrum    1 weight  0.11000E+01 volume  0.32323E-02 ppm1      1.069 ppm2      5.325 CV     1
 OR {  666}
   (  segid "    " and resid 67   and name HG2%)
   (( segid "    " and resid 87   and name HA  ))
 ASSI {  676}
   (  segid "    " and resid 72   and name HG2%)
   (( segid "    " and resid 72   and name HB  ))
      2.600     0.800     0.800 peak   676 spectrum    1 weight  0.11000E+01 volume  0.35469E-02 ppm1      1.179 ppm2      4.025 CV     1
 OR {  676}
   (  segid "    " and resid 74   and name HD1%)
   (( segid "    " and resid 78   and name HB  ))
 ASSI {  726}
   (( segid "    " and resid 6    and name HA  ))
   (  segid "    " and resid 6    and name HB% )
      3.000     1.100     1.100 peak   726 spectrum    1 weight  0.11000E+01 volume  0.32718E-02 ppm1      4.281 ppm2      1.411 CV     1
 OR {  726}
   (( segid "    " and resid 9    and name HA  ))
   (  segid "    " and resid 9    and name HB% )
 OR {  726}
   (( segid "    " and resid 21   and name HA  ))
   (  segid "    " and resid 21   and name HB% )
 OR {  726}
   (( segid "    " and resid 16   and name HA  ))
   (  segid "    " and resid 16   and name HB% )
 ASSI {  733}
   (  segid "    " and resid 14   and name HB% )
   (( segid "    " and resid 14   and name HA  ))
      3.000     1.100     1.100 peak   733 spectrum    1 weight  0.11000E+01 volume  0.33590E-02 ppm1      1.406 ppm2      4.295 CV     1
 OR {  733}
   (  segid "    " and resid 22   and name HB% )
   (( segid "    " and resid 22   and name HA  ))
 OR {  733}
   (  segid "    " and resid 21   and name HB% )
   (( segid "    " and resid 21   and name HA  ))
 OR {  733}
   (  segid "    " and resid 16   and name HB% )
   (( segid "    " and resid 16   and name HA  ))
 ASSI {  737}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 32   and name HA  ))
      3.000     1.100     1.100 peak   737 spectrum    1 weight  0.11000E+01 volume  0.27415E-02 ppm1      1.360 ppm2      4.589 CV     1
 OR {  737}
   (  segid "    " and resid 28   and name HB% )
   (( segid "    " and resid 28   and name HA  ))
 ASSI {  985}
   (( segid "    " and resid 10   and name HB2 ))
   (( segid "    " and resid 10   and name HA  ))
      2.900     1.100     1.100 peak   985 spectrum    1 weight  0.11000E+01 volume  0.36448E-02 ppm1      1.975 ppm2      4.290 CV     1
 OR {  985}
   (( segid "    " and resid 7    and name HB2 ))
   (( segid "    " and resid 7    and name HA  ))
 OR {  985}
   (( segid "    " and resid 151  and name HB2 ))
   (( segid "    " and resid 151  and name HA  ))
 ASSI {  986}
   (( segid "    " and resid 151  and name HB1 ))
   (( segid "    " and resid 151  and name HA  ))
      3.000     1.100     1.100 peak   986 spectrum    1 weight  0.11000E+01 volume  0.31581E-02 ppm1      2.051 ppm2      4.287 CV     1
 OR {  986}
   (( segid "    " and resid 10   and name HB1 ))
   (( segid "    " and resid 10   and name HA  ))
 OR {  986}
   (( segid "    " and resid 7    and name HB1 ))
   (( segid "    " and resid 7    and name HA  ))
 ASSI {  991}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 7    and name HB2 ))
      3.200     1.300     1.300 peak   991 spectrum    1 weight  0.11000E+01 volume  0.21097E-02 ppm1      4.273 ppm2      1.950 CV     1
 OR {  991}
   (( segid "    " and resid 151  and name HA  ))
   (( segid "    " and resid 151  and name HB2 ))
 ASSI {  993}
   (( segid "    " and resid 151  and name HB1 ))
   (( segid "    " and resid 151  and name HG1 ))
      2.200     0.600     0.600 peak   993 spectrum    1 weight  0.11000E+01 volume  0.18210E-01 ppm1      2.067 ppm2      2.262 CV     1
 OR {  993}
   (( segid "    " and resid 7    and name HB1 ))
   (( segid "    " and resid 7    and name HG1 ))
 ASSI {  994}
   (( segid "    " and resid 151  and name HB2 ))
   (( segid "    " and resid 151  and name HG1 ))
      2.900     1.100     1.100 peak   994 spectrum    1 weight  0.11000E+01 volume  0.38235E-02 ppm1      1.986 ppm2      2.262 CV     1
 OR {  994}
   (( segid "    " and resid 7    and name HB2 ))
   (( segid "    " and resid 7    and name HG1 ))
 ASSI { 1000}
   (( segid "    " and resid 84   and name HB1 ))
   (( segid "    " and resid 84   and name HA  ))
      2.200     0.600     0.600 peak  1000 spectrum    1 weight  0.11000E+01 volume  0.10139E-01 ppm1      2.302 ppm2      4.424 CV     1
 OR { 1000}
   (( segid "    " and resid 52   and name HB1 ))
   (( segid "    " and resid 52   and name HA  ))
 ASSI { 1001}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 52   and name HA  ))
      2.900     1.000     1.000 peak  1001 spectrum    1 weight  0.11000E+01 volume  0.38751E-02 ppm1      1.911 ppm2      4.423 CV     1
 OR { 1001}
   (( segid "    " and resid 84   and name HB2 ))
   (( segid "    " and resid 84   and name HA  ))
 ASSI { 1002}
   (( segid "    " and resid 106  and name HG1 ))
   (( segid "    " and resid 106  and name HG2 ))
      1.700     0.300     0.500 peak  1002 spectrum    1 weight  0.11000E+01 volume  0.22602E-01 ppm1      2.282 ppm2      1.914 CV     1
 OR { 1002}
   (( segid "    " and resid 84   and name HB1 ))
   (( segid "    " and resid 84   and name HB2 ))
 OR { 1002}
   (( segid "    " and resid 52   and name HB1 ))
   (( segid "    " and resid 52   and name HB2 ))
 ASSI { 1009}
   (( segid "    " and resid 121  and name HA  ))
   (( segid "    " and resid 121  and name HB1 ))
      4.300     2.300     1.700 peak  1009 spectrum    1 weight  0.11000E+01 volume  0.27154E-03 ppm1      4.463 ppm2      3.255 CV     1
 OR { 1009}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 79   and name HD1 ))
 OR { 1009}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 79   and name HD2 ))
 ASSI { 1052}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 107  and name HB1 ))
      4.300     2.400     1.700 peak  1052 spectrum    1 weight  0.11000E+01 volume  0.16980E-03 ppm1      4.767 ppm2      2.576 CV     1
 OR { 1052}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 38   and name HB2 ))
 ASSI { 1093}
   (( segid "    " and resid 149  and name HA  ))
   (( segid "    " and resid 149  and name HB2 ))
      4.200     2.200     1.800 peak  1093 spectrum    1 weight  0.11000E+01 volume  0.30192E-03 ppm1      4.836 ppm2      2.507 CV     1
 OR { 1093}
   (( segid "    " and resid 149  and name HA  ))
   (( segid "    " and resid 64   and name HG1 ))
 ASSI { 1107}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 64   and name HB2 ))
      4.400     2.400     1.600 peak  1107 spectrum    1 weight  0.11000E+01 volume  0.41941E-03 ppm1      4.449 ppm2      1.630 CV     1
 OR { 1107}
   (( segid "    " and resid 128  and name HA  ))
   (( segid "    " and resid 128  and name HG2 ))
 ASSI { 1110}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 64   and name HG1 ))
      5.800     4.200     0.200 peak  1110 spectrum    1 weight  0.11000E+01 volume  0.20455E-03 ppm1      4.482 ppm2      2.479 CV     1
 OR { 1110}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 149  and name HB2 ))
 ASSI { 1169}
   (( segid "    " and resid 7    and name HG1 ))
   (( segid "    " and resid 7    and name HA  ))
      3.400     1.400     1.400 peak  1169 spectrum    1 weight  0.11000E+01 volume  0.21714E-02 ppm1      2.255 ppm2      4.289 CV     1
 OR { 1169}
   (( segid "    " and resid 10   and name HG1 ))
   (( segid "    " and resid 10   and name HA  ))
 ASSI { 1171}
   (( segid "    " and resid 7    and name HG1 ))
   (( segid "    " and resid 7    and name HG2 ))
      1.900     0.400     0.400 peak  1171 spectrum    1 weight  0.11000E+01 volume  0.25078E-01 ppm1      2.253 ppm2      2.064 CV     1
 OR { 1171}
   (( segid "    " and resid 10   and name HG2 ))
   (( segid "    " and resid 10   and name HB1 ))
 OR { 1171}
   (( segid "    " and resid 7    and name HG1 ))
   (( segid "    " and resid 7    and name HB1 ))
 ASSI { 1176}
   (( segid "    " and resid 7    and name HG1 ))
   (( segid "    " and resid 7    and name HB2 ))
      3.100     1.200     1.200 peak  1176 spectrum    1 weight  0.11000E+01 volume  0.28789E-02 ppm1      2.254 ppm2      1.944 CV     1
 OR { 1176}
   (( segid "    " and resid 10   and name HG1 ))
   (( segid "    " and resid 10   and name HB2 ))
 OR { 1176}
   (( segid "    " and resid 10   and name HG2 ))
   (( segid "    " and resid 10   and name HB2 ))
 ASSI { 1178}
   (( segid "    " and resid 79   and name HB1 ))
   (( segid "    " and resid 79   and name HA  ))
      3.100     1.200     1.200 peak  1178 spectrum    1 weight  0.11000E+01 volume  0.17819E-02 ppm1      1.884 ppm2      4.509 CV     1
 OR { 1178}
   (( segid "    " and resid 26   and name HB1 ))
   (( segid "    " and resid 26   and name HA  ))
 OR { 1178}
   (( segid "    " and resid 26   and name HB2 ))
   (( segid "    " and resid 26   and name HA  ))
 ASSI { 1188}
   (( segid "    " and resid 123  and name HA2 ))
   (( segid "    " and resid 123  and name HA1 ))
      2.500     2.500     3.500 peak  1188 spectrum    1 weight  0.11000E+01 volume  0.16607E-02 ppm1      3.598 ppm2      4.139 CV     1
 OR { 1188}
   (( segid "    " and resid 41   and name HA2 ))
   (( segid "    " and resid 41   and name HA1 ))
 ASSI { 1198}
   (( segid "    " and resid 109  and name HA2 ))
   (( segid "    " and resid 109  and name HA1 ))
      2.900     2.900     3.100 peak  1198 spectrum    1 weight  0.11000E+01 volume  0.13379E-02 ppm1      3.752 ppm2      4.409 CV     1
 OR { 1198}
   (( segid "    " and resid 77   and name HA2 ))
   (( segid "    " and resid 77   and name HA1 ))
 ASSI { 1207}
   (( segid "    " and resid 82   and name HG2 ))
   (( segid "    " and resid 82   and name HG1 ))
      2.200     0.600     0.600 peak  1207 spectrum    1 weight  0.11000E+01 volume  0.59733E-02 ppm1      2.062 ppm2      2.218 CV     1
 OR { 1207}
   (( segid "    " and resid 151  and name HG2 ))
   (( segid "    " and resid 151  and name HG1 ))
 ASSI { 1208}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 71   and name HA  ))
      2.800     1.000     1.000 peak  1208 spectrum    1 weight  0.11000E+01 volume  0.25163E-02 ppm1      2.113 ppm2      5.045 CV     1
 OR { 1208}
   (( segid "    " and resid 82   and name HB1 ))
   (( segid "    " and resid 82   and name HA  ))
 ASSI { 1210}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 71   and name HB1 ))
      1.800     1.800     4.200 peak  1210 spectrum    1 weight  0.11000E+01 volume  0.14211E-01 ppm1      2.039 ppm2      2.089 CV     1
 OR { 1210}
   (( segid "    " and resid 82   and name HB2 ))
   (( segid "    " and resid 82   and name HB1 ))
 ASSI { 1213}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 82   and name HG1 ))
      3.400     1.500     1.500 peak  1213 spectrum    1 weight  0.11000E+01 volume  0.17228E-02 ppm1      5.055 ppm2      2.198 CV     1
 OR { 1213}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 82   and name HB1 ))
 OR { 1213}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 71   and name HG2 ))
 ASSI { 1214}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 82   and name HB2 ))
      3.300     1.400     1.400 peak  1214 spectrum    1 weight  0.11000E+01 volume  0.13763E-02 ppm1      5.063 ppm2      2.050 CV     1
 OR { 1214}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 82   and name HG2 ))
 OR { 1214}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 71   and name HB2 ))
 ASSI { 1215}
   (( segid "    " and resid 82   and name HB2 ))
   (( segid "    " and resid 82   and name HA  ))
      3.100     1.200     1.200 peak  1215 spectrum    1 weight  0.11000E+01 volume  0.23445E-02 ppm1      2.069 ppm2      5.062 CV     1
 OR { 1215}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 71   and name HA  ))
 OR { 1215}
   (( segid "    " and resid 83   and name HB1 ))
   (( segid "    " and resid 83   and name HA  ))
 ASSI { 1216}
   (( segid "    " and resid 83   and name HB1 ))
   (( segid "    " and resid 83   and name HG1 ))
      2.400     0.700     0.700 peak  1216 spectrum    1 weight  0.11000E+01 volume  0.70660E-02 ppm1      2.062 ppm2      2.186 CV     1
 OR { 1216}
   (( segid "    " and resid 82   and name HB2 ))
   (( segid "    " and resid 82   and name HG1 ))
 OR { 1216}
   (( segid "    " and resid 83   and name HB1 ))
   (( segid "    " and resid 83   and name HG2 ))
 ASSI { 1217}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 71   and name HB2 ))
      1.700     0.400     0.500 peak  1217 spectrum    1 weight  0.11000E+01 volume  0.20056E-01 ppm1      2.094 ppm2      2.038 CV     1
 OR { 1217}
   (( segid "    " and resid 82   and name HB1 ))
   (( segid "    " and resid 82   and name HB2 ))
 OR { 1217}
   (( segid "    " and resid 82   and name HB1 ))
   (( segid "    " and resid 82   and name HG2 ))
 ASSI { 1218}
   (( segid "    " and resid 151  and name HB1 ))
   (( segid "    " and resid 151  and name HB2 ))
      2.000     0.500     0.500 peak  1218 spectrum    1 weight  0.11000E+01 volume  0.11366E-01 ppm1      2.052 ppm2      1.944 CV     1
 OR { 1218}
   (( segid "    " and resid 10   and name HB1 ))
   (( segid "    " and resid 10   and name HB2 ))
 OR { 1218}
   (( segid "    " and resid 7    and name HB1 ))
   (( segid "    " and resid 7    and name HB2 ))
 ASSI { 1227}
   (( segid "    " and resid 151  and name HA  ))
   (( segid "    " and resid 151  and name HB1 ))
      3.200     1.300     1.300 peak  1227 spectrum    1 weight  0.11000E+01 volume  0.23774E-02 ppm1      4.282 ppm2      2.069 CV     1
 OR { 1227}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 7    and name HB1 ))
 OR { 1227}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 7    and name HG2 ))
 ASSI { 1232}
   (( segid "    " and resid 26   and name HB2 ))
   (( segid "    " and resid 26   and name HB1 ))
      1.100     1.100     4.900 peak  1232 spectrum    1 weight  0.11000E+01 volume  0.26725E+00 ppm1      1.912 ppm2      1.920 CV     1
 OR { 1232}
   (( segid "    " and resid 26   and name HB1 ))
   (( segid "    " and resid 26   and name HB2 ))
 OR { 1232}
   (( segid "    " and resid 79   and name HB2 ))
   (( segid "    " and resid 79   and name HB1 ))
 OR { 1232}
   (( segid "    " and resid 79   and name HB1 ))
   (( segid "    " and resid 79   and name HB2 ))
 ASSI { 1289}
   (( segid "    " and resid 84   and name HD2 ))
   (( segid "    " and resid 84   and name HD1 ))
      1.600     1.600     4.400 peak  1289 spectrum    1 weight  0.11000E+01 volume  0.23421E-01 ppm1      3.655 ppm2      3.818 CV     1
 OR { 1289}
   (( segid "    " and resid 130  and name HD2 ))
   (( segid "    " and resid 130  and name HD1 ))
 ASSI { 1481}
   (( segid "    " and resid 39   and name HG11))
   (( segid "    " and resid 46   and name HA  ))
      4.000     2.000     2.000 peak  1481 spectrum    1 weight  0.11000E+01 volume  0.21313E-03 ppm1      1.805 ppm2      5.936 CV     1
 OR { 1481}
   (( segid "    " and resid 47   and name HD1 ))
   (( segid "    " and resid 47   and name HA  ))
 ASSI { 1719}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 79   and name HG2 ))
      4.100     2.100     1.900 peak  1719 spectrum    1 weight  0.11000E+01 volume  0.20268E-03 ppm1      4.467 ppm2      1.691 CV     1
 OR { 1719}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 79   and name HG1 ))
 OR { 1719}
   (( segid "    " and resid 128  and name HA  ))
   (( segid "    " and resid 128  and name HG1 ))
 ASSI { 1770}
   (( segid "    " and resid 65   and name HA  ))
   (  segid "    " and resid 89   and name HG2%)
      5.400     3.600     0.600 peak  1770 spectrum    1 weight  0.11000E+01 volume  0.30610E-03 ppm1      4.266 ppm2      0.991 CV     1
 OR { 1770}
   (( segid "    " and resid 65   and name HA  ))
   (  segid "    " and resid 87   and name HG1%)
 ASSI { 1778}
   (  segid "    " and resid 108  and name HG2%)
   (  segid "    " and resid 147  and name HB% )
      3.200     1.300     1.300 peak  1778 spectrum    1 weight  0.10000E+01 volume  0.17693E-02 ppm1      0.848 ppm2      1.139 CV     1
 OR { 1778}
   (  segid "    " and resid 44   and name HD2%)
   (  segid "    " and resid 116  and name HB% )
 ASSI { 1780}
   (  segid "    " and resid 44   and name HD2%)
   (( segid "    " and resid 43   and name HA1 ))
      4.600     2.600     1.400 peak  1780 spectrum    1 weight  0.10000E+01 volume  0.10036E-02 ppm1      0.868 ppm2      4.059 CV     1
 OR { 1780}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 57   and name HB1 ))
 ASSI { 1783}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 59   and name HA  ))
      4.300     2.400     1.700 peak  1783 spectrum    1 weight  0.10000E+01 volume  0.10297E-02 ppm1      0.846 ppm2      5.232 CV     1
 OR { 1783}
   (  segid "    " and resid 44   and name HD2%)
   (( segid "    " and resid 45   and name HA  ))
 ASSI { 1785}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 58   and name HN  ))
      5.500     3.800     0.500 peak  1785 spectrum    1 weight  0.10000E+01 volume  0.13293E-03 ppm1      0.831 ppm2      8.163 CV     1
 OR { 1785}
   (  segid "    " and resid 44   and name HD2%)
   (( segid "    " and resid 117  and name HN  ))
 ASSI { 1786}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 147  and name HN  ))
      5.000     3.100     1.000 peak  1786 spectrum    1 weight  0.10000E+01 volume  0.20369E-03 ppm1      0.833 ppm2      8.291 CV     1
 OR { 1786}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 39   and name HN  ))
 OR { 1786}
   (  segid "    " and resid 44   and name HD2%)
   (( segid "    " and resid 39   and name HN  ))
 ASSI { 1792}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 150  and name HB1 ))
      5.500     3.800     0.500 peak  1792 spectrum    1 weight  0.10000E+01 volume  0.18312E-03 ppm1      0.470 ppm2      1.603 CV     1
 OR { 1792}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 150  and name HB2 ))
 OR { 1792}
   (  segid "    " and resid 15   and name HD2%)
   (( segid "    " and resid 17   and name HB2 ))
 OR { 1792}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 64   and name HB2 ))
 ASSI { 1801}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 88   and name HA  ))
      4.700     2.800     1.300 peak  1801 spectrum    1 weight  0.10000E+01 volume  0.27340E-03 ppm1      0.467 ppm2      4.993 CV     1
 OR { 1801}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 147  and name HA  ))
 ASSI { 1802}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 87   and name HA  ))
      4.800     2.800     1.200 peak  1802 spectrum    1 weight  0.11000E+01 volume  0.34701E-03 ppm1      0.467 ppm2      5.360 CV     1
 OR { 1802}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 67   and name HA  ))
 ASSI { 1809}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 148  and name HA  ))
      4.500     2.500     1.500 peak  1809 spectrum    1 weight  0.11000E+01 volume  0.73189E-03 ppm1      5.076 ppm2      4.627 CV     1
 OR { 1809}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 89   and name HA  ))
 ASSI { 1819}
   (( segid "    " and resid 66   and name HB  ))
   (  segid "    " and resid 68   and name HG2%)
      4.500     2.600     1.500 peak  1819 spectrum    1 weight  0.11000E+01 volume  0.47234E-03 ppm1      1.687 ppm2      0.953 CV     1
 OR { 1819}
   (( segid "    " and resid 66   and name HB  ))
   (  segid "    " and resid 87   and name HG1%)
 ASSI { 1821}
   (( segid "    " and resid 66   and name HB  ))
   (( segid "    " and resid 60   and name HD1 ))
      5.900     4.400     0.100 peak  1821 spectrum    1 weight  0.10000E+01 volume  0.28995E-03 ppm1      1.699 ppm2      3.606 CV     1
 OR { 1821}
   (( segid "    " and resid 66   and name HB  ))
   (( segid "    " and resid 104  and name HD1 ))
 ASSI { 1823}
   (( segid "    " and resid 66   and name HB  ))
   (( segid "    " and resid 67   and name HA  ))
      5.600     3.900     0.400 peak  1823 spectrum    1 weight  0.11000E+01 volume  0.91076E-04 ppm1      1.689 ppm2      5.321 CV     1
 OR { 1823}
   (( segid "    " and resid 66   and name HB  ))
   (( segid "    " and resid 87   and name HA  ))
 ASSI { 1829}
   (  segid "    " and resid 66   and name HG1%)
   (  segid "    " and resid 144  and name HD2%)
      3.500     1.500     1.500 peak  1829 spectrum    1 weight  0.10000E+01 volume  0.26594E-02 ppm1      0.685 ppm2      0.850 CV     1
 OR { 1829}
   (  segid "    " and resid 66   and name HG1%)
   (  segid "    " and resid 108  and name HG2%)
 OR { 1829}
   (  segid "    " and resid 66   and name HG1%)
   (  segid "    " and resid 148  and name HG2%)
 ASSI { 1832}
   (  segid "    " and resid 66   and name HG1%)
   (( segid "    " and resid 64   and name HG2 ))
      5.200     3.400     0.800 peak  1832 spectrum    1 weight  0.10000E+01 volume  0.31100E-03 ppm1      0.685 ppm2      2.162 CV     1
 OR { 1832}
   (  segid "    " and resid 66   and name HG1%)
   (( segid "    " and resid 148  and name HB  ))
 ASSI { 1844}
   (  segid "    " and resid 66   and name HG1%)
   (( segid "    " and resid 61   and name HN  ))
      6.000     4.600     0.000 peak  1844 spectrum    1 weight  0.10000E+01 volume  0.15533E-03 ppm1      0.689 ppm2      7.914 CV     1
 OR { 1844}
   (  segid "    " and resid 66   and name HG1%)
   (( segid "    " and resid 103  and name HN  ))
 ASSI { 1854}
   (  segid "    " and resid 66   and name HG2%)
   (( segid "    " and resid 88   and name HB1 ))
      6.000     5.000     0.000 peak  1854 spectrum    1 weight  0.10000E+01 volume  0.13693E-03 ppm1      0.029 ppm2      3.148 CV     1
 OR { 1854}
   (  segid "    " and resid 66   and name HG2%)
   (( segid "    " and resid 88   and name HB2 ))
 OR { 1854}
   (  segid "    " and resid 66   and name HG2%)
   (( segid "    " and resid 104  and name HD2 ))
 ASSI { 1896}
   (( segid "    " and resid 68   and name HB  ))
   (( segid "    " and resid 69   and name HA  ))
      4.900     3.000     1.100 peak  1896 spectrum    1 weight  0.11000E+01 volume  0.19671E-03 ppm1      2.220 ppm2      5.394 CV     1
 OR { 1896}
   (( segid "    " and resid 68   and name HB  ))
   (( segid "    " and resid 70   and name HA  ))
 ASSI { 1903}
   (  segid "    " and resid 67   and name HG2%)
   (( segid "    " and resid 145  and name HG2 ))
      4.200     2.300     1.800 peak  1903 spectrum    1 weight  0.10000E+01 volume  0.13287E-02 ppm1      1.086 ppm2      1.419 CV     1
 OR { 1903}
   (  segid "    " and resid 68   and name HG1%)
   (( segid "    " and resid 144  and name HG  ))
 OR { 1903}
   (  segid "    " and resid 68   and name HG1%)
   (( segid "    " and resid 145  and name HG2 ))
 ASSI { 1909}
   (  segid "    " and resid 67   and name HG2%)
   (( segid "    " and resid 147  and name HN  ))
      6.000     6.000     0.000 peak  1909 spectrum    1 weight  0.10000E+01 volume  0.77760E-04 ppm1      1.093 ppm2      8.286 CV     1
 OR { 1909}
   (  segid "    " and resid 67   and name HG2%)
   (( segid "    " and resid 85   and name HN  ))
 ASSI { 1913}
   (  segid "    " and resid 68   and name HG2%)
   (( segid "    " and resid 66   and name HB  ))
      3.800     1.800     1.800 peak  1913 spectrum    1 weight  0.11000E+01 volume  0.16331E-02 ppm1      0.960 ppm2      1.711 CV     1
 OR { 1913}
   (  segid "    " and resid 68   and name HG2%)
   (( segid "    " and resid 145  and name HD2 ))
 ASSI { 1914}
   (  segid "    " and resid 61   and name HG1%)
   (( segid "    " and resid 61   and name HA  ))
      3.400     1.400     1.400 peak  1914 spectrum    1 weight  0.10000E+01 volume  0.21665E-02 ppm1      0.960 ppm2      4.418 CV     1
 OR { 1914}
   (  segid "    " and resid 89   and name HG2%)
   (( segid "    " and resid 63   and name HA1 ))
 ASSI { 1915}
   (  segid "    " and resid 68   and name HG2%)
   (( segid "    " and resid 67   and name HA  ))
      3.600     3.600     2.400 peak  1915 spectrum    1 weight  0.11000E+01 volume  0.24353E-02 ppm1      0.983 ppm2      5.366 CV     1
 OR { 1915}
   (  segid "    " and resid 68   and name HG2%)
   (( segid "    " and resid 87   and name HA  ))
 ASSI { 1927}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 62   and name HG2 ))
      5.500     3.800     0.500 peak  1927 spectrum    1 weight  0.10000E+01 volume  0.34943E-03 ppm1      1.997 ppm2      1.368 CV     1
 OR { 1927}
   (( segid "    " and resid 60   and name HB1 ))
   (( segid "    " and resid 62   and name HG2 ))
 OR { 1927}
   (( segid "    " and resid 110  and name HB2 ))
   (( segid "    " and resid 47   and name HG1 ))
 OR { 1927}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 99   and name HG  ))
 OR { 1927}
   (( segid "    " and resid 110  and name HB2 ))
   (( segid "    " and resid 47   and name HG2 ))
 OR { 1927}
   (( segid "    " and resid 60   and name HB1 ))
   (( segid "    " and resid 99   and name HG  ))
 ASSI { 1932}
   (  segid "    " and resid 80   and name HG2%)
   (( segid "    " and resid 79   and name HG2 ))
      5.500     3.800     0.500 peak  1932 spectrum    1 weight  0.10000E+01 volume  0.45538E-03 ppm1      0.775 ppm2      1.630 CV     1
 OR { 1932}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 64   and name HB2 ))
 ASSI { 1945}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 86   and name HA  ))
      4.300     2.300     1.700 peak  1945 spectrum    1 weight  0.10000E+01 volume  0.68821E-03 ppm1      5.341 ppm2      4.636 CV     1
 OR { 1945}
   (( segid "    " and resid 87   and name HA  ))
   (( segid "    " and resid 86   and name HA  ))
 ASSI { 1987}
   (  segid "    " and resid 80   and name HG1%)
   (( segid "    " and resid 132  and name HA  ))
      3.400     3.400     2.600 peak  1987 spectrum    1 weight  0.10000E+01 volume  0.28433E-02 ppm1      0.984 ppm2      4.145 CV     1
 OR { 1987}
   (  segid "    " and resid 87   and name HG1%)
   (( segid "    " and resid 89   and name HB  ))
 ASSI { 1998}
   (( segid "    " and resid 95   and name HB  ))
   (  segid "    " and resid 99   and name HD2%)
      3.400     1.400     1.400 peak  1998 spectrum    1 weight  0.11000E+01 volume  0.12653E-02 ppm1      1.806 ppm2      0.772 CV     1
 OR { 1998}
   (( segid "    " and resid 95   and name HB  ))
   (  segid "    " and resid 96   and name HD1%)
 ASSI { 2007}
   (( segid "    " and resid 95   and name HB  ))
   (( segid "    " and resid 99   and name HN  ))
      4.900     3.000     1.100 peak  2007 spectrum    1 weight  0.10000E+01 volume  0.44303E-03 ppm1      1.789 ppm2      7.228 CV     1
 OR { 2007}
   (( segid "    " and resid 95   and name HB  ))
   (( segid "    " and resid 100  and name HN  ))
 ASSI { 2062}
   (( segid "    " and resid 57   and name HA  ))
   (  segid "    " and resid 108  and name HG2%)
      6.000     4.900     0.000 peak  2062 spectrum    1 weight  0.10000E+01 volume  0.13595E-03 ppm1      4.320 ppm2      0.851 CV     1
 OR { 2062}
   (( segid "    " and resid 145  and name HA  ))
   (  segid "    " and resid 144  and name HD2%)
 OR { 2062}
   (( segid "    " and resid 145  and name HA  ))
   (  segid "    " and resid 108  and name HG2%)
 ASSI { 2089}
   (  segid "    " and resid 99   and name HD1%)
   (( segid "    " and resid 99   and name HG  ))
      2.600     0.800     0.800 peak  2089 spectrum    1 weight  0.10000E+01 volume  0.33070E-02 ppm1      1.311 ppm2      1.407 CV     1
 OR { 2089}
   (  segid "    " and resid 103  and name HG1%)
   (( segid "    " and resid 99   and name HG  ))
 ASSI { 2097}
   (  segid "    " and resid 99   and name HD1%)
   (( segid "    " and resid 88   and name HZ  ))
      3.500     1.500     1.500 peak  2097 spectrum    1 weight  0.11000E+01 volume  0.19737E-02 ppm1      1.305 ppm2      6.852 CV     1
 OR { 2097}
   (  segid "    " and resid 103  and name HG1%)
   (( segid "    " and resid 88   and name HZ  ))
 ASSI { 2100}
   (  segid "    " and resid 103  and name HG1%)
   (( segid "    " and resid 106  and name HN  ))
      4.500     2.500     1.500 peak  2100 spectrum    1 weight  0.10000E+01 volume  0.36240E-03 ppm1      1.305 ppm2      7.894 CV     1
 OR { 2100}
   (  segid "    " and resid 99   and name HD1%)
   (( segid "    " and resid 106  and name HN  ))
 ASSI { 2107}
   (  segid "    " and resid 103  and name HG2%)
   (( segid "    " and resid 144  and name HA  ))
      4.900     3.000     1.100 peak  2107 spectrum    1 weight  0.10000E+01 volume  0.44213E-03 ppm1      1.017 ppm2      4.673 CV     1
 OR { 2107}
   (  segid "    " and resid 37   and name HD1%)
   (( segid "    " and resid 36   and name HA  ))
 ASSI { 2168}
   (  segid "    " and resid 108  and name HG2%)
   (  segid "    " and resid 103  and name HG1%)
      4.400     2.400     1.600 peak  2168 spectrum    1 weight  0.10000E+01 volume  0.21340E-02 ppm1      0.851 ppm2      1.275 CV     1
 OR { 2168}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 144  and name HB2 ))
 ASSI { 2175}
   (  segid "    " and resid 65   and name HG1%)
   (( segid "    " and resid 65   and name HA  ))
      3.100     1.200     1.200 peak  2175 spectrum    1 weight  0.10000E+01 volume  0.50263E-02 ppm1      0.843 ppm2      4.269 CV     1
 OR { 2175}
   (  segid "    " and resid 15   and name HD1%)
   (( segid "    " and resid 15   and name HA  ))
 ASSI { 2176}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 109  and name HA1 ))
      3.800     1.800     1.800 peak  2176 spectrum    1 weight  0.10000E+01 volume  0.20485E-02 ppm1      0.837 ppm2      4.383 CV     1
 OR { 2176}
   (  segid "    " and resid 65   and name HG1%)
   (( segid "    " and resid 90   and name HA  ))
 OR { 2176}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 44   and name HA  ))
 ASSI { 2192}
   (( segid "    " and resid 114  and name HA  ))
   (( segid "    " and resid 113  and name HB2 ))
      6.000     4.500     0.000 peak  2192 spectrum    1 weight  0.10000E+01 volume  0.12595E-03 ppm1      5.630 ppm2      1.886 CV     1
 OR { 2192}
   (( segid "    " and resid 114  and name HA  ))
   (( segid "    " and resid 140  and name HB1 ))
 ASSI { 2219}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 51   and name HA  ))
      3.400     1.400     1.400 peak  2219 spectrum    1 weight  0.10000E+01 volume  0.15382E-02 ppm1      0.901 ppm2      4.502 CV     1
 OR { 2219}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 50   and name HA  ))
 ASSI { 2224}
   (  segid "    " and resid 142  and name HG2%)
   (  segid "    " and resid 112  and name HB% )
      3.300     1.400     1.400 peak  2224 spectrum    1 weight  0.10000E+01 volume  0.19099E-02 ppm1      0.863 ppm2      1.552 CV     1
 OR { 2224}
   (  segid "    " and resid 114  and name HG2%)
   (  segid "    " and resid 112  and name HB% )
 ASSI { 2231}
   (  segid "    " and resid 142  and name HG2%)
   (( segid "    " and resid 141  and name HA  ))
      4.300     2.300     1.700 peak  2231 spectrum    1 weight  0.10000E+01 volume  0.11662E-02 ppm1      0.857 ppm2      5.227 CV     1
 OR { 2231}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 141  and name HA  ))
 ASSI { 2260}
   (( segid "    " and resid 142  and name HB  ))
   (( segid "    " and resid 70   and name HA  ))
      6.000     6.000     0.000 peak  2260 spectrum    1 weight  0.11000E+01 volume  0.81591E-04 ppm1      1.999 ppm2      5.396 CV     1
 OR { 2260}
   (( segid "    " and resid 142  and name HB  ))
   (( segid "    " and resid 69   and name HA  ))
 ASSI { 2262}
   (( segid "    " and resid 143  and name HA  ))
   (( segid "    " and resid 142  and name HA  ))
      5.800     4.200     0.200 peak  2262 spectrum    1 weight  0.11000E+01 volume  0.11542E-03 ppm1      5.614 ppm2      5.063 CV     1
 OR { 2262}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 142  and name HA  ))
 ASSI { 2263}
   (( segid "    " and resid 142  and name HB  ))
   (( segid "    " and resid 143  and name HA  ))
      5.200     3.400     0.800 peak  2263 spectrum    1 weight  0.11000E+01 volume  0.14346E-03 ppm1      1.999 ppm2      5.632 CV     1
 OR { 2263}
   (( segid "    " and resid 142  and name HB  ))
   (( segid "    " and resid 111  and name HA  ))
 ASSI { 2302}
   (  segid "    " and resid 142  and name HG1%)
   (( segid "    " and resid 143  and name HA  ))
      4.000     2.000     2.000 peak  2302 spectrum    1 weight  0.11000E+01 volume  0.19648E-02 ppm1      0.922 ppm2      5.606 CV     1
 OR { 2302}
   (  segid "    " and resid 142  and name HG1%)
   (( segid "    " and resid 111  and name HA  ))
 ASSI { 2303}
   (( segid "    " and resid 111  and name HA  ))
   (  segid "    " and resid 50   and name HD1%)
      5.100     3.300     0.900 peak  2303 spectrum    1 weight  0.11000E+01 volume  0.27601E-03 ppm1      5.619 ppm2      0.854 CV     1
 OR { 2303}
   (( segid "    " and resid 111  and name HA  ))
   (  segid "    " and resid 142  and name HG2%)
 ASSI { 2312}
   (( segid "    " and resid 148  and name HB  ))
   (( segid "    " and resid 150  and name HB1 ))
      4.400     2.500     1.600 peak  2312 spectrum    1 weight  0.10000E+01 volume  0.32104E-03 ppm1      2.119 ppm2      1.598 CV     1
 OR { 2312}
   (( segid "    " and resid 148  and name HB  ))
   (( segid "    " and resid 64   and name HB2 ))
 OR { 2312}
   (( segid "    " and resid 148  and name HB  ))
   (( segid "    " and resid 150  and name HB2 ))
 ASSI { 2338}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 38   and name HA  ))
      5.400     3.600     0.600 peak  2338 spectrum    1 weight  0.10000E+01 volume  0.23409E-03 ppm1      1.731 ppm2      4.797 CV     1
 OR { 2338}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 38   and name HA  ))
 ASSI { 2345}
   (( segid "    " and resid 44   and name HB2 ))
   (  segid "    " and resid 120  and name HE% )
      4.400     2.400     1.600 peak  2345 spectrum    1 weight  0.10000E+01 volume  0.65742E-03 ppm1      1.697 ppm2      6.703 CV     1
 OR { 2345}
   (( segid "    " and resid 45   and name HB1 ))
   (  segid "    " and resid 120  and name HE% )
 ASSI { 2346}
   (( segid "    " and resid 44   and name HB2 ))
   (  segid "    " and resid 120  and name HD% )
      4.900     2.900     1.100 peak  2346 spectrum    1 weight  0.10000E+01 volume  0.23322E-03 ppm1      1.699 ppm2      6.934 CV     1
 OR { 2346}
   (( segid "    " and resid 45   and name HB1 ))
   (  segid "    " and resid 120  and name HD% )
 ASSI { 2348}
   (( segid "    " and resid 45   and name HB1 ))
   (  segid "    " and resid 40   and name HD2%)
      4.900     3.000     1.100 peak  2348 spectrum    1 weight  0.10000E+01 volume  0.37453E-03 ppm1      1.734 ppm2      0.602 CV     1
 OR { 2348}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 119  and name HG2 ))
 ASSI { 2351}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 40   and name HG  ))
      3.700     1.700     1.700 peak  2351 spectrum    1 weight  0.10000E+01 volume  0.12559E-02 ppm1      1.736 ppm2      1.365 CV     1
 OR { 2351}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 46   and name HG2 ))
 OR { 2351}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 46   and name HG1 ))
 OR { 2351}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 46   and name HG1 ))
 OR { 2351}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 119  and name HD2 ))
 OR { 2351}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 46   and name HG2 ))
 ASSI { 2354}
   (( segid "    " and resid 70   and name HG  ))
   (( segid "    " and resid 81   and name HG2 ))
      5.800     4.300     0.200 peak  2354 spectrum    1 weight  0.10000E+01 volume  0.18528E-03 ppm1      1.484 ppm2      2.188 CV     1
 OR { 2354}
   (( segid "    " and resid 70   and name HG  ))
   (( segid "    " and resid 71   and name HG2 ))
 OR { 2354}
   (( segid "    " and resid 70   and name HG  ))
   (( segid "    " and resid 83   and name HG2 ))
 ASSI { 2358}
   (( segid "    " and resid 70   and name HG  ))
   (( segid "    " and resid 71   and name HA  ))
      4.400     2.500     1.600 peak  2358 spectrum    1 weight  0.10000E+01 volume  0.30658E-03 ppm1      1.489 ppm2      5.061 CV     1
 OR { 2358}
   (( segid "    " and resid 70   and name HG  ))
   (( segid "    " and resid 142  and name HA  ))
 ASSI { 2368}
   (( segid "    " and resid 47   and name HE1 ))
   (  segid "    " and resid 105  and name HD1%)
      3.800     1.800     1.800 peak  2368 spectrum    1 weight  0.11000E+01 volume  0.90733E-03 ppm1      2.587 ppm2      0.975 CV     1
 OR { 2368}
   (( segid "    " and resid 47   and name HE2 ))
   (  segid "    " and resid 37   and name HD2%)
 OR { 2368}
   (( segid "    " and resid 47   and name HE2 ))
   (  segid "    " and resid 105  and name HD1%)
 ASSI { 2391}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 97   and name HB1 ))
      4.700     2.700     1.300 peak  2391 spectrum    1 weight  0.10000E+01 volume  0.45303E-03 ppm1      0.829 ppm2      2.277 CV     1
 OR { 2391}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 97   and name HB2 ))
 OR { 2391}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 106  and name HG1 ))
 OR { 2391}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 107  and name HB2 ))
 ASSI { 2404}
   (( segid "    " and resid 44   and name HB2 ))
   (( segid "    " and resid 119  and name HG2 ))
      5.000     3.100     1.000 peak  2404 spectrum    1 weight  0.11000E+01 volume  0.55992E-03 ppm1      1.705 ppm2      0.594 CV     1
 OR { 2404}
   (( segid "    " and resid 45   and name HB1 ))
   (  segid "    " and resid 40   and name HD2%)
 ASSI { 2406}
   (( segid "    " and resid 97   and name HG2 ))
   (  segid "    " and resid 40   and name HD1%)
      5.400     3.600     0.600 peak  2406 spectrum    1 weight  0.10000E+01 volume  0.13946E-03 ppm1      2.479 ppm2      0.830 CV     1
 OR { 2406}
   (( segid "    " and resid 97   and name HG2 ))
   (  segid "    " and resid 44   and name HD2%)
 ASSI { 2412}
   (( segid "    " and resid 37   and name HB1 ))
   (( segid "    " and resid 47   and name HE1 ))
      5.400     3.600     0.600 peak  2412 spectrum    1 weight  0.10000E+01 volume  0.11521E-03 ppm1      1.928 ppm2      2.597 CV     1
 OR { 2412}
   (( segid "    " and resid 37   and name HB1 ))
   (( segid "    " and resid 47   and name HE2 ))
 OR { 2412}
   (( segid "    " and resid 37   and name HB1 ))
   (( segid "    " and resid 38   and name HB2 ))
 OR { 2412}
   (( segid "    " and resid 44   and name HB1 ))
   (( segid "    " and resid 120  and name HB2 ))
 ASSI { 2413}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 120  and name HB2 ))
      6.000     5.100     0.000 peak  2413 spectrum    1 weight  0.10000E+01 volume  0.75318E-04 ppm1      1.722 ppm2      2.585 CV     1
 OR { 2413}
   (( segid "    " and resid 44   and name HB2 ))
   (( segid "    " and resid 120  and name HB2 ))
 OR { 2413}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 47   and name HE1 ))
 OR { 2413}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 47   and name HE2 ))
 OR { 2413}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 38   and name HB1 ))
 ASSI { 2430}
   (  segid "    " and resid 70   and name HD1%)
   (  segid "    " and resid 72   and name HG2%)
      3.500     1.500     1.500 peak  2430 spectrum    1 weight  0.10000E+01 volume  0.33046E-02 ppm1      0.940 ppm2      1.180 CV     1
 OR { 2430}
   (  segid "    " and resid 140  and name HD1%)
   (  segid "    " and resid 72   and name HG2%)
 ASSI { 2438}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 70   and name HA  ))
      3.800     1.800     1.800 peak  2438 spectrum    1 weight  0.10000E+01 volume  0.28496E-02 ppm1      0.946 ppm2      5.378 CV     1
 OR { 2438}
   (  segid "    " and resid 140  and name HD1%)
   (( segid "    " and resid 70   and name HA  ))
 ASSI { 2448}
   (  segid "    " and resid 40   and name HD1%)
   (  segid "    " and resid 120  and name HD% )
      4.000     2.000     2.000 peak  2448 spectrum    1 weight  0.11000E+01 volume  0.37238E-03 ppm1      0.835 ppm2      6.934 CV     1
 OR { 2448}
   (  segid "    " and resid 44   and name HD2%)
   (  segid "    " and resid 120  and name HD% )
 ASSI { 2492}
   (( segid "    " and resid 45   and name HG  ))
   (( segid "    " and resid 38   and name HB1 ))
      6.000     6.000     0.000 peak  2492 spectrum    1 weight  0.10000E+01 volume  0.49434E-04 ppm1      1.264 ppm2      2.627 CV     1
 OR { 2492}
   (( segid "    " and resid 45   and name HG  ))
   (( segid "    " and resid 97   and name HG1 ))
 OR { 2492}
   (( segid "    " and resid 45   and name HG  ))
   (( segid "    " and resid 47   and name HE2 ))
 ASSI { 2499}
   (( segid "    " and resid 45   and name HG  ))
   (( segid "    " and resid 45   and name HN  ))
      6.000     5.400     0.000 peak  2499 spectrum    1 weight  0.10000E+01 volume  0.44896E-04 ppm1      1.270 ppm2      8.389 CV     1
 OR { 2499}
   (( segid "    " and resid 17   and name HG2 ))
   (( segid "    " and resid 18   and name HN  ))
 ASSI { 2509}
   (  segid "    " and resid 101  and name HD2%)
   (  segid "    " and resid 101  and name HD1%)
      3.400     1.400     1.400 peak  2509 spectrum    1 weight  0.10000E+01 volume  0.16980E-02 ppm1      0.517 ppm2      0.691 CV     1
 OR { 2509}
   (  segid "    " and resid 20   and name HD2%)
   (  segid "    " and resid 20   and name HD1%)
 ASSI { 2524}
   (  segid "    " and resid 101  and name HD2%)
   (( segid "    " and resid 101  and name HN  ))
      6.000     6.000     0.000 peak  2524 spectrum    1 weight  0.10000E+01 volume  0.52625E-04 ppm1      0.511 ppm2      8.202 CV     1
 OR { 2524}
   (  segid "    " and resid 45   and name HD2%)
   (( segid "    " and resid 117  and name HN  ))
 ASSI { 2551}
   (( segid "    " and resid 50   and name HB1 ))
   (  segid "    " and resid 51   and name HG1%)
      6.000     5.700     0.000 peak  2551 spectrum    1 weight  0.10000E+01 volume  0.19706E-03 ppm1      1.534 ppm2      1.069 CV     1
 OR { 2551}
   (( segid "    " and resid 50   and name HB1 ))
   (  segid "    " and resid 49   and name HG2%)
 ASSI { 2562}
   (( segid "    " and resid 59   and name HG2 ))
   (( segid "    " and resid 58   and name HA  ))
      3.300     1.300     1.300 peak  2562 spectrum    1 weight  0.10000E+01 volume  0.79929E-03 ppm1      1.590 ppm2      4.782 CV     1
 OR { 2562}
   (( segid "    " and resid 59   and name HG2 ))
   (( segid "    " and resid 107  and name HA  ))
 ASSI { 2565}
   (( segid "    " and resid 50   and name HG  ))
   (( segid "    " and resid 51   and name HN  ))
      6.000     5.400     0.000 peak  2565 spectrum    1 weight  0.10000E+01 volume  0.52988E-04 ppm1      1.614 ppm2      8.175 CV     1
 OR { 2565}
   (( segid "    " and resid 44   and name HG  ))
   (( segid "    " and resid 117  and name HN  ))
 ASSI { 2603}
   (( segid "    " and resid 70   and name HB1 ))
   (( segid "    " and resid 68   and name HA  ))
      6.000     5.400     0.000 peak  2603 spectrum    1 weight  0.10000E+01 volume  0.73134E-04 ppm1      1.891 ppm2      5.618 CV     1
 OR { 2603}
   (( segid "    " and resid 70   and name HB1 ))
   (( segid "    " and resid 143  and name HA  ))
 ASSI { 2610}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 140  and name HG  ))
      6.000     6.000     0.000 peak  2610 spectrum    1 weight  0.10000E+01 volume  0.49841E-04 ppm1      1.238 ppm2      1.649 CV     1
 OR { 2610}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 86   and name HG  ))
 ASSI { 2611}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 141  and name HG1 ))
      5.400     3.600     0.600 peak  2611 spectrum    1 weight  0.10000E+01 volume  0.31832E-03 ppm1      1.239 ppm2      2.015 CV     1
 OR { 2611}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 141  and name HB1 ))
 OR { 2611}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 86   and name HB1 ))
 OR { 2611}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 114  and name HB  ))
 ASSI { 2633}
   (  segid "    " and resid 70   and name HD1%)
   (  segid "    " and resid 88   and name HE% )
      5.500     3.700     0.500 peak  2633 spectrum    1 weight  0.10000E+01 volume  0.11469E-03 ppm1      0.935 ppm2      7.176 CV     1
 OR { 2633}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 100  and name HN  ))
 ASSI { 2635}
   (  segid "    " and resid 70   and name HD2%)
   (( segid "    " and resid 86   and name HB2 ))
      3.400     1.400     1.400 peak  2635 spectrum    1 weight  0.10000E+01 volume  0.33025E-02 ppm1      0.782 ppm2      1.300 CV     1
 OR { 2635}
   (  segid "    " and resid 70   and name HD2%)
   (( segid "    " and resid 140  and name HB2 ))
 ASSI { 2658}
   (( segid "    " and resid 72   and name HB  ))
   (  segid "    " and resid 70   and name HD1%)
      3.800     3.800     2.200 peak  2658 spectrum    1 weight  0.11000E+01 volume  0.13886E-02 ppm1      4.066 ppm2      0.986 CV     1
 OR { 2658}
   (( segid "    " and resid 72   and name HB  ))
   (  segid "    " and resid 140  and name HD1%)
 ASSI { 2684}
   (( segid "    " and resid 59   and name HG1 ))
   (( segid "    " and resid 108  and name HB  ))
      4.600     2.600     1.400 peak  2684 spectrum    1 weight  0.10000E+01 volume  0.14405E-02 ppm1      1.733 ppm2      2.081 CV     1
 OR { 2684}
   (( segid "    " and resid 79   and name HG1 ))
   (( segid "    " and resid 71   and name HB2 ))
 OR { 2684}
   (( segid "    " and resid 74   and name HG  ))
   (( segid "    " and resid 75   and name HB1 ))
 ASSI { 2686}
   (( segid "    " and resid 78   and name HA  ))
   (( segid "    " and resid 79   and name HG1 ))
      5.600     3.900     0.400 peak  2686 spectrum    1 weight  0.11000E+01 volume  0.25342E-03 ppm1      4.053 ppm2      1.727 CV     1
 OR { 2686}
   (( segid "    " and resid 78   and name HA  ))
   (( segid "    " and resid 74   and name HG  ))
 ASSI { 2727}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 67   and name HA  ))
      6.000     4.500     0.000 peak  2727 spectrum    1 weight  0.10000E+01 volume  0.91526E-04 ppm1      2.042 ppm2      5.350 CV     1
 OR { 2727}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 87   and name HA  ))
 OR { 2727}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 69   and name HA  ))
 ASSI { 2739}
   (( segid "    " and resid 140  and name HG  ))
   (( segid "    " and resid 138  and name HB2 ))
      4.100     2.100     1.900 peak  2739 spectrum    1 weight  0.10000E+01 volume  0.15470E-02 ppm1      1.629 ppm2      1.423 CV     1
 OR { 2739}
   (( segid "    " and resid 128  and name HG2 ))
   (( segid "    " and resid 130  and name HG2 ))
 ASSI { 2747}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 83   and name HB2 ))
      4.200     2.200     1.800 peak  2747 spectrum    1 weight  0.10000E+01 volume  0.11689E-02 ppm1      0.957 ppm2      1.918 CV     1
 OR { 2747}
   (( segid "    " and resid 119  and name HG1 ))
   (( segid "    " and resid 44   and name HB1 ))
 OR { 2747}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 87   and name HB  ))
 ASSI { 2754}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 107  and name HB1 ))
      5.600     3.900     0.400 peak  2754 spectrum    1 weight  0.10000E+01 volume  0.30603E-03 ppm1      0.840 ppm2      2.577 CV     1
 OR { 2754}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 120  and name HB2 ))
 ASSI { 2755}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 97   and name HB1 ))
      4.700     2.800     1.300 peak  2755 spectrum    1 weight  0.10000E+01 volume  0.44078E-03 ppm1      0.830 ppm2      2.286 CV     1
 OR { 2755}
   (  segid "    " and resid 40   and name HD1%)
   (( segid "    " and resid 97   and name HB2 ))
 OR { 2755}
   (  segid "    " and resid 74   and name HD2%)
   (( segid "    " and resid 75   and name HG1 ))
 OR { 2755}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 107  and name HB2 ))
 ASSI { 2761}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 70   and name HB1 ))
      3.700     1.700     1.700 peak  2761 spectrum    1 weight  0.10000E+01 volume  0.10153E-02 ppm1      1.303 ppm2      1.893 CV     1
 OR { 2761}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 83   and name HB2 ))
 ASSI { 2772}
   (( segid "    " and resid 90   and name HG  ))
   (  segid "    " and resid 89   and name HG2%)
      3.800     3.800     2.200 peak  2772 spectrum    1 weight  0.10000E+01 volume  0.22198E-02 ppm1      1.571 ppm2      0.944 CV     1
 OR { 2772}
   (( segid "    " and resid 90   and name HG  ))
   (  segid "    " and resid 68   and name HG2%)
 ASSI { 2785}
   (  segid "    " and resid 45   and name HD1%)
   (( segid "    " and resid 39   and name HG11))
      3.500     1.500     1.500 peak  2785 spectrum    1 weight  0.10000E+01 volume  0.25555E-02 ppm1      0.760 ppm2      1.808 CV     1
 OR { 2785}
   (  segid "    " and resid 90   and name HD2%)
   (( segid "    " and resid 104  and name HG2 ))
 OR { 2785}
   (  segid "    " and resid 45   and name HD1%)
   (( segid "    " and resid 47   and name HB2 ))
 OR { 2785}
   (  segid "    " and resid 45   and name HD1%)
   (( segid "    " and resid 46   and name HB2 ))
 OR { 2785}
   (  segid "    " and resid 90   and name HD2%)
   (( segid "    " and resid 62   and name HB1 ))
 OR { 2785}
   (  segid "    " and resid 45   and name HD1%)
   (( segid "    " and resid 47   and name HB1 ))
 ASSI { 2786}
   (  segid "    " and resid 90   and name HD2%)
   (( segid "    " and resid 104  and name HD1 ))
      3.000     1.100     1.100 peak  2786 spectrum    1 weight  0.11000E+01 volume  0.93581E-03 ppm1      0.748 ppm2      3.620 CV     1
 OR { 2786}
   (  segid "    " and resid 90   and name HD2%)
   (( segid "    " and resid 62   and name HA  ))
 ASSI { 2789}
   (  segid "    " and resid 90   and name HD2%)
   (( segid "    " and resid 61   and name HN  ))
      6.000     4.800     0.000 peak  2789 spectrum    1 weight  0.10000E+01 volume  0.81741E-04 ppm1      0.762 ppm2      7.913 CV     1
 OR { 2789}
   (  segid "    " and resid 90   and name HD2%)
   (( segid "    " and resid 103  and name HN  ))
 ASSI { 2810}
   (( segid "    " and resid 99   and name HA  ))
   (  segid "    " and resid 98   and name HB% )
      5.400     3.600     0.600 peak  2810 spectrum    1 weight  0.10000E+01 volume  0.18059E-03 ppm1      4.191 ppm2      1.124 CV     1
 OR { 2810}
   (( segid "    " and resid 99   and name HA  ))
   (  segid "    " and resid 68   and name HG1%)
 ASSI { 2830}
   (  segid "    " and resid 99   and name HD2%)
   (( segid "    " and resid 142  and name HB  ))
      4.200     2.200     1.800 peak  2830 spectrum    1 weight  0.10000E+01 volume  0.83030E-03 ppm1      0.743 ppm2      1.960 CV     1
 OR { 2830}
   (  segid "    " and resid 99   and name HD2%)
   (  segid "    " and resid 106  and name HE% )
 ASSI { 2859}
   (( segid "    " and resid 59   and name HG1 ))
   (( segid "    " and resid 106  and name HN  ))
      6.000     5.400     0.000 peak  2859 spectrum    1 weight  0.10000E+01 volume  0.94437E-04 ppm1      1.800 ppm2      7.912 CV     1
 OR { 2859}
   (( segid "    " and resid 101  and name HG  ))
   (( segid "    " and resid 103  and name HN  ))
 ASSI { 2864}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 120  and name HB1 ))
      3.100     3.100     2.900 peak  2864 spectrum    1 weight  0.10000E+01 volume  0.98908E-04 ppm1      0.686 ppm2      3.268 CV     1
 OR { 2864}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 93   and name HB1 ))
 ASSI { 2877}
   (  segid "    " and resid 39   and name HG2%)
   (  segid "    " and resid 45   and name HD2%)
      3.200     1.300     1.300 peak  2877 spectrum    1 weight  0.11000E+01 volume  0.21471E-02 ppm1      0.788 ppm2      0.517 CV     1
 OR { 2877}
   (  segid "    " and resid 39   and name HG2%)
   (  segid "    " and resid 101  and name HD2%)
 ASSI { 2908}
   (  segid "    " and resid 105  and name HD1%)
   (( segid "    " and resid 37   and name HG  ))
      1.700     1.700     4.300 peak  2908 spectrum    1 weight  0.10000E+01 volume  0.39270E-02 ppm1      0.964 ppm2      1.494 CV     1
 OR { 2908}
   (  segid "    " and resid 105  and name HD1%)
   (( segid "    " and resid 47   and name HD2 ))
 ASSI { 2912}
   (  segid "    " and resid 105  and name HD1%)
   (( segid "    " and resid 104  and name HB1 ))
      2.900     2.900     3.100 peak  2912 spectrum    1 weight  0.10000E+01 volume  0.14152E-03 ppm1      0.968 ppm2      2.452 CV     1
 OR { 2912}
   (  segid "    " and resid 105  and name HD1%)
   (( segid "    " and resid 100  and name HB2 ))
 ASSI { 2915}
   (  segid "    " and resid 105  and name HD2%)
   (( segid "    " and resid 37   and name HB1 ))
      1.700     1.700     4.300 peak  2915 spectrum    1 weight  0.10000E+01 volume  0.41133E-02 ppm1      0.864 ppm2      1.912 CV     1
 OR { 2915}
   (  segid "    " and resid 105  and name HD2%)
   (( segid "    " and resid 59   and name HB1 ))
 OR { 2915}
   (  segid "    " and resid 105  and name HD2%)
   (( segid "    " and resid 106  and name HB2 ))
 ASSI { 2924}
   (( segid "    " and resid 47   and name HE2 ))
   (( segid "    " and resid 106  and name HA  ))
      4.300     2.400     1.700 peak  2924 spectrum    1 weight  0.11000E+01 volume  0.64914E-03 ppm1      2.577 ppm2      4.385 CV     1
 OR { 2924}
   (( segid "    " and resid 47   and name HE1 ))
   (( segid "    " and resid 106  and name HA  ))
 OR { 2924}
   (( segid "    " and resid 47   and name HE2 ))
   (( segid "    " and resid 105  and name HA  ))
 ASSI { 2959}
   (  segid "    " and resid 138  and name HD1%)
   (( segid "    " and resid 81   and name HE22))
      5.600     4.000     0.400 peak  2959 spectrum    1 weight  0.10000E+01 volume  0.19292E-03 ppm1      1.106 ppm2      6.699 CV     1
 OR { 2959}
   (  segid "    " and resid 116  and name HB% )
   (  segid "    " and resid 120  and name HE% )
 ASSI { 2962}
   (  segid "    " and resid 138  and name HD2%)
   (  segid "    " and resid 140  and name HD2%)
      2.500     2.500     3.500 peak  2962 spectrum    1 weight  0.10000E+01 volume  0.87393E-02 ppm1      0.835 ppm2      0.738 CV     1
 OR { 2962}
   (  segid "    " and resid 138  and name HD2%)
   (( segid "    " and resid 132  and name HG12))
 OR { 2962}
   (  segid "    " and resid 138  and name HD2%)
   (  segid "    " and resid 96   and name HD1%)
 ASSI { 2963}
   (  segid "    " and resid 142  and name HG2%)
   (  segid "    " and resid 99   and name HD1%)
      2.700     0.900     0.900 peak  2963 spectrum    1 weight  0.10000E+01 volume  0.40340E-02 ppm1      0.849 ppm2      1.305 CV     1
 OR { 2963}
   (  segid "    " and resid 44   and name HD2%)
   (( segid "    " and resid 45   and name HG  ))
 ASSI { 2964}
   (  segid "    " and resid 142  and name HG2%)
   (  segid "    " and resid 106  and name HE% )
      2.200     0.600     0.600 peak  2964 spectrum    1 weight  0.10000E+01 volume  0.11033E-01 ppm1      0.854 ppm2      1.968 CV     1
 OR { 2964}
   (  segid "    " and resid 142  and name HG2%)
   (( segid "    " and resid 142  and name HB  ))
 ASSI { 2965}
   (  segid "    " and resid 142  and name HG2%)
   (( segid "    " and resid 68   and name HB  ))
      4.000     2.000     2.000 peak  2965 spectrum    1 weight  0.10000E+01 volume  0.21948E-02 ppm1      0.855 ppm2      2.230 CV     1
 OR { 2965}
   (  segid "    " and resid 44   and name HD2%)
   (( segid "    " and resid 97   and name HB1 ))
 OR { 2965}
   (  segid "    " and resid 44   and name HD2%)
   (( segid "    " and resid 97   and name HB2 ))
 ASSI { 2967}
   (  segid "    " and resid 142  and name HG2%)
   (( segid "    " and resid 143  and name HA  ))
      3.400     1.400     1.400 peak  2967 spectrum    1 weight  0.10000E+01 volume  0.29849E-02 ppm1      0.865 ppm2      5.616 CV     1
 OR { 2967}
   (  segid "    " and resid 142  and name HG2%)
   (( segid "    " and resid 111  and name HA  ))
 ASSI { 2969}
   (  segid "    " and resid 138  and name HD2%)
   (( segid "    " and resid 138  and name HN  ))
      5.600     4.000     0.400 peak  2969 spectrum    1 weight  0.10000E+01 volume  0.20198E-03 ppm1      0.843 ppm2      8.293 CV     1
 OR { 2969}
   (  segid "    " and resid 148  and name HG1%)
   (( segid "    " and resid 147  and name HN  ))
 ASSI { 2970}
   (( segid "    " and resid 120  and name HB1 ))
   (  segid "    " and resid 98   and name HB% )
      3.500     1.500     1.500 peak  2970 spectrum    1 weight  0.11000E+01 volume  0.50649E-03 ppm1      3.278 ppm2      1.124 CV     1
 OR { 2970}
   (( segid "    " and resid 120  and name HB1 ))
   (  segid "    " and resid 116  and name HB% )
 ASSI { 2971}
   (( segid "    " and resid 120  and name HB2 ))
   (  segid "    " and resid 116  and name HB% )
      3.500     1.600     1.600 peak  2971 spectrum    1 weight  0.11000E+01 volume  0.57951E-03 ppm1      2.565 ppm2      1.124 CV     1
 OR { 2971}
   (( segid "    " and resid 120  and name HB2 ))
   (  segid "    " and resid 98   and name HB% )
 ASSI { 2978}
   (( segid "    " and resid 140  and name HB1 ))
   (  segid "    " and resid 138  and name HD2%)
      3.700     1.700     1.700 peak  2978 spectrum    1 weight  0.10000E+01 volume  0.94006E-03 ppm1      1.879 ppm2      0.831 CV     1
 OR { 2978}
   (( segid "    " and resid 140  and name HB1 ))
   (  segid "    " and resid 142  and name HG2%)
 ASSI { 2981}
   (( segid "    " and resid 140  and name HG  ))
   (  segid "    " and resid 72   and name HG2%)
      4.900     3.000     1.100 peak  2981 spectrum    1 weight  0.10000E+01 volume  0.40312E-03 ppm1      1.673 ppm2      1.178 CV     1
 OR { 2981}
   (( segid "    " and resid 79   and name HG2 ))
   (  segid "    " and resid 72   and name HG2%)
 OR { 2981}
   (( segid "    " and resid 79   and name HG1 ))
   (  segid "    " and resid 72   and name HG2%)
 ASSI { 2982}
   (  segid "    " and resid 140  and name HD2%)
   (  segid "    " and resid 116  and name HB% )
      2.800     1.000     1.000 peak  2982 spectrum    1 weight  0.10000E+01 volume  0.45495E-02 ppm1      0.703 ppm2      1.137 CV     1
 OR { 2982}
   (  segid "    " and resid 140  and name HD2%)
   (  segid "    " and resid 98   and name HB% )
 OR { 2982}
   (  segid "    " and resid 140  and name HD2%)
   (( segid "    " and resid 96   and name HG12))
 ASSI { 3009}
   (( segid "    " and resid 49   and name HA  ))
   (  segid "    " and resid 112  and name HB% )
      3.400     1.500     1.500 peak  3009 spectrum    1 weight  0.11000E+01 volume  0.96030E-03 ppm1      3.977 ppm2      1.542 CV     1
 OR { 3009}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 50   and name HG  ))
 ASSI { 3013}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 111  and name HA  ))
      6.000     5.600     0.000 peak  3013 spectrum    1 weight  0.10000E+01 volume  0.96171E-04 ppm1      3.964 ppm2      5.594 CV     1
 OR { 3013}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 114  and name HA  ))
 ASSI { 3056}
   (( segid "    " and resid 87   and name HA  ))
   (  segid "    " and resid 66   and name HG2%)
      5.500     3.800     0.500 peak  3056 spectrum    1 weight  0.10000E+01 volume  0.11508E-03 ppm1      5.320 ppm2      0.032 CV     1
 OR { 3056}
   (( segid "    " and resid 67   and name HA  ))
   (  segid "    " and resid 66   and name HG2%)
 ASSI { 3061}
   (( segid "    " and resid 72   and name HB  ))
   (( segid "    " and resid 140  and name HB1 ))
      4.700     2.700     1.300 peak  3061 spectrum    1 weight  0.10000E+01 volume  0.39215E-03 ppm1      3.996 ppm2      1.889 CV     1
 OR { 3061}
   (( segid "    " and resid 72   and name HB  ))
   (( segid "    " and resid 138  and name HG  ))
 OR { 3061}
   (( segid "    " and resid 67   and name HB  ))
   (( segid "    " and resid 87   and name HB  ))
 OR { 3061}
   (( segid "    " and resid 67   and name HB  ))
   (( segid "    " and resid 145  and name HB1 ))
 OR { 3061}
   (( segid "    " and resid 72   and name HB  ))
   (( segid "    " and resid 70   and name HB1 ))
 ASSI { 3064}
   (  segid "    " and resid 143  and name HG2%)
   (( segid "    " and resid 145  and name HD1 ))
      4.600     2.600     1.400 peak  3064 spectrum    1 weight  0.10000E+01 volume  0.10884E-02 ppm1      1.060 ppm2      1.748 CV     1
 OR { 3064}
   (  segid "    " and resid 67   and name HG2%)
   (( segid "    " and resid 85   and name HB2 ))
 OR { 3064}
   (  segid "    " and resid 51   and name HG1%)
   (( segid "    " and resid 52   and name HG2 ))
 ASSI { 3066}
   (  segid "    " and resid 67   and name HG2%)
   (( segid "    " and resid 87   and name HB  ))
      3.700     1.700     1.700 peak  3066 spectrum    1 weight  0.10000E+01 volume  0.14062E-02 ppm1      1.064 ppm2      1.902 CV     1
 OR { 3066}
   (  segid "    " and resid 143  and name HG2%)
   (( segid "    " and resid 145  and name HB1 ))
 OR { 3066}
   (  segid "    " and resid 51   and name HG1%)
   (( segid "    " and resid 52   and name HB2 ))
 ASSI { 3073}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 140  and name HB1 ))
      4.900     3.000     1.100 peak  3073 spectrum    1 weight  0.10000E+01 volume  0.80692E-04 ppm1      4.904 ppm2      1.912 CV     1
 OR { 3073}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 138  and name HG  ))
 ASSI { 3076}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 107  and name HA  ))
      5.500     3.800     0.500 peak  3076 spectrum    1 weight  0.10000E+01 volume  0.24150E-03 ppm1      4.922 ppm2      4.709 CV     1
 OR { 3076}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 74   and name HA  ))
 ASSI { 3097}
   (( segid "    " and resid 78   and name HB  ))
   (  segid "    " and resid 80   and name HG1%)
      3.800     1.800     1.800 peak  3097 spectrum    1 weight  0.11000E+01 volume  0.15237E-02 ppm1      4.067 ppm2      0.985 CV     1
 OR { 3097}
   (( segid "    " and resid 72   and name HB  ))
   (  segid "    " and resid 140  and name HD1%)
 ASSI { 3117}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 72   and name HB  ))
      6.000     4.900     0.000 peak  3117 spectrum    1 weight  0.11000E+01 volume  0.79151E-04 ppm1      5.528 ppm2      4.032 CV     1
 OR { 3117}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 78   and name HB  ))
 ASSI { 3133}
   (( segid "    " and resid 143  and name HA  ))
   (( segid "    " and resid 144  and name HB2 ))
      6.000     6.000     0.000 peak  3133 spectrum    1 weight  0.10000E+01 volume  0.75083E-04 ppm1      5.615 ppm2      1.326 CV     1
 OR { 3133}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 144  and name HB2 ))
 ASSI { 3136}
   (( segid "    " and resid 143  and name HA  ))
   (( segid "    " and resid 144  and name HA  ))
      4.600     2.600     1.400 peak  3136 spectrum    1 weight  0.10000E+01 volume  0.43442E-03 ppm1      5.616 ppm2      4.646 CV     1
 OR { 3136}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 110  and name HA  ))
 ASSI { 3144}
   (( segid "    " and resid 111  and name HB  ))
   (( segid "    " and resid 110  and name HB1 ))
      6.000     5.700     0.000 peak  3144 spectrum    1 weight  0.10000E+01 volume  0.84440E-04 ppm1      3.786 ppm2      2.179 CV     1
 OR { 3144}
   (( segid "    " and resid 111  and name HB  ))
   (  segid "    " and resid 113  and name HE% )
 ASSI { 3166}
   (( segid "    " and resid 115  and name HB  ))
   (( segid "    " and resid 36   and name HE3 ))
      5.800     4.200     0.200 peak  3166 spectrum    1 weight  0.10000E+01 volume  0.10047E-03 ppm1      4.113 ppm2      7.232 CV     1
 OR { 3166}
   (( segid "    " and resid 115  and name HB  ))
   (( segid "    " and resid 46   and name HE  ))
 ASSI { 3178}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 46   and name HA  ))
      3.000     3.000     3.000 peak  3178 spectrum    1 weight  0.11000E+01 volume  0.14025E-03 ppm1      1.121 ppm2      5.939 CV     1
 OR { 3178}
   (  segid "    " and resid 115  and name HG2%)
   (( segid "    " and resid 47   and name HA  ))
 ASSI { 3189}
   (( segid "    " and resid 115  and name HB  ))
   (( segid "    " and resid 47   and name HA  ))
      3.600     3.600     2.400 peak  3189 spectrum    1 weight  0.11000E+01 volume  0.42669E-04 ppm1      4.107 ppm2      5.925 CV     1
 OR { 3189}
   (( segid "    " and resid 115  and name HB  ))
   (( segid "    " and resid 46   and name HA  ))
 ASSI { 3195}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 112  and name HA  ))
      6.000     5.000     0.000 peak  3195 spectrum    1 weight  0.10000E+01 volume  0.59583E-04 ppm1      5.624 ppm2      5.197 CV     1
 OR { 3195}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 141  and name HA  ))
 ASSI { 3225}
   (( segid "    " and resid 145  and name HG1 ))
   (( segid "    " and resid 143  and name HB  ))
      5.900     4.400     0.100 peak  3225 spectrum    1 weight  0.10000E+01 volume  0.14586E-03 ppm1      1.599 ppm2      4.091 CV     1
 OR { 3225}
   (( segid "    " and resid 145  and name HG1 ))
   (( segid "    " and resid 146  and name HB  ))
 ASSI { 3304}
   (  segid "    " and resid 112  and name HB% )
   (( segid "    " and resid 106  and name HA  ))
      3.100     3.100     2.900 peak  3304 spectrum    1 weight  0.10000E+01 volume  0.10974E-03 ppm1      1.528 ppm2      4.384 CV     1
 OR { 3304}
   (  segid "    " and resid 112  and name HB% )
   (( segid "    " and resid 52   and name HA  ))
 ASSI { 3350}
   (  segid "    " and resid 136  and name HB% )
   (  segid "    " and resid 74   and name HD2%)
      3.000     3.000     3.000 peak  3350 spectrum    1 weight  0.10000E+01 volume  0.58708E-02 ppm1      1.266 ppm2      0.857 CV     1
 OR { 3350}
   (  segid "    " and resid 136  and name HB% )
   (  segid "    " and resid 138  and name HD2%)
 ASSI { 3363}
   (( segid "    " and resid 147  and name HA  ))
   (  segid "    " and resid 108  and name HG2%)
      5.900     4.400     0.100 peak  3363 spectrum    1 weight  0.10000E+01 volume  0.10537E-03 ppm1      5.004 ppm2      0.863 CV     1
 OR { 3363}
   (( segid "    " and resid 147  and name HA  ))
   (  segid "    " and resid 144  and name HD2%)
 OR { 3363}
   (( segid "    " and resid 147  and name HA  ))
   (  segid "    " and resid 148  and name HG2%)
 ASSI { 3375}
   (( segid "    " and resid 147  and name HA  ))
   (  segid "    " and resid 148  and name HG1%)
      5.700     4.100     0.300 peak  3375 spectrum    1 weight  0.10000E+01 volume  0.16819E-03 ppm1      5.029 ppm2      0.911 CV     1
 OR { 3375}
   (( segid "    " and resid 147  and name HA  ))
   (  segid "    " and resid 144  and name HD2%)
 ASSI { 3378}
   (( segid "    " and resid 28   and name HA  ))
   (( segid "    " and resid 29   and name HG2 ))
      6.000     5.700     0.000 peak  3378 spectrum    1 weight  0.10000E+01 volume  0.16194E-03 ppm1      4.584 ppm2      1.914 CV     1
 OR { 3378}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 33   and name HG1 ))
 OR { 3378}
   (( segid "    " and resid 28   and name HA  ))
   (( segid "    " and resid 29   and name HG1 ))
 ASSI { 3397}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 105  and name HB2 ))
      6.000     4.700     0.000 peak  3397 spectrum    1 weight  0.10000E+01 volume  0.19185E-03 ppm1      3.479 ppm2      1.734 CV     1
 OR { 3397}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 37   and name HB2 ))
 OR { 3397}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 45   and name HB1 ))
 ASSI { 3398}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 40   and name HA  ))
      5.100     3.300     0.900 peak  3398 spectrum    1 weight  0.10000E+01 volume  0.17504E-03 ppm1      3.473 ppm2      4.593 CV     1
 OR { 3398}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 37   and name HA  ))
 ASSI { 3458}
   (( segid "    " and resid 96   and name HA  ))
   (( segid "    " and resid 97   and name HG1 ))
      6.000     5.400     0.000 peak  3458 spectrum    1 weight  0.11000E+01 volume  0.22028E-03 ppm1      4.014 ppm2      2.649 CV     1
 OR { 3458}
   (( segid "    " and resid 96   and name HA  ))
   (( segid "    " and resid 121  and name HB2 ))
 ASSI { 3468}
   (  segid "    " and resid 99   and name HD1%)
   (  segid "    " and resid 142  and name HG1%)
      2.500     2.500     3.500 peak  3468 spectrum    1 weight  0.10000E+01 volume  0.46638E-02 ppm1      1.307 ppm2      0.942 CV     1
 OR { 3468}
   (  segid "    " and resid 99   and name HD1%)
   (  segid "    " and resid 68   and name HG2%)
 OR { 3468}
   (  segid "    " and resid 99   and name HD1%)
   (  segid "    " and resid 140  and name HD1%)
 ASSI { 3469}
   (  segid "    " and resid 99   and name HD1%)
   (  segid "    " and resid 103  and name HG2%)
      2.500     0.800     0.800 peak  3469 spectrum    1 weight  0.10000E+01 volume  0.45360E-02 ppm1      1.305 ppm2      1.035 CV     1
 OR { 3469}
   (  segid "    " and resid 103  and name HG1%)
   (  segid "    " and resid 103  and name HG2%)
 OR { 3469}
   (  segid "    " and resid 103  and name HG1%)
   (  segid "    " and resid 90   and name HD1%)
 ASSI { 3470}
   (  segid "    " and resid 103  and name HG1%)
   (( segid "    " and resid 144  and name HG  ))
      4.000     2.000     2.000 peak  3470 spectrum    1 weight  0.10000E+01 volume  0.20549E-02 ppm1      1.285 ppm2      1.419 CV     1
 OR { 3470}
   (  segid "    " and resid 99   and name HD1%)
   (( segid "    " and resid 47   and name HG2 ))
 OR { 3470}
   (  segid "    " and resid 99   and name HD1%)
   (( segid "    " and resid 47   and name HG1 ))
 ASSI { 3471}
   (( segid "    " and resid 96   and name HG11))
   (  segid "    " and resid 95   and name HG2%)
      6.000     4.700     0.000 peak  3471 spectrum    1 weight  0.10000E+01 volume  0.15515E-03 ppm1      1.285 ppm2      0.089 CV     1
 OR { 3471}
   (  segid "    " and resid 99   and name HD1%)
   (  segid "    " and resid 95   and name HG2%)
 ASSI { 3474}
   (  segid "    " and resid 96   and name HG2%)
   (  segid "    " and resid 70   and name HD1%)
      5.000     3.200     1.000 peak  3474 spectrum    1 weight  0.10000E+01 volume  0.44639E-03 ppm1      0.276 ppm2      0.942 CV     1
 OR { 3474}
   (  segid "    " and resid 96   and name HG2%)
   (  segid "    " and resid 140  and name HD1%)
 OR { 3474}
   (  segid "    " and resid 96   and name HG2%)
   (  segid "    " and resid 142  and name HG1%)
 OR { 3474}
   (  segid "    " and resid 96   and name HG2%)
   (  segid "    " and resid 114  and name HG1%)
 ASSI { 3515}
   (( segid "    " and resid 132  and name HG11))
   (( segid "    " and resid 127  and name HB2 ))
      4.500     2.500     1.500 peak  3515 spectrum    1 weight  0.11000E+01 volume  0.28475E-03 ppm1      1.014 ppm2      2.693 CV     1
 OR { 3515}
   (( segid "    " and resid 132  and name HG11))
   (( segid "    " and resid 122  and name HB2 ))
 ASSI { 3523}
   (  segid "    " and resid 132  and name HG2%)
   (( segid "    " and resid 122  and name HB2 ))
      4.400     2.500     1.600 peak  3523 spectrum    1 weight  0.11000E+01 volume  0.73373E-03 ppm1      0.936 ppm2      2.700 CV     1
 OR { 3523}
   (  segid "    " and resid 132  and name HG2%)
   (( segid "    " and resid 127  and name HB2 ))
 ASSI { 3534}
   (  segid "    " and resid 132  and name HD1%)
   (  segid "    " and resid 74   and name HD2%)
      2.800     1.000     1.000 peak  3534 spectrum    1 weight  0.10000E+01 volume  0.28099E-02 ppm1      0.456 ppm2      0.843 CV     1
 OR { 3534}
   (  segid "    " and resid 132  and name HD1%)
   (  segid "    " and resid 138  and name HD2%)
 ASSI { 3561}
   (( segid "    " and resid 132  and name HB  ))
   (( segid "    " and resid 126  and name HA2 ))
      5.600     4.000     0.400 peak  3561 spectrum    1 weight  0.11000E+01 volume  0.82663E-04 ppm1      1.152 ppm2      3.523 CV     1
 OR { 3561}
   (( segid "    " and resid 132  and name HB  ))
   (( segid "    " and resid 130  and name HD1 ))
 ASSI { 3588}
   (( segid "    " and resid 151  and name HB2 ))
   (( segid "    " and resid 64   and name HE22))
      4.300     2.300     1.700 peak  3588 spectrum    1 weight  0.11000E+01 volume  0.49984E-03 ppm1      1.976 ppm2      7.285 CV     1
 OR { 3588}
   (( segid "    " and resid 34   and name HB1 ))
   (( segid "    " and resid 36   and name HD1 ))
 ASSI { 3651}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 62   and name HD1 ))
      6.000     4.900     0.000 peak  3651 spectrum    1 weight  0.10000E+01 volume  0.11531E-03 ppm1      4.414 ppm2      1.789 CV     1
 OR { 3651}
   (( segid "    " and resid 131  and name HA  ))
   (( segid "    " and resid 130  and name HB2 ))
 OR { 3651}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 104  and name HG2 ))
 ASSI { 3677}
   (( segid "    " and resid 69   and name HA  ))
   (  segid "    " and resid 68   and name HG1%)
      6.000     5.100     0.000 peak  3677 spectrum    1 weight  0.10000E+01 volume  0.13061E-03 ppm1      5.398 ppm2      1.085 CV     1
 OR { 3677}
   (( segid "    " and resid 69   and name HA  ))
   (  segid "    " and resid 67   and name HG2%)
 ASSI { 3678}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 70   and name HB1 ))
      4.900     3.000     1.100 peak  3678 spectrum    1 weight  0.10000E+01 volume  0.37229E-03 ppm1      5.375 ppm2      1.899 CV     1
 OR { 3678}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 84   and name HB2 ))
 OR { 3678}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 83   and name HB2 ))
 ASSI { 3703}
   (( segid "    " and resid 69   and name HB2 ))
   (( segid "    " and resid 144  and name HA  ))
      6.000     5.000     0.000 peak  3703 spectrum    1 weight  0.10000E+01 volume  0.14676E-03 ppm1      3.075 ppm2      4.640 CV     1
 OR { 3703}
   (( segid "    " and resid 69   and name HB2 ))
   (( segid "    " and resid 86   and name HA  ))
 ASSI { 3725}
   (( segid "    " and resid 121  and name HA  ))
   (  segid "    " and resid 116  and name HB% )
      5.800     4.100     0.200 peak  3725 spectrum    1 weight  0.10000E+01 volume  0.14387E-03 ppm1      4.447 ppm2      1.142 CV     1
 OR { 3725}
   (( segid "    " and resid 121  and name HA  ))
   (( segid "    " and resid 96   and name HG12))
 OR { 3725}
   (( segid "    " and resid 121  and name HA  ))
   (  segid "    " and resid 98   and name HB% )
 ASSI { 3726}
   (( segid "    " and resid 64   and name HB1 ))
   (( segid "    " and resid 65   and name HA  ))
      5.700     4.100     0.300 peak  3726 spectrum    1 weight  0.10000E+01 volume  0.16442E-03 ppm1      2.253 ppm2      4.273 CV     1
 OR { 3726}
   (( segid "    " and resid 64   and name HB1 ))
   (( segid "    " and resid 151  and name HA  ))
 ASSI { 3753}
   (( segid "    " and resid 97   and name HB1 ))
   (  segid "    " and resid 40   and name HD1%)
      5.900     4.400     0.100 peak  3753 spectrum    1 weight  0.10000E+01 volume  0.13841E-03 ppm1      2.262 ppm2      0.823 CV     1
 OR { 3753}
   (( segid "    " and resid 97   and name HB1 ))
   (  segid "    " and resid 45   and name HD1%)
 OR { 3753}
   (( segid "    " and resid 97   and name HB2 ))
   (  segid "    " and resid 40   and name HD1%)
 OR { 3753}
   (( segid "    " and resid 97   and name HB1 ))
   (( segid "    " and resid 45   and name HB2 ))
 OR { 3753}
   (( segid "    " and resid 97   and name HB1 ))
   (  segid "    " and resid 44   and name HD2%)
 OR { 3753}
   (( segid "    " and resid 97   and name HB2 ))
   (  segid "    " and resid 44   and name HD2%)
 ASSI { 3761}
   (( segid "    " and resid 97   and name HG2 ))
   (( segid "    " and resid 93   and name HA  ))
      6.000     6.000     0.000 peak  3761 spectrum    1 weight  0.10000E+01 volume  0.66326E-04 ppm1      2.471 ppm2      4.292 CV     1
 OR { 3761}
   (( segid "    " and resid 97   and name HG2 ))
   (( segid "    " and resid 101  and name HA  ))
 ASSI { 3770}
   (( segid "    " and resid 100  and name HB1 ))
   (( segid "    " and resid 97   and name HA  ))
      3.100     1.200     1.200 peak  3770 spectrum    1 weight  0.11000E+01 volume  0.71345E-03 ppm1      2.577 ppm2      4.028 CV     1
 OR { 3770}
   (( segid "    " and resid 107  and name HB1 ))
   (( segid "    " and resid 57   and name HB1 ))
 ASSI { 3779}
   (( segid "    " and resid 104  and name HG1 ))
   (( segid "    " and resid 106  and name HN  ))
      6.000     6.000     0.000 peak  3779 spectrum    1 weight  0.10000E+01 volume  0.81528E-04 ppm1      2.130 ppm2      7.869 CV     1
 OR { 3779}
   (( segid "    " and resid 125  and name HB2 ))
   (( segid "    " and resid 132  and name HN  ))
 ASSI { 3784}
   (( segid "    " and resid 29   and name HB1 ))
   (( segid "    " and resid 29   and name HG2 ))
      4.600     2.600     1.400 peak  3784 spectrum    1 weight  0.10000E+01 volume  0.39395E-03 ppm1      2.400 ppm2      1.892 CV     1
 OR { 3784}
   (( segid "    " and resid 81   and name HG1 ))
   (( segid "    " and resid 140  and name HB1 ))
 ASSI { 3794}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 84   and name HA  ))
      5.000     3.100     1.000 peak  3794 spectrum    1 weight  0.10000E+01 volume  0.32397E-03 ppm1      5.046 ppm2      4.397 CV     1
 OR { 3794}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 84   and name HA  ))
 OR { 3794}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 80   and name HA  ))
 ASSI { 3795}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 81   and name HA  ))
      4.200     2.200     1.800 peak  3795 spectrum    1 weight  0.10000E+01 volume  0.93390E-03 ppm1      5.050 ppm2      4.622 CV     1
 OR { 3795}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 81   and name HA  ))
 ASSI { 3805}
   (( segid "    " and resid 83   and name HB1 ))
   (( segid "    " and resid 84   and name HA  ))
      4.200     2.200     1.800 peak  3805 spectrum    1 weight  0.11000E+01 volume  0.95534E-03 ppm1      2.049 ppm2      4.395 CV     1
 OR { 3805}
   (( segid "    " and resid 83   and name HB1 ))
   (( segid "    " and resid 85   and name HA  ))
 ASSI { 3819}
   (( segid "    " and resid 68   and name HB  ))
   (  segid "    " and resid 99   and name HD1%)
      5.100     3.200     0.900 peak  3819 spectrum    1 weight  0.10000E+01 volume  0.31883E-03 ppm1      2.198 ppm2      1.311 CV     1
 OR { 3819}
   (( segid "    " and resid 68   and name HB  ))
   (( segid "    " and resid 86   and name HB2 ))
 OR { 3819}
   (( segid "    " and resid 68   and name HB  ))
   (( segid "    " and resid 144  and name HB2 ))
 ASSI { 3821}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 74   and name HA  ))
      3.600     1.600     1.600 peak  3821 spectrum    1 weight  0.10000E+01 volume  0.15391E-02 ppm1      3.985 ppm2      4.744 CV     1
 OR { 3821}
   (( segid "    " and resid 119  and name HA  ))
   (( segid "    " and resid 120  and name HA  ))
 ASSI { 3844}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 34   and name HB1 ))
      2.700     0.900     0.900 peak  3844 spectrum    1 weight  0.10000E+01 volume  0.81543E-02 ppm1      2.200 ppm2      1.945 CV     1
 OR { 3844}
   (( segid "    " and resid 18   and name HG1 ))
   (( segid "    " and resid 18   and name HB1 ))
 OR { 3844}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 34   and name HB2 ))
 ASSI { 3845}
   (( segid "    " and resid 75   and name HG2 ))
   (( segid "    " and resid 76   and name HD21))
      5.900     4.300     0.100 peak  3845 spectrum    1 weight  0.10000E+01 volume  0.62409E-04 ppm1      2.204 ppm2      6.829 CV     1
 OR { 3845}
   (( segid "    " and resid 82   and name HG1 ))
   (( segid "    " and resid 79   and name HH11))
 ASSI { 3848}
   (( segid "    " and resid 8    and name HG2 ))
   (  segid "    " and resid 9    and name HB% )
      4.200     2.200     1.800 peak  3848 spectrum    1 weight  0.10000E+01 volume  0.44128E-03 ppm1      2.055 ppm2      1.381 CV     1
 OR { 3848}
   (( segid "    " and resid 7    and name HG2 ))
   (  segid "    " and resid 9    and name HB% )
 ASSI { 3850}
   (( segid "    " and resid 151  and name HG2 ))
   (( segid "    " and resid 62   and name HA  ))
      3.200     3.200     2.800 peak  3850 spectrum    1 weight  0.10000E+01 volume  0.35379E-03 ppm1      2.059 ppm2      3.584 CV     1
 OR { 3850}
   (( segid "    " and resid 51   and name HB  ))
   (( segid "    " and resid 60   and name HD1 ))
 OR { 3850}
   (( segid "    " and resid 51   and name HB  ))
   (( segid "    " and resid 102  and name HB1 ))
 ASSI { 3855}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 79   and name HG2 ))
      5.300     3.500     0.700 peak  3855 spectrum    1 weight  0.10000E+01 volume  0.30136E-03 ppm1      2.080 ppm2      1.649 CV     1
 OR { 3855}
   (( segid "    " and resid 83   and name HB1 ))
   (( segid "    " and resid 86   and name HG  ))
 ASSI { 3867}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 52   and name HD2 ))
      4.100     2.100     1.900 peak  3867 spectrum    1 weight  0.10000E+01 volume  0.15089E-02 ppm1      1.924 ppm2      3.677 CV     1
 OR { 3867}
   (( segid "    " and resid 84   and name HB2 ))
   (( segid "    " and resid 84   and name HD2 ))
 OR { 3867}
   (( segid "    " and resid 83   and name HB2 ))
   (( segid "    " and resid 84   and name HD2 ))
 ASSI { 3868}
   (( segid "    " and resid 106  and name HG2 ))
   (( segid "    " and resid 107  and name HN  ))
      5.900     4.400     0.100 peak  3868 spectrum    1 weight  0.10000E+01 volume  0.61253E-04 ppm1      1.924 ppm2      7.670 CV     1
 OR { 3868}
   (( segid "    " and resid 81   and name HB2 ))
   (( segid "    " and resid 81   and name HE21))
 ASSI { 3880}
   (( segid "    " and resid 151  and name HB2 ))
   (  segid "    " and resid 89   and name HG2%)
      4.600     2.600     1.400 peak  3880 spectrum    1 weight  0.10000E+01 volume  0.43971E-03 ppm1      1.960 ppm2      0.985 CV     1
 OR { 3880}
   (( segid "    " and resid 85   and name HB1 ))
   (  segid "    " and resid 86   and name HD1%)
 OR { 3880}
   (( segid "    " and resid 85   and name HB1 ))
   (  segid "    " and resid 68   and name HG2%)
 ASSI { 3882}
   (( segid "    " and resid 10   and name HB2 ))
   (( segid "    " and resid 10   and name HA  ))
      2.900     1.100     1.100 peak  3882 spectrum    1 weight  0.10000E+01 volume  0.35779E-02 ppm1      1.974 ppm2      4.291 CV     1
 OR { 3882}
   (( segid "    " and resid 34   and name HB1 ))
   (( segid "    " and resid 34   and name HA  ))
 OR { 3882}
   (( segid "    " and resid 7    and name HB2 ))
   (( segid "    " and resid 7    and name HA  ))
 OR { 3882}
   (( segid "    " and resid 34   and name HB2 ))
   (( segid "    " and resid 34   and name HA  ))
 ASSI { 3885}
   (( segid "    " and resid 85   and name HB1 ))
   (( segid "    " and resid 67   and name HA  ))
      5.700     4.000     0.300 peak  3885 spectrum    1 weight  0.10000E+01 volume  0.18139E-03 ppm1      1.966 ppm2      5.350 CV     1
 OR { 3885}
   (( segid "    " and resid 85   and name HB1 ))
   (( segid "    " and resid 69   and name HA  ))
 ASSI { 3892}
   (( segid "    " and resid 85   and name HG1 ))
   (( segid "    " and resid 69   and name HA  ))
      5.800     4.200     0.200 peak  3892 spectrum    1 weight  0.10000E+01 volume  0.17592E-03 ppm1      2.038 ppm2      5.353 CV     1
 OR { 3892}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 67   and name HA  ))
 OR { 3892}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 69   and name HA  ))
 OR { 3892}
   (( segid "    " and resid 85   and name HG1 ))
   (( segid "    " and resid 67   and name HA  ))
 ASSI { 3915}
   (( segid "    " and resid 85   and name HG2 ))
   (  segid "    " and resid 68   and name HG2%)
      4.600     2.600     1.400 peak  3915 spectrum    1 weight  0.10000E+01 volume  0.11645E-02 ppm1      2.050 ppm2      0.987 CV     1
 OR { 3915}
   (( segid "    " and resid 85   and name HG1 ))
   (  segid "    " and resid 68   and name HG2%)
 OR { 3915}
   (( segid "    " and resid 85   and name HG2 ))
   (  segid "    " and resid 86   and name HD1%)
 OR { 3915}
   (( segid "    " and resid 85   and name HG2 ))
   (  segid "    " and resid 87   and name HG1%)
 ASSI { 3949}
   (( segid "    " and resid 151  and name HG1 ))
   (( segid "    " and resid 63   and name HA1 ))
      4.000     2.000     2.000 peak  3949 spectrum    1 weight  0.10000E+01 volume  0.76060E-03 ppm1      2.273 ppm2      4.451 CV     1
 OR { 3949}
   (( segid "    " and resid 26   and name HG2 ))
   (( segid "    " and resid 25   and name HA  ))
 ASSI { 3976}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 106  and name HA  ))
      4.700     2.800     1.300 peak  3976 spectrum    1 weight  0.10000E+01 volume  0.33870E-03 ppm1      4.768 ppm2      4.429 CV     1
 OR { 3976}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 52   and name HA  ))
 ASSI { 3977}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 42   and name HN  ))
      6.000     6.000     0.000 peak  3977 spectrum    1 weight  0.10000E+01 volume  0.54402E-04 ppm1      4.773 ppm2      7.056 CV     1
 OR { 3977}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 46   and name HH12))
 OR { 3977}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 46   and name HH11))
 OR { 3977}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 46   and name HH21))
 ASSI { 3984}
   (( segid "    " and resid 92   and name HA  ))
   (( segid "    " and resid 91   and name HA1 ))
      5.700     4.000     0.300 peak  3984 spectrum    1 weight  0.10000E+01 volume  0.15228E-03 ppm1      4.879 ppm2      4.292 CV     1
 OR { 3984}
   (( segid "    " and resid 92   and name HA  ))
   (( segid "    " and resid 93   and name HA  ))
 OR { 3984}
   (( segid "    " and resid 149  and name HA  ))
   (( segid "    " and resid 151  and name HA  ))
 ASSI { 4002}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 113  and name HB1 ))
      6.000     4.600     0.000 peak  4002 spectrum    1 weight  0.10000E+01 volume  0.15355E-03 ppm1      4.667 ppm2      2.008 CV     1
 OR { 4002}
   (( segid "    " and resid 48   and name HA  ))
   (  segid "    " and resid 106  and name HE% )
 ASSI { 4044}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 57   and name HB1 ))
      6.000     5.800     0.000 peak  4044 spectrum    1 weight  0.11000E+01 volume  0.12103E-03 ppm1      4.746 ppm2      4.025 CV     1
 OR { 4044}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 53   and name HA1 ))
 ASSI { 4052}
   (( segid "    " and resid 107  and name HB2 ))
   (( segid "    " and resid 53   and name HA1 ))
      5.300     3.500     0.700 peak  4052 spectrum    1 weight  0.11000E+01 volume  0.13390E-03 ppm1      2.291 ppm2      3.978 CV     1
 OR { 4052}
   (( segid "    " and resid 107  and name HB2 ))
   (( segid "    " and resid 57   and name HB2 ))
 ASSI { 4101}
   (( segid "    " and resid 92   and name HA  ))
   (( segid "    " and resid 97   and name HE22))
      5.800     4.200     0.200 peak  4101 spectrum    1 weight  0.10000E+01 volume  0.12583E-03 ppm1      4.861 ppm2      6.781 CV     1
 OR { 4101}
   (( segid "    " and resid 92   and name HA  ))
   (( segid "    " and resid 95   and name HN  ))
 ASSI { 4111}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 48   and name HA  ))
      5.700     4.100     0.300 peak  4111 spectrum    1 weight  0.10000E+01 volume  0.14216E-03 ppm1      5.945 ppm2      4.668 CV     1
 OR { 4111}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 36   and name HA  ))
 ASSI { 4114}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 36   and name HH2 ))
      5.200     3.400     0.800 peak  4114 spectrum    1 weight  0.10000E+01 volume  0.54222E-03 ppm1      5.946 ppm2      7.018 CV     1
 OR { 4114}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 46   and name HH12))
 OR { 4114}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 46   and name HH21))
 OR { 4114}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 46   and name HH11))
 ASSI { 4115}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 36   and name HE3 ))
      3.900     1.900     1.900 peak  4115 spectrum    1 weight  0.10000E+01 volume  0.53000E-03 ppm1      5.942 ppm2      7.227 CV     1
 OR { 4115}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 36   and name HE3 ))
 OR { 4115}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 46   and name HE  ))
 ASSI { 4117}
   (( segid "    " and resid 47   and name HB2 ))
   (  segid "    " and resid 39   and name HD1%)
      3.200     1.300     1.300 peak  4117 spectrum    1 weight  0.10000E+01 volume  0.10391E-02 ppm1      1.789 ppm2      0.763 CV     1
 OR { 4117}
   (( segid "    " and resid 47   and name HB1 ))
   (  segid "    " and resid 39   and name HD1%)
 OR { 4117}
   (( segid "    " and resid 47   and name HB2 ))
   (  segid "    " and resid 45   and name HD1%)
 OR { 4117}
   (( segid "    " and resid 47   and name HB2 ))
   (  segid "    " and resid 39   and name HG2%)
 ASSI { 4118}
   (( segid "    " and resid 47   and name HB2 ))
   (( segid "    " and resid 39   and name HB  ))
      5.100     3.200     0.900 peak  4118 spectrum    1 weight  0.10000E+01 volume  0.52862E-03 ppm1      1.798 ppm2      1.649 CV     1
 OR { 4118}
   (( segid "    " and resid 47   and name HB1 ))
   (( segid "    " and resid 39   and name HB  ))
 OR { 4118}
   (( segid "    " and resid 47   and name HB1 ))
   (( segid "    " and resid 105  and name HG  ))
 OR { 4118}
   (( segid "    " and resid 47   and name HB2 ))
   (( segid "    " and resid 105  and name HG  ))
 ASSI { 4119}
   (( segid "    " and resid 47   and name HB2 ))
   (  segid "    " and resid 106  and name HE% )
      4.900     3.000     1.100 peak  4119 spectrum    1 weight  0.10000E+01 volume  0.68907E-03 ppm1      1.786 ppm2      1.978 CV     1
 OR { 4119}
   (( segid "    " and resid 47   and name HB1 ))
   (  segid "    " and resid 106  and name HE% )
 OR { 4119}
   (( segid "    " and resid 47   and name HB2 ))
   (( segid "    " and resid 113  and name HB1 ))
 OR { 4119}
   (( segid "    " and resid 47   and name HB2 ))
   (( segid "    " and resid 142  and name HB  ))
 OR { 4119}
   (( segid "    " and resid 47   and name HB1 ))
   (( segid "    " and resid 113  and name HB1 ))
 ASSI { 4121}
   (( segid "    " and resid 47   and name HG2 ))
   (  segid "    " and resid 114  and name HG1%)
      3.400     1.500     1.500 peak  4121 spectrum    1 weight  0.10000E+01 volume  0.40742E-02 ppm1      1.386 ppm2      0.936 CV     1
 OR { 4121}
   (( segid "    " and resid 47   and name HG1 ))
   (  segid "    " and resid 114  and name HG1%)
 OR { 4121}
   (( segid "    " and resid 47   and name HG2 ))
   (  segid "    " and resid 105  and name HD1%)
 OR { 4121}
   (( segid "    " and resid 47   and name HG1 ))
   (  segid "    " and resid 105  and name HD1%)
 ASSI { 4126}
   (( segid "    " and resid 47   and name HD2 ))
   (  segid "    " and resid 105  and name HD1%)
      4.400     2.400     1.600 peak  4126 spectrum    1 weight  0.10000E+01 volume  0.15751E-02 ppm1      1.469 ppm2      0.954 CV     1
 OR { 4126}
   (( segid "    " and resid 47   and name HD2 ))
   (  segid "    " and resid 114  and name HG1%)
 OR { 4126}
   (( segid "    " and resid 47   and name HD2 ))
   (( segid "    " and resid 39   and name HG12))
 ASSI { 4127}
   (( segid "    " and resid 47   and name HD2 ))
   (  segid "    " and resid 114  and name HG2%)
      4.500     2.500     1.500 peak  4127 spectrum    1 weight  0.10000E+01 volume  0.10108E-02 ppm1      1.479 ppm2      0.855 CV     1
 OR { 4127}
   (( segid "    " and resid 47   and name HD2 ))
   (  segid "    " and resid 142  and name HG2%)
 ASSI { 4129}
   (( segid "    " and resid 47   and name HD2 ))
   (( segid "    " and resid 114  and name HA  ))
      6.000     6.000     0.000 peak  4129 spectrum    1 weight  0.10000E+01 volume  0.81849E-04 ppm1      1.458 ppm2      5.620 CV     1
 OR { 4129}
   (( segid "    " and resid 47   and name HD2 ))
   (( segid "    " and resid 111  and name HA  ))
 ASSI { 4133}
   (( segid "    " and resid 47   and name HE1 ))
   (  segid "    " and resid 39   and name HD1%)
      5.600     3.900     0.400 peak  4133 spectrum    1 weight  0.10000E+01 volume  0.28038E-03 ppm1      2.578 ppm2      0.758 CV     1
 OR { 4133}
   (( segid "    " and resid 47   and name HE2 ))
   (  segid "    " and resid 39   and name HD1%)
 OR { 4133}
   (( segid "    " and resid 47   and name HE2 ))
   (  segid "    " and resid 39   and name HG2%)
 OR { 4133}
   (( segid "    " and resid 47   and name HE2 ))
   (  segid "    " and resid 45   and name HD1%)
 ASSI { 4134}
   (( segid "    " and resid 47   and name HE1 ))
   (  segid "    " and resid 105  and name HD2%)
      6.000     4.700     0.000 peak  4134 spectrum    1 weight  0.10000E+01 volume  0.21037E-03 ppm1      2.574 ppm2      0.857 CV     1
 OR { 4134}
   (( segid "    " and resid 47   and name HE1 ))
   (  segid "    " and resid 114  and name HG2%)
 OR { 4134}
   (( segid "    " and resid 47   and name HE2 ))
   (  segid "    " and resid 114  and name HG2%)
 OR { 4134}
   (( segid "    " and resid 47   and name HE2 ))
   (  segid "    " and resid 105  and name HD2%)
 ASSI { 4135}
   (( segid "    " and resid 47   and name HE1 ))
   (( segid "    " and resid 37   and name HB1 ))
      4.500     2.500     1.500 peak  4135 spectrum    1 weight  0.10000E+01 volume  0.37863E-03 ppm1      2.593 ppm2      1.964 CV     1
 OR { 4135}
   (( segid "    " and resid 47   and name HE2 ))
   (( segid "    " and resid 37   and name HB1 ))
 OR { 4135}
   (( segid "    " and resid 47   and name HE2 ))
   (  segid "    " and resid 106  and name HE% )
 OR { 4135}
   (( segid "    " and resid 47   and name HE1 ))
   (  segid "    " and resid 106  and name HE% )
 ASSI { 4151}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 134  and name HB2 ))
      5.100     3.200     0.900 peak  4151 spectrum    1 weight  0.10000E+01 volume  0.60544E-03 ppm1      3.973 ppm2      2.000 CV     1
 OR { 4151}
   (( segid "    " and resid 57   and name HB2 ))
   (( segid "    " and resid 110  and name HB2 ))
 ASSI { 4169}
   (( segid "    " and resid 43   and name HA2 ))
   (  segid "    " and resid 44   and name HD2%)
      6.000     6.000     0.000 peak  4169 spectrum    1 weight  0.10000E+01 volume  0.12285E-03 ppm1      3.496 ppm2      0.833 CV     1
 OR { 4169}
   (( segid "    " and resid 43   and name HA2 ))
   (( segid "    " and resid 45   and name HB2 ))
 ASSI { 4187}
   (( segid "    " and resid 109  and name HA1 ))
   (( segid "    " and resid 145  and name HA  ))
      5.500     3.800     0.500 peak  4187 spectrum    1 weight  0.10000E+01 volume  0.35506E-03 ppm1      4.402 ppm2      4.294 CV     1
 OR { 4187}
   (( segid "    " and resid 63   and name HA1 ))
   (( segid "    " and resid 151  and name HA  ))
 ASSI { 4189}
   (( segid "    " and resid 77   and name HA1 ))
   (( segid "    " and resid 74   and name HA  ))
      5.500     3.700     0.500 peak  4189 spectrum    1 weight  0.10000E+01 volume  0.33371E-03 ppm1      4.411 ppm2      4.753 CV     1
 OR { 4189}
   (( segid "    " and resid 109  and name HA1 ))
   (( segid "    " and resid 107  and name HA  ))
 ASSI { 4207}
   (( segid "    " and resid 91   and name HA2 ))
   (( segid "    " and resid 100  and name HB2 ))
      5.700     4.100     0.300 peak  4207 spectrum    1 weight  0.10000E+01 volume  0.69067E-04 ppm1      3.925 ppm2      2.411 CV     1
 OR { 4207}
   (( segid "    " and resid 91   and name HA2 ))
   (( segid "    " and resid 104  and name HB1 ))
 ASSI { 4215}
   (( segid "    " and resid 63   and name HA2 ))
   (( segid "    " and resid 92   and name HA  ))
      6.000     6.000     0.000 peak  4215 spectrum    1 weight  0.10000E+01 volume  0.59925E-04 ppm1      3.519 ppm2      4.853 CV     1
 OR { 4215}
   (( segid "    " and resid 63   and name HA2 ))
   (( segid "    " and resid 149  and name HA  ))
 ASSI { 4217}
   (( segid "    " and resid 63   and name HA2 ))
   (( segid "    " and resid 64   and name HN  ))
      5.900     4.400     0.100 peak  4217 spectrum    1 weight  0.10000E+01 volume  0.10002E-03 ppm1      3.524 ppm2      8.103 CV     1
 OR { 4217}
   (( segid "    " and resid 126  and name HA2 ))
   (( segid "    " and resid 125  and name HN  ))
 ASSI { 4254}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 139  and name HB1 ))
      6.000     6.000     0.000 peak  4254 spectrum    1 weight  0.10000E+01 volume  0.41706E-04 ppm1      3.992 ppm2      2.879 CV     1
 OR { 4254}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 76   and name HB2 ))
 ASSI { 4256}
   (( segid "    " and resid 78   and name HA  ))
   (( segid "    " and resid 74   and name HB1 ))
      5.400     3.700     0.600 peak  4256 spectrum    1 weight  0.10000E+01 volume  0.48994E-03 ppm1      4.054 ppm2      1.983 CV     1
 OR { 4256}
   (( segid "    " and resid 57   and name HB1 ))
   (( segid "    " and resid 110  and name HB2 ))
 OR { 4256}
   (( segid "    " and resid 78   and name HA  ))
   (( segid "    " and resid 80   and name HB  ))
 ASSI { 4304}
   (( segid "    " and resid 102  and name HB2 ))
   (( segid "    " and resid 47   and name HD2 ))
      6.000     4.500     0.000 peak  4304 spectrum    1 weight  0.10000E+01 volume  0.10711E-03 ppm1      3.548 ppm2      1.485 CV     1
 OR { 4304}
   (( segid "    " and resid 102  and name HB2 ))
   (( segid "    " and resid 99   and name HB1 ))
 ASSI { 4307}
   (( segid "    " and resid 102  and name HB2 ))
   (  segid "    " and resid 45   and name HD2%)
      6.000     6.000     0.000 peak  4307 spectrum    1 weight  0.11000E+01 volume  0.14528E-03 ppm1      3.534 ppm2      0.514 CV     1
 OR { 4307}
   (( segid "    " and resid 102  and name HB2 ))
   (  segid "    " and resid 101  and name HD2%)
 ASSI { 4339}
   (( segid "    " and resid 113  and name HA  ))
   (( segid "    " and resid 113  and name HB2 ))
      3.100     1.200     1.200 peak  4339 spectrum    1 weight  0.11000E+01 volume  0.99526E-03 ppm1      5.523 ppm2      1.924 CV     1
 OR { 4339}
   (( segid "    " and resid 113  and name HA  ))
   (( segid "    " and resid 141  and name HB2 ))
 ASSI { 4340}
   (( segid "    " and resid 113  and name HA  ))
   (( segid "    " and resid 113  and name HB1 ))
      3.800     1.800     1.800 peak  4340 spectrum    1 weight  0.11000E+01 volume  0.93177E-03 ppm1      5.523 ppm2      2.018 CV     1
 OR { 4340}
   (( segid "    " and resid 113  and name HA  ))
   (( segid "    " and resid 141  and name HB1 ))
 ASSI { 4429}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 61   and name HA  ))
      5.200     3.400     0.800 peak  4429 spectrum    1 weight  0.10000E+01 volume  0.26636E-03 ppm1      3.616 ppm2      4.426 CV     1
 OR { 4429}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 63   and name HA1 ))
 ASSI { 4438}
   (( segid "    " and resid 145  and name HD2 ))
   (( segid "    " and resid 145  and name HA  ))
      5.100     3.200     0.900 peak  4438 spectrum    1 weight  0.10000E+01 volume  0.58878E-03 ppm1      1.689 ppm2      4.326 CV     1
 OR { 4438}
   (( segid "    " and resid 62   and name HD2 ))
   (( segid "    " and resid 104  and name HA  ))
 ASSI { 4439}
   (( segid "    " and resid 104  and name HG2 ))
   (( segid "    " and resid 104  and name HA  ))
      4.800     2.900     1.200 peak  4439 spectrum    1 weight  0.10000E+01 volume  0.63060E-03 ppm1      1.755 ppm2      4.324 CV     1
 OR { 4439}
   (( segid "    " and resid 145  and name HD1 ))
   (( segid "    " and resid 145  and name HA  ))
 ASSI { 4478}
   (( segid "    " and resid 145  and name HB2 ))
   (  segid "    " and resid 143  and name HG2%)
      4.600     2.700     1.400 peak  4478 spectrum    1 weight  0.11000E+01 volume  0.93772E-03 ppm1      1.686 ppm2      1.054 CV     1
 OR { 4478}
   (( segid "    " and resid 145  and name HB2 ))
   (  segid "    " and resid 67   and name HG2%)
 ASSI { 4482}
   (( segid "    " and resid 66   and name HB  ))
   (( segid "    " and resid 68   and name HA  ))
      5.900     4.400     0.100 peak  4482 spectrum    1 weight  0.11000E+01 volume  0.11814E-03 ppm1      1.693 ppm2      5.599 CV     1
 OR { 4482}
   (( segid "    " and resid 145  and name HB2 ))
   (( segid "    " and resid 68   and name HA  ))
 ASSI { 4516}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 106  and name HA  ))
      5.800     4.200     0.200 peak  4516 spectrum    1 weight  0.10000E+01 volume  0.14556E-03 ppm1      5.206 ppm2      4.363 CV     1
 OR { 4516}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 105  and name HA  ))
 OR { 4516}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 57   and name HA  ))
 ASSI { 4519}
   (( segid "    " and resid 24   and name HB2 ))
   (( segid "    " and resid 25   and name HD2 ))
      5.700     4.000     0.300 peak  4519 spectrum    1 weight  0.10000E+01 volume  0.31091E-03 ppm1      1.923 ppm2      3.733 CV     1
 OR { 4519}
   (( segid "    " and resid 79   and name HB1 ))
   (( segid "    " and resid 73   and name HB1 ))
 OR { 4519}
   (( segid "    " and resid 79   and name HB2 ))
   (( segid "    " and resid 73   and name HB2 ))
 OR { 4519}
   (( segid "    " and resid 79   and name HB1 ))
   (( segid "    " and resid 73   and name HB2 ))
 ASSI { 4521}
   (( segid "    " and resid 59   and name HB2 ))
   (( segid "    " and resid 57   and name HB2 ))
      6.000     4.500     0.000 peak  4521 spectrum    1 weight  0.10000E+01 volume  0.21260E-03 ppm1      1.528 ppm2      4.009 CV     1
 OR { 4521}
   (( segid "    " and resid 59   and name HB2 ))
   (( segid "    " and resid 103  and name HA  ))
 ASSI { 4541}
   (( segid "    " and resid 104  and name HG1 ))
   (  segid "    " and resid 103  and name HG2%)
      6.000     5.500     0.000 peak  4541 spectrum    1 weight  0.10000E+01 volume  0.17344E-03 ppm1      2.112 ppm2      0.997 CV     1
 OR { 4541}
   (( segid "    " and resid 104  and name HG1 ))
   (  segid "    " and resid 105  and name HD1%)
 ASSI { 4544}
   (( segid "    " and resid 39   and name HG11))
   (( segid "    " and resid 39   and name HG12))
      2.300     0.700     0.700 peak  4544 spectrum    1 weight  0.10000E+01 volume  0.22280E-02 ppm1      1.809 ppm2      0.990 CV     1
 OR { 4544}
   (( segid "    " and resid 39   and name HG11))
   (  segid "    " and resid 105  and name HD1%)
 ASSI { 4652}
   (  segid "    " and resid 144  and name HD1%)
   (( segid "    " and resid 146  and name HB  ))
      4.500     2.500     1.500 peak  4652 spectrum    1 weight  0.10000E+01 volume  0.59437E-03 ppm1      0.783 ppm2      4.025 CV     1
 OR { 4652}
   (  segid "    " and resid 144  and name HD1%)
   (( segid "    " and resid 67   and name HB  ))
 ASSI { 4659}
   (( segid "    " and resid 144  and name HB1 ))
   (( segid "    " and resid 60   and name HG2 ))
      6.000     5.800     0.000 peak  4659 spectrum    1 weight  0.10000E+01 volume  0.94737E-04 ppm1      2.375 ppm2      1.862 CV     1
 OR { 4659}
   (( segid "    " and resid 144  and name HB1 ))
   (( segid "    " and resid 145  and name HB1 ))
 ASSI { 4660}
   (( segid "    " and resid 144  and name HB2 ))
   (( segid "    " and resid 60   and name HG2 ))
      6.000     4.600     0.000 peak  4660 spectrum    1 weight  0.10000E+01 volume  0.13006E-03 ppm1      1.311 ppm2      1.867 CV     1
 OR { 4660}
   (( segid "    " and resid 144  and name HB2 ))
   (( segid "    " and resid 145  and name HB1 ))
 ASSI {  103}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 51   and name HA  ))
      3.100     1.200     1.200 peak   103 spectrum    1 weight  0.11000E+01 volume  0.22372E-02 ppm1      8.142 ppm2      4.474 CV     1
 OR {  103}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 50   and name HA  ))
 ASSI {  225}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 8    and name HA  ))
      3.100     1.200     1.200 peak   225 spectrum    1 weight  0.11000E+01 volume  0.26613E-02 ppm1      8.212 ppm2      4.270 CV     1
 OR {  225}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 9    and name HA  ))
 ASSI {  229}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 15   and name HA  ))
      3.200     1.300     1.300 peak   229 spectrum    1 weight  0.11000E+01 volume  0.20882E-02 ppm1      8.135 ppm2      4.307 CV     1
 OR {  229}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 16   and name HA  ))
 ASSI {  232}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 21   and name HA  ))
      3.200     1.300     1.300 peak   232 spectrum    1 weight  0.11000E+01 volume  0.20216E-02 ppm1      8.068 ppm2      4.270 CV     1
 OR {  232}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 20   and name HA  ))
 ASSI {  235}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 21   and name HA  ))
      3.400     3.400     2.600 peak   235 spectrum    1 weight  0.11000E+01 volume  0.15461E-02 ppm1      8.032 ppm2      4.232 CV     1
 OR {  235}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 22   and name HA  ))
 ASSI {  382}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 74   and name HB1 ))
      2.400     0.700     0.700 peak   382 spectrum    1 weight  0.11000E+01 volume  0.80936E-02 ppm1      8.661 ppm2      2.010 CV     1
 OR {  382}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 75   and name HB2 ))
 ASSI {  409}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 34   and name HA  ))
      2.800     1.000     1.000 peak   409 spectrum    1 weight  0.11000E+01 volume  0.37724E-02 ppm1      8.510 ppm2      4.272 CV     1
 OR {  409}
   (( segid "    " and resid 151  and name HN  ))
   (( segid "    " and resid 151  and name HA  ))
 ASSI {  418}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 106  and name HA  ))
      2.700     0.900     0.900 peak   418 spectrum    1 weight  0.11000E+01 volume  0.50664E-02 ppm1      7.864 ppm2      4.360 CV     1
 OR {  418}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 105  and name HA  ))
 ASSI {  492}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 64   and name HA  ))
      2.500     0.800     0.800 peak   492 spectrum    1 weight  0.11000E+01 volume  0.43793E-02 ppm1      8.060 ppm2      4.445 CV     1
 OR {  492}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 63   and name HA1 ))
 ASSI {  556}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 7    and name HA  ))
      3.200     1.300     1.300 peak   556 spectrum    1 weight  0.11000E+01 volume  0.22030E-02 ppm1      8.417 ppm2      4.269 CV     1
 OR {  556}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 6    and name HA  ))
 ASSI {  565}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 9    and name HA  ))
      2.500     0.800     0.800 peak   565 spectrum    1 weight  0.11000E+01 volume  0.10542E-01 ppm1      8.276 ppm2      4.284 CV     1
 OR {  565}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 10   and name HA  ))
 ASSI {  584}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 122  and name HA  ))
      3.200     1.300     1.300 peak   584 spectrum    1 weight  0.11000E+01 volume  0.12349E-02 ppm1      9.381 ppm2      4.495 CV     1
 OR {  584}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 121  and name HA  ))
 ASSI {  628}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 119  and name HA  ))
      2.400     0.700     0.700 peak   628 spectrum    1 weight  0.11000E+01 volume  0.65036E-02 ppm1      9.139 ppm2      3.956 CV     1
 OR {  628}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 118  and name HA  ))
 ASSI {  685}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 62   and name HA  ))
      5.100     3.200     0.900 peak   685 spectrum    1 weight  0.10000E+01 volume  0.33836E-03 ppm1      7.938 ppm2      3.598 CV     1
 OR {  685}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 60   and name HD1 ))
 ASSI {  716}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 86   and name HA  ))
      4.500     2.500     1.500 peak   716 spectrum    1 weight  0.11000E+01 volume  0.49820E-03 ppm1      9.569 ppm2      4.623 CV     1
 OR {  716}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 144  and name HA  ))
 ASSI {  743}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 86   and name HN  ))
      4.100     2.100     1.900 peak   743 spectrum    1 weight  0.11000E+01 volume  0.75865E-03 ppm1      8.334 ppm2      8.820 CV     1
 OR {  743}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 88   and name HN  ))
 ASSI {  744}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 87   and name HN  ))
      3.300     1.300     1.300 peak   744 spectrum    1 weight  0.11000E+01 volume  0.26892E-02 ppm1      8.803 ppm2      8.321 CV     1
 OR {  744}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 85   and name HN  ))
 ASSI {  795}
   (( segid "    " and resid 142  and name HN  ))
   (( segid "    " and resid 111  and name HA  ))
      4.600     4.600     1.400 peak   795 spectrum    1 weight  0.11000E+01 volume  0.40234E-03 ppm1      9.358 ppm2      5.675 CV     1
 OR {  795}
   (( segid "    " and resid 142  and name HN  ))
   (( segid "    " and resid 143  and name HA  ))
 ASSI {  811}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 47   and name HN  ))
      3.000     1.200     1.200 peak   811 spectrum    1 weight  0.11000E+01 volume  0.33935E-02 ppm1      9.578 ppm2      9.015 CV     1
 OR {  811}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 38   and name HN  ))
 ASSI {  814}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 46   and name HA  ))
      4.100     2.100     1.900 peak   814 spectrum    1 weight  0.11000E+01 volume  0.96855E-03 ppm1      9.578 ppm2      5.930 CV     1
 OR {  814}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 47   and name HA  ))
 ASSI {  844}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 42   and name HD22))
      3.500     1.500     1.500 peak   844 spectrum    1 weight  0.10000E+01 volume  0.10999E-02 ppm1      7.658 ppm2      7.874 CV     1
 OR {  844}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 106  and name HN  ))
 ASSI {  856}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 113  and name HB1 ))
      5.400     3.700     0.600 peak   856 spectrum    1 weight  0.10000E+01 volume  0.44177E-03 ppm1      9.130 ppm2      1.985 CV     1
 OR {  856}
   (( segid "    " and resid 50   and name HN  ))
   (  segid "    " and resid 106  and name HE% )
 OR {  856}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 141  and name HG1 ))
 ASSI {  880}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 74   and name HN  ))
      3.800     1.800     1.800 peak   880 spectrum    1 weight  0.11000E+01 volume  0.11518E-02 ppm1      8.192 ppm2      8.658 CV     1
 OR {  880}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 75   and name HN  ))
 ASSI {  882}
   (( segid "    " and resid 86   and name HN  ))
   (  segid "    " and resid 67   and name HG2%)
      3.700     1.700     1.700 peak   882 spectrum    1 weight  0.11000E+01 volume  0.30353E-02 ppm1      8.805 ppm2      1.064 CV     1
 OR {  882}
   (( segid "    " and resid 86   and name HN  ))
   (  segid "    " and resid 68   and name HG1%)
 ASSI {  885}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 67   and name HA  ))
      3.600     1.600     1.600 peak   885 spectrum    1 weight  0.11000E+01 volume  0.12493E-02 ppm1      8.802 ppm2      5.350 CV     1
 OR {  885}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 69   and name HA  ))
 ASSI {  910}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 102  and name HN  ))
      2.300     0.700     0.700 peak   910 spectrum    1 weight  0.11000E+01 volume  0.69581E-02 ppm1      8.223 ppm2      7.186 CV     1
 OR {  910}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 100  and name HN  ))
 ASSI {  932}
   (( segid "    " and resid 105  and name HN  ))
   (  segid "    " and resid 103  and name HG1%)
      4.500     2.500     1.500 peak   932 spectrum    1 weight  0.10000E+01 volume  0.40612E-03 ppm1      7.383 ppm2      1.300 CV     1
 OR {  932}
   (( segid "    " and resid 105  and name HN  ))
   (  segid "    " and resid 99   and name HD1%)
 ASSI {  938}
   (( segid "    " and resid 138  and name HN  ))
   (( segid "    " and resid 118  and name HA  ))
      4.100     2.100     1.900 peak   938 spectrum    1 weight  0.10000E+01 volume  0.47696E-03 ppm1      8.268 ppm2      3.946 CV     1
 OR {  938}
   (( segid "    " and resid 138  and name HN  ))
   (( segid "    " and resid 75   and name HA  ))
 ASSI {  999}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 81   and name HA  ))
      3.000     1.200     1.200 peak   999 spectrum    1 weight  0.11000E+01 volume  0.25255E-02 ppm1      7.770 ppm2      4.717 CV     1
 OR {  999}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 74   and name HA  ))
 ASSI { 1003}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 78   and name HN  ))
      2.200     0.600     0.600 peak  1003 spectrum    1 weight  0.11000E+01 volume  0.65865E-02 ppm1      8.196 ppm2      7.767 CV     1
 OR { 1003}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 76   and name HN  ))
 ASSI { 1011}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 94   and name HB2 ))
      4.000     2.000     2.000 peak  1011 spectrum    1 weight  0.11000E+01 volume  0.73763E-03 ppm1      9.139 ppm2      2.710 CV     1
 OR { 1011}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 92   and name HB2 ))
 ASSI { 1067}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 144  and name HG  ))
      3.800     1.800     1.800 peak  1067 spectrum    1 weight  0.11000E+01 volume  0.12822E-02 ppm1      7.362 ppm2      1.428 CV     1
 OR { 1067}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 145  and name HG2 ))
 ASSI { 1073}
   (( segid "    " and resid 116  and name HN  ))
   (  segid "    " and resid 96   and name HD1%)
      4.300     2.300     1.700 peak  1073 spectrum    1 weight  0.10000E+01 volume  0.69654E-03 ppm1      8.637 ppm2      0.784 CV     1
 OR { 1073}
   (( segid "    " and resid 116  and name HN  ))
   (  segid "    " and resid 45   and name HD1%)
 ASSI { 1074}
   (( segid "    " and resid 116  and name HN  ))
   (  segid "    " and resid 138  and name HD2%)
      4.700     2.800     1.300 peak  1074 spectrum    1 weight  0.10000E+01 volume  0.57069E-03 ppm1      8.637 ppm2      0.874 CV     1
 OR { 1074}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 45   and name HB2 ))
 OR { 1074}
   (( segid "    " and resid 116  and name HN  ))
   (  segid "    " and resid 114  and name HG2%)
 ASSI { 1076}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 139  and name HB2 ))
      5.300     3.500     0.700 peak  1076 spectrum    1 weight  0.10000E+01 volume  0.44862E-03 ppm1      8.643 ppm2      2.688 CV     1
 OR { 1076}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 113  and name HG1 ))
 ASSI { 1078}
   (( segid "    " and resid 112  and name HN  ))
   (  segid "    " and resid 142  and name HG2%)
      3.400     1.400     1.400 peak  1078 spectrum    1 weight  0.11000E+01 volume  0.12474E-02 ppm1      9.965 ppm2      0.832 CV     1
 OR { 1078}
   (( segid "    " and resid 112  and name HN  ))
   (  segid "    " and resid 50   and name HD1%)
 ASSI { 1081}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 144  and name HB2 ))
      5.000     3.100     1.000 peak  1081 spectrum    1 weight  0.10000E+01 volume  0.48238E-03 ppm1      9.961 ppm2      1.304 CV     1
 OR { 1081}
   (( segid "    " and resid 112  and name HN  ))
   (  segid "    " and resid 99   and name HD1%)
 ASSI { 1133}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 45   and name HG  ))
      3.600     1.700     1.700 peak  1133 spectrum    1 weight  0.11000E+01 volume  0.13447E-02 ppm1      8.295 ppm2      1.328 CV     1
 OR { 1133}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 46   and name HG2 ))
 ASSI { 1138}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 47   and name HN  ))
      3.900     1.900     1.900 peak  1138 spectrum    1 weight  0.11000E+01 volume  0.11404E-02 ppm1      8.294 ppm2      9.006 CV     1
 OR { 1138}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 38   and name HN  ))
 ASSI { 1149}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 127  and name HB1 ))
      3.100     1.200     1.200 peak  1149 spectrum    1 weight  0.11000E+01 volume  0.23435E-02 ppm1      7.857 ppm2      2.990 CV     1
 OR { 1149}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 131  and name HB1 ))
 ASSI { 1159}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 10   and name HB2 ))
      3.100     1.200     1.200 peak  1159 spectrum    1 weight  0.10000E+01 volume  0.34249E-02 ppm1      8.272 ppm2      1.968 CV     1
 OR { 1159}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 11   and name HB2 ))
 ASSI { 1191}
   (( segid "    " and resid 122  and name HN  ))
   (  segid "    " and resid 96   and name HD1%)
      5.200     3.400     0.800 peak  1191 spectrum    1 weight  0.11000E+01 volume  0.31734E-03 ppm1      9.379 ppm2      0.718 CV     1
 OR { 1191}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 132  and name HG12))
 ASSI { 1196}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 118  and name HB2 ))
      4.200     2.200     1.800 peak  1196 spectrum    1 weight  0.11000E+01 volume  0.66018E-03 ppm1      9.380 ppm2      3.552 CV     1
 OR { 1196}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 123  and name HA2 ))
 ASSI { 1219}
   (( segid "    " and resid 69   and name HN  ))
   (  segid "    " and resid 143  and name HG2%)
      4.000     2.000     2.000 peak  1219 spectrum    1 weight  0.11000E+01 volume  0.13832E-02 ppm1      8.726 ppm2      1.057 CV     1
 OR { 1219}
   (( segid "    " and resid 69   and name HN  ))
   (  segid "    " and resid 68   and name HG1%)
 ASSI { 1240}
   (( segid "    " and resid 64   and name HE21))
   (( segid "    " and resid 89   and name HA  ))
      5.700     4.000     0.300 peak  1240 spectrum    1 weight  0.10000E+01 volume  0.24155E-03 ppm1      6.336 ppm2      4.562 CV     1
 OR { 1240}
   (( segid "    " and resid 64   and name HE21))
   (( segid "    " and resid 148  and name HA  ))
 ASSI { 1249}
   (( segid "    " and resid 97   and name HN  ))
   (  segid "    " and resid 98   and name HB% )
      4.500     2.500     1.500 peak  1249 spectrum    1 weight  0.11000E+01 volume  0.91519E-03 ppm1      9.046 ppm2      1.130 CV     1
 OR { 1249}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 96   and name HG12))
 ASSI { 1269}
   (( segid "    " and resid 97   and name HE22))
   (( segid "    " and resid 62   and name HG1 ))
      5.000     3.200     1.000 peak  1269 spectrum    1 weight  0.10000E+01 volume  0.68072E-03 ppm1      6.775 ppm2      1.512 CV     1
 OR { 1269}
   (( segid "    " and resid 97   and name HE22))
   (( segid "    " and resid 99   and name HB1 ))
 ASSI { 1271}
   (( segid "    " and resid 97   and name HE22))
   (  segid "    " and resid 101  and name HD2%)
      5.100     3.200     0.900 peak  1271 spectrum    1 weight  0.10000E+01 volume  0.44012E-03 ppm1      6.777 ppm2      0.555 CV     1
 OR { 1271}
   (( segid "    " and resid 97   and name HE22))
   (  segid "    " and resid 45   and name HD2%)
 ASSI { 1279}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 124  and name HD2 ))
      3.000     1.200     1.200 peak  1279 spectrum    1 weight  0.11000E+01 volume  0.23409E-02 ppm1      8.076 ppm2      3.559 CV     1
 OR { 1279}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 126  and name HA2 ))
 ASSI { 1308}
   (( segid "    " and resid 125  and name HE22))
   (( segid "    " and resid 126  and name HN  ))
      2.000     2.000     4.000 peak  1308 spectrum    1 weight  0.10000E+01 volume  0.15518E-02 ppm1      6.829 ppm2      7.079 CV     1
 OR { 1308}
   (( segid "    " and resid 125  and name HE22))
   (  segid "    " and resid 122  and name HD% )
 ASSI { 1345}
   (( segid "    " and resid 71   and name HE22))
   (( segid "    " and resid 140  and name HB2 ))
      5.100     3.300     0.900 peak  1345 spectrum    1 weight  0.10000E+01 volume  0.42690E-03 ppm1      6.659 ppm2      1.323 CV     1
 OR { 1345}
   (( segid "    " and resid 71   and name HE22))
   (  segid "    " and resid 99   and name HD1%)
 ASSI { 1349}
   (( segid "    " and resid 75   and name HN  ))
   (  segid "    " and resid 132  and name HG2%)
      3.900     1.900     1.900 peak  1349 spectrum    1 weight  0.10000E+01 volume  0.11706E-02 ppm1      8.662 ppm2      0.948 CV     1
 OR { 1349}
   (( segid "    " and resid 75   and name HN  ))
   (  segid "    " and resid 80   and name HG1%)
 ASSI { 1361}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 69   and name HE1 ))
      4.900     3.100     1.100 peak  1361 spectrum    1 weight  0.10000E+01 volume  0.41485E-03 ppm1      9.068 ppm2      7.747 CV     1
 OR { 1361}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 69   and name HE1 ))
 ASSI { 1373}
   (( segid "    " and resid 141  and name HN  ))
   (  segid "    " and resid 140  and name HD1%)
      3.300     1.300     1.300 peak  1373 spectrum    1 weight  0.11000E+01 volume  0.33772E-02 ppm1      9.190 ppm2      0.926 CV     1
 OR { 1373}
   (( segid "    " and resid 141  and name HN  ))
   (  segid "    " and resid 70   and name HD1%)
 ASSI { 1413}
   (( segid "    " and resid 42   and name HD21))
   (( segid "    " and resid 46   and name HB2 ))
      4.900     3.000     1.100 peak  1413 spectrum    1 weight  0.10000E+01 volume  0.54024E-03 ppm1      6.488 ppm2      1.782 CV     1
 OR { 1413}
   (( segid "    " and resid 42   and name HD21))
   (( segid "    " and resid 39   and name HG11))
 OR { 1413}
   (( segid "    " and resid 42   and name HD21))
   (( segid "    " and resid 46   and name HB1 ))
 ASSI { 1419}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 74   and name HB1 ))
      2.900     1.100     1.100 peak  1419 spectrum    1 weight  0.11000E+01 volume  0.13910E-02 ppm1      7.722 ppm2      1.992 CV     1
 OR { 1419}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 75   and name HB1 ))
 ASSI { 1466}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 95   and name HB  ))
      4.400     2.400     1.600 peak  1466 spectrum    1 weight  0.11000E+01 volume  0.74401E-03 ppm1      7.201 ppm2      1.797 CV     1
 OR { 1466}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 101  and name HG  ))
 ASSI { 1469}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 96   and name HG11))
      3.400     1.500     1.500 peak  1469 spectrum    1 weight  0.11000E+01 volume  0.23626E-02 ppm1      7.201 ppm2      1.330 CV     1
 OR { 1469}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 99   and name HG  ))
 OR { 1469}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 99   and name HB2 ))
 ASSI { 1492}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 118  and name HA  ))
      4.900     3.000     1.100 peak  1492 spectrum    1 weight  0.11000E+01 volume  0.40801E-03 ppm1      8.166 ppm2      3.974 CV     1
 OR { 1492}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 119  and name HA  ))
 ASSI { 1597}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 107  and name HB2 ))
      3.200     1.200     1.200 peak  1597 spectrum    1 weight  0.11000E+01 volume  0.31626E-02 ppm1      9.206 ppm2      2.309 CV     1
 OR { 1597}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 52   and name HB1 ))
 ASSI { 1602}
   (( segid "    " and resid 41   and name HN  ))
   (  segid "    " and resid 39   and name HG2%)
      4.400     2.400     1.600 peak  1602 spectrum    1 weight  0.11000E+01 volume  0.81886E-03 ppm1      7.561 ppm2      0.815 CV     1
 OR { 1602}
   (( segid "    " and resid 41   and name HN  ))
   (  segid "    " and resid 40   and name HD1%)
 ASSI { 1605}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 40   and name HB1 ))
      4.200     2.200     1.800 peak  1605 spectrum    1 weight  0.11000E+01 volume  0.10194E-02 ppm1      7.557 ppm2      1.814 CV     1
 OR { 1605}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 39   and name HG11))
 ASSI { 1608}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 39   and name HA  ))
      3.800     1.800     1.800 peak  1608 spectrum    1 weight  0.11000E+01 volume  0.88898E-03 ppm1      7.558 ppm2      3.479 CV     1
 OR { 1608}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 43   and name HA2 ))
 ASSI { 1664}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 110  and name HB2 ))
      5.300     3.600     0.700 peak  1664 spectrum    1 weight  0.10000E+01 volume  0.47578E-03 ppm1      8.827 ppm2      1.975 CV     1
 OR { 1664}
   (( segid "    " and resid 109  and name HN  ))
   (  segid "    " and resid 106  and name HE% )
 OR { 1664}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 60   and name HG1 ))
 ASSI { 1700}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 118  and name HA  ))
      3.000     1.100     1.100 peak  1700 spectrum    1 weight  0.11000E+01 volume  0.31618E-02 ppm1      7.720 ppm2      3.949 CV     1
 OR { 1700}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 119  and name HA  ))
 ASSI { 1722}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 140  and name HB1 ))
      4.300     2.300     1.700 peak  1722 spectrum    1 weight  0.11000E+01 volume  0.48286E-03 ppm1      9.172 ppm2      1.882 CV     1
 OR { 1722}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 79   and name HB1 ))
 OR { 1722}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 79   and name HB2 ))
 ASSI { 1743}
   (( segid "    " and resid 102  and name HN  ))
   (  segid "    " and resid 99   and name HD1%)
      4.000     2.000     2.000 peak  1743 spectrum    1 weight  0.11000E+01 volume  0.10533E-02 ppm1      7.162 ppm2      1.285 CV     1
 OR { 1743}
   (( segid "    " and resid 102  and name HN  ))
   (  segid "    " and resid 103  and name HG1%)
 ASSI { 1783}
   (( segid "    " and resid 106  and name HN  ))
   (  segid "    " and resid 39   and name HD1%)
      4.000     2.000     2.000 peak  1783 spectrum    1 weight  0.10000E+01 volume  0.89866E-03 ppm1      7.865 ppm2      0.765 CV     1
 OR { 1783}
   (( segid "    " and resid 106  and name HN  ))
   (  segid "    " and resid 144  and name HD1%)
 ASSI { 1801}
   (( segid "    " and resid 113  and name HN  ))
   (  segid "    " and resid 114  and name HG1%)
      5.000     3.100     1.000 peak  1801 spectrum    1 weight  0.10000E+01 volume  0.43918E-03 ppm1      9.104 ppm2      0.940 CV     1
 OR { 1801}
   (( segid "    " and resid 113  and name HN  ))
   (  segid "    " and resid 140  and name HD1%)
 OR { 1801}
   (( segid "    " and resid 113  and name HN  ))
   (  segid "    " and resid 142  and name HG1%)
 OR { 1801}
   (( segid "    " and resid 94   and name HN  ))
   (  segid "    " and resid 68   and name HG2%)
 ASSI { 1812}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 47   and name HB2 ))
      4.200     2.200     1.800 peak  1812 spectrum    1 weight  0.10000E+01 volume  0.73527E-03 ppm1      9.140 ppm2      1.741 CV     1
 OR { 1812}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 52   and name HG2 ))
 OR { 1812}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 105  and name HB2 ))
 OR { 1812}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 45   and name HB1 ))
 ASSI { 1813}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 47   and name HD2 ))
      4.900     3.000     1.100 peak  1813 spectrum    1 weight  0.10000E+01 volume  0.34827E-03 ppm1      9.141 ppm2      1.461 CV     1
 OR { 1813}
   (( segid "    " and resid 119  and name HN  ))
   (  segid "    " and resid 137  and name HB% )
 ASSI {   21}
   (  segid "    " and resid 120  and name HE% )
   (( segid "    " and resid 117  and name HB2 ))
      3.400     1.400     1.400 peak    21 spectrum    1 weight  0.11000E+01 volume  0.56409E-03 ppm1      6.694 ppm2      2.484 CV     1
 OR {   21}
   (  segid "    " and resid 120  and name HE% )
   (( segid "    " and resid 97   and name HG2 ))
 ASSI {   23}
   (  segid "    " and resid 120  and name HD% )
   (( segid "    " and resid 117  and name HB2 ))
      2.600     0.800     0.800 peak    23 spectrum    1 weight  0.11000E+01 volume  0.99039E-03 ppm1      6.910 ppm2      2.484 CV     1
 OR {   23}
   (  segid "    " and resid 120  and name HD% )
   (( segid "    " and resid 97   and name HG2 ))
 ASSI {   48}
   (( segid "    " and resid 69   and name HD2 ))
   (( segid "    " and resid 70   and name HA  ))
      2.700     0.900     0.900 peak    48 spectrum    1 weight  0.11000E+01 volume  0.93543E-03 ppm1      6.908 ppm2      5.386 CV     1
 OR {   48}
   (( segid "    " and resid 69   and name HD2 ))
   (( segid "    " and resid 69   and name HA  ))
 ASSI {   95}
   (  segid "    " and resid 88   and name HD% )
   (( segid "    " and resid 86   and name HG  ))
      3.100     1.200     1.200 peak    95 spectrum    1 weight  0.11000E+01 volume  0.11454E-02 ppm1      6.955 ppm2      1.596 CV     1
 OR {   95}
   (  segid "    " and resid 88   and name HD% )
   (( segid "    " and resid 90   and name HG  ))
 ASSI {   96}
   (  segid "    " and resid 88   and name HD% )
   (  segid "    " and resid 103  and name HG1%)
      4.600     2.600     1.400 peak    96 spectrum    1 weight  0.11000E+01 volume  0.19382E-03 ppm1      6.949 ppm2      1.297 CV     1
 OR {   96}
   (  segid "    " and resid 88   and name HD% )
   (( segid "    " and resid 99   and name HB2 ))
 ASSI {   99}
   (  segid "    " and resid 88   and name HE% )
   (( segid "    " and resid 90   and name HG  ))
      4.500     2.500     1.500 peak    99 spectrum    1 weight  0.11000E+01 volume  0.29212E-03 ppm1      7.155 ppm2      1.592 CV     1
 OR {   99}
   (  segid "    " and resid 88   and name HE% )
   (( segid "    " and resid 86   and name HG  ))
 ASSI {  117}
   (  segid "    " and resid 120  and name HD% )
   (  segid "    " and resid 116  and name HB% )
      4.500     2.500     1.500 peak   117 spectrum    1 weight  0.11000E+01 volume  0.29892E-03 ppm1      6.917 ppm2      1.117 CV     1
 OR {  117}
   (  segid "    " and resid 120  and name HD% )
   (  segid "    " and resid 98   and name HB% )
 ASSI {  120}
   (  segid "    " and resid 122  and name HE% )
   (  segid "    " and resid 96   and name HD1%)
      3.500     1.600     1.600 peak   120 spectrum    1 weight  0.11000E+01 volume  0.61503E-03 ppm1      6.623 ppm2      0.750 CV     1
 OR {  120}
   (  segid "    " and resid 122  and name HE% )
   (( segid "    " and resid 132  and name HG12))
 ASSI {  145}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 127  and name HB2 ))
      4.900     3.000     1.100 peak   145 spectrum    1 weight  0.10000E+01 volume  0.27953E-03 ppm1      7.457 ppm2      2.660 CV     1
 OR {  145}
   (( segid "    " and resid 36   and name HZ2 ))
   (( segid "    " and resid 113  and name HG1 ))
 ASSI {  157}
   (( segid "    " and resid 36   and name HE3 ))
   (( segid "    " and resid 47   and name HA  ))
      3.300     1.400     1.400 peak   157 spectrum    1 weight  0.11000E+01 volume  0.42151E-03 ppm1      7.221 ppm2      5.939 CV     1
 OR {  157}
   (( segid "    " and resid 36   and name HE3 ))
   (( segid "    " and resid 46   and name HA  ))
 ASSI {  166}
   (  segid "    " and resid 88   and name HE% )
   (  segid "    " and resid 99   and name HD1%)
      3.700     1.700     1.700 peak   166 spectrum    1 weight  0.11000E+01 volume  0.61272E-03 ppm1      7.170 ppm2      1.301 CV     1
 OR {  166}
   (  segid "    " and resid 88   and name HE% )
   (  segid "    " and resid 103  and name HG1%)
 ASSI {  268}
   (( segid "    " and resid 96   and name HG11))
   (( segid "    " and resid 100  and name HN  ))
      3.100     1.200     1.200 peak   268 spectrum    1 weight  0.10000E+01 volume  0.40690E-02 ppm1      1.304 ppm2      7.178 CV     1
 OR {  268}
   (  segid "    " and resid 99   and name HD1%)
   (  segid "    " and resid 88   and name HE% )
 OR {  268}
   (  segid "    " and resid 99   and name HD1%)
   (( segid "    " and resid 102  and name HN  ))
 OR {  268}
   (  segid "    " and resid 103  and name HG1%)
   (  segid "    " and resid 88   and name HE% )
 ASSI {  343}
   (( segid "    " and resid 68   and name HB  ))
   (  segid "    " and resid 142  and name HG1%)
      3.000     1.100     1.100 peak   343 spectrum    1 weight  0.10000E+01 volume  0.37825E-02 ppm1      2.225 ppm2      0.859 CV     1
 OR {  343}
   (( segid "    " and resid 83   and name HG1 ))
   (  segid "    " and resid 70   and name HD2%)
 OR {  343}
   (( segid "    " and resid 83   and name HG1 ))
   (  segid "    " and resid 86   and name HD2%)
 OR {  343}
   (( segid "    " and resid 83   and name HG2 ))
   (  segid "    " and resid 70   and name HD2%)
 OR {  343}
   (( segid "    " and resid 68   and name HB  ))
   (  segid "    " and resid 142  and name HG2%)
 OR {  343}
   (( segid "    " and resid 106  and name HB1 ))
   (  segid "    " and resid 142  and name HG2%)
 OR {  343}
   (( segid "    " and resid 68   and name HB  ))
   (  segid "    " and resid 86   and name HD2%)
 OR {  343}
   (( segid "    " and resid 83   and name HG2 ))
   (  segid "    " and resid 86   and name HD2%)
 ASSI {  481}
   (( segid "    " and resid 17   and name HD1 ))
   (( segid "    " and resid 19   and name HA  ))
      2.900     2.900     3.100 peak   481 spectrum    1 weight  0.10000E+01 volume  0.31521E-02 ppm1      3.218 ppm2      4.630 CV     1
 OR {  481}
   (( segid "    " and resid 128  and name HD2 ))
   (( segid "    " and resid 81   and name HA  ))

!Dihedral angle constraints :
! using 1.5 times the talos error! 

!  5   P   TALOS  PHI = -69.42 +/- 14.88 
ASSIGN  (resid  4   and name C ) (resid  5   and name N )
        (resid  5   and name CA) (resid  5   and name C )   1.00  -69.0 22.5  2 
 
!  26   E   TALOS  PHI = -86.55 +/- 22.77 
ASSIGN  (resid  25   and name C ) (resid  26   and name N )
        (resid  26   and name CA) (resid  26   and name C )   1.00  -87.0 34.5  2 
 
!  28   A   TALOS  PHI = -89.09 +/- 19.5 
ASSIGN  (resid  27   and name C ) (resid  28   and name N )
        (resid  28   and name CA) (resid  28   and name C )   1.00  -89.0 30.0  2 
 
!  29   P   TALOS  PHI = -69.09 +/- 18.62 
ASSIGN  (resid  28   and name C ) (resid  29   and name N )
        (resid  29   and name CA) (resid  29   and name C )   1.00  -69.0 28.5  2 
 
!  32   A   TALOS  PHI = -82.39 +/- 18.89 
ASSIGN  (resid  31   and name C ) (resid  32   and name N )
        (resid  32   and name CA) (resid  32   and name C )   1.00  -82.0 28.5  2 
 
!  37   L   TALOS  PHI = -102.66 +/- 21.66 
ASSIGN  (resid  36   and name C ) (resid  37   and name N )
        (resid  37   and name CA) (resid  37   and name C )   1.00  -103.0 33.0  2 
 
!  38   D   TALOS  PHI = -82.26 +/- 12.01 
ASSIGN  (resid  37   and name C ) (resid  38   and name N )
        (resid  38   and name CA) (resid  38   and name C )   1.00  -82.0 18.0  2 
 
!  39   I   TALOS  PHI = -67.37 +/- 14.62 
ASSIGN  (resid  38   and name C ) (resid  39   and name N )
        (resid  39   and name CA) (resid  39   and name C )   1.00  -67.0 22.5  2 
 
!  45   L   TALOS  PHI = -103.37 +/- 9.79 
ASSIGN  (resid  44   and name C ) (resid  45   and name N )
        (resid  45   and name CA) (resid  45   and name C )   1.00  -103.0 15.0  2 
 
!  46   R   TALOS  PHI = -124.14 +/- 11.67 
ASSIGN  (resid  45   and name C ) (resid  46   and name N )
        (resid  46   and name CA) (resid  46   and name C )   1.00  -124.0 18.0  2 
 
!  47   K   TALOS  PHI = -129.36 +/- 15.77 
ASSIGN  (resid  46   and name C ) (resid  47   and name N )
        (resid  47   and name CA) (resid  47   and name C )   1.00  -129.0 24.0  2 
 
!  48   K   TALOS  PHI = -107.48 +/- 19.21 
ASSIGN  (resid  47   and name C ) (resid  48   and name N )
        (resid  48   and name CA) (resid  48   and name C )   1.00  -107.0 28.5  2 
 
!  51   V   TALOS  PHI = -107.2 +/- 22.07 
ASSIGN  (resid  50   and name C ) (resid  51   and name N )
        (resid  51   and name CA) (resid  51   and name C )   1.00  -107.0 33.0  2 
 
!  58   S   TALOS  PHI = -118.25 +/- 27.19 
ASSIGN  (resid  57   and name C ) (resid  58   and name N )
        (resid  58   and name CA) (resid  58   and name C )   1.00  -118.0 40.5  2 
 
!  59   R   TALOS  PHI = -118.28 +/- 18.11 
ASSIGN  (resid  58   and name C ) (resid  59   and name N )
        (resid  59   and name CA) (resid  59   and name C )   1.00  -118.0 27.0  2 
 
!  61   V   TALOS  PHI = -114.37 +/- 15.51 
ASSIGN  (resid  60   and name C ) (resid  61   and name N )
        (resid  61   and name CA) (resid  61   and name C )   1.00  -114.0 24.0  2 
 
!  64   Q   TALOS  PHI = -98.39 +/- 38.81 
ASSIGN  (resid  63   and name C ) (resid  64   and name N )
        (resid  64   and name CA) (resid  64   and name C )   1.00  -98.0 58.5  2 
 
!  65   V   TALOS  PHI = -94.23 +/- 17.09 
ASSIGN  (resid  64   and name C ) (resid  65   and name N )
        (resid  65   and name CA) (resid  65   and name C )   1.00  -94.0 25.5  2 
 
!  66   V   TALOS  PHI = -127.6 +/- 17.67 
ASSIGN  (resid  65   and name C ) (resid  66   and name N )
        (resid  66   and name CA) (resid  66   and name C )   1.00  -128.0 27.0  2 
 
!  67   T   TALOS  PHI = -115.32 +/- 16.64 
ASSIGN  (resid  66   and name C ) (resid  67   and name N )
        (resid  67   and name CA) (resid  67   and name C )   1.00  -115.0 25.5  2 
 
!  68   V   TALOS  PHI = -127.53 +/- 10.58 
ASSIGN  (resid  67   and name C ) (resid  68   and name N )
        (resid  68   and name CA) (resid  68   and name C )   1.00  -128.0 16.5  2 
 
!  69   H   TALOS  PHI = -125.19 +/- 13.16 
ASSIGN  (resid  68   and name C ) (resid  69   and name N )
        (resid  69   and name CA) (resid  69   and name C )   1.00  -125.0 19.5  2 
 
!  70   L   TALOS  PHI = -122.83 +/- 9.15 
ASSIGN  (resid  69   and name C ) (resid  70   and name N )
        (resid  70   and name CA) (resid  70   and name C )   1.00  -123.0 13.5  2 
 
!  71   Q   TALOS  PHI = -118.04 +/- 19.16 
ASSIGN  (resid  70   and name C ) (resid  71   and name N )
        (resid  71   and name CA) (resid  71   and name C )   1.00  -118.0 28.5  2 
 
!  72   T   TALOS  PHI = -112.26 +/- 17.41 
ASSIGN  (resid  71   and name C ) (resid  72   and name N )
        (resid  72   and name CA) (resid  72   and name C )   1.00  -112.0 25.5  2 
 
!  73   S   TALOS  PHI = -128.64 +/- 15.64 
ASSIGN  (resid  72   and name C ) (resid  73   and name N )
        (resid  73   and name CA) (resid  73   and name C )   1.00  -129.0 24.0  2 
 
!  74   L   TALOS  PHI = -89.8 +/- 23.47 
ASSIGN  (resid  73   and name C ) (resid  74   and name N )
        (resid  74   and name CA) (resid  74   and name C )   1.00  -90.0 34.5  2 
 
!  75   E   TALOS  PHI = -67.65 +/- 10.84 
ASSIGN  (resid  74   and name C ) (resid  75   and name N )
        (resid  75   and name CA) (resid  75   and name C )   1.00  -68.0 16.5  2 
 
!  76   N   TALOS  PHI = -84.44 +/- 8.69 
ASSIGN  (resid  75   and name C ) (resid  76   and name N )
        (resid  76   and name CA) (resid  76   and name C )   1.00  -84.0 13.5  2 
 
!  78   T   TALOS  PHI = -82.26 +/- 13.04 
ASSIGN  (resid  77   and name C ) (resid  78   and name N )
        (resid  78   and name CA) (resid  78   and name C )   1.00  -82.0 19.5  2 
 
!  80   V   TALOS  PHI = -104.0 +/- 14.13 
ASSIGN  (resid  79   and name C ) (resid  80   and name N )
        (resid  80   and name CA) (resid  80   and name C )   1.00  -104.0 21.0  2 
 
!  81   Q   TALOS  PHI = -145.16 +/- 19.76 
ASSIGN  (resid  80   and name C ) (resid  81   and name N )
        (resid  81   and name CA) (resid  81   and name C )   1.00  -145.0 30.0  2 
 
!  82   E   TALOS  PHI = -117.78 +/- 23.16 
ASSIGN  (resid  81   and name C ) (resid  82   and name N )
        (resid  82   and name CA) (resid  82   and name C )   1.00  -118.0 34.5  2 
 
!  83   E   TALOS  PHI = -125.07 +/- 21.32 
ASSIGN  (resid  82   and name C ) (resid  83   and name N )
        (resid  83   and name CA) (resid  83   and name C )   1.00  -125.0 31.5  2 
 
!  87   V   TALOS  PHI = -109.27 +/- 13.29 
ASSIGN  (resid  86   and name C ) (resid  87   and name N )
        (resid  87   and name CA) (resid  87   and name C )   1.00  -109.0 19.5  2 
 
!  88   F   TALOS  PHI = -140.24 +/- 21.83 
ASSIGN  (resid  87   and name C ) (resid  88   and name N )
        (resid  88   and name CA) (resid  88   and name C )   1.00  -140.0 33.0  2 
 
!  89   T   TALOS  PHI = -94.37 +/- 12.93 
ASSIGN  (resid  88   and name C ) (resid  89   and name N )
        (resid  89   and name CA) (resid  89   and name C )   1.00  -94.0 19.5  2 
 
!  90   L   TALOS  PHI = -77.15 +/- 16.87 
ASSIGN  (resid  89   and name C ) (resid  90   and name N )
        (resid  90   and name CA) (resid  90   and name C )   1.00  -77.0 25.5  2 
 
!  94   D   TALOS  PHI = -86.03 +/- 22.75 
ASSIGN  (resid  93   and name C ) (resid  94   and name N )
        (resid  94   and name CA) (resid  94   and name C )   1.00  -86.0 34.5  2 
 
!  98   A   TALOS  PHI = -62.86 +/- 8.79 
ASSIGN  (resid  97   and name C ) (resid  98   and name N )
        (resid  98   and name CA) (resid  98   and name C )   1.00  -63.0 13.5  2 
 
!  99   L   TALOS  PHI = -79.95 +/- 15.65 
ASSIGN  (resid  98   and name C ) (resid  99   and name N )
        (resid  99   and name CA) (resid  99   and name C )   1.00  -80.0 24.0  2 
 
!  100   D   TALOS  PHI = -68.12 +/- 9.1 
ASSIGN  (resid  99   and name C ) (resid  100   and name N )
        (resid  100   and name CA) (resid  100   and name C )   1.00  -68.0 13.5  2 
 
!  101   L   TALOS  PHI = -71.3 +/- 11.43 
ASSIGN  (resid  100   and name C ) (resid  101   and name N )
        (resid  101   and name CA) (resid  101   and name C )   1.00  -71.0 16.5  2 
 
!  103   V   TALOS  PHI = -61.85 +/- 14.58 
ASSIGN  (resid  102   and name C ) (resid  103   and name N )
        (resid  103   and name CA) (resid  103   and name C )   1.00  -62.0 22.5  2 
 
!  104   P   TALOS  PHI = -67.84 +/- 8.17 
ASSIGN  (resid  103   and name C ) (resid  104   and name N )
        (resid  104   and name CA) (resid  104   and name C )   1.00  -68.0 12.0  2 
 
!  107   D   TALOS  PHI = -88.14 +/- 20.26 
ASSIGN  (resid  106   and name C ) (resid  107   and name N )
        (resid  107   and name CA) (resid  107   and name C )   1.00  -88.0 30.0  2 
 
!  108   V   TALOS  PHI = -61.4 +/- 11.96 
ASSIGN  (resid  107   and name C ) (resid  108   and name N )
        (resid  108   and name CA) (resid  108   and name C )   1.00  -61.0 18.0  2 
 
!  110   E   TALOS  PHI = -93.96 +/- 33.68 
ASSIGN  (resid  109   and name C ) (resid  110   and name N )
        (resid  110   and name CA) (resid  110   and name C )   1.00  -94.0 51.0  2 
 
!  111   T   TALOS  PHI = -118.76 +/- 10.49 
ASSIGN  (resid  110   and name C ) (resid  111   and name N )
        (resid  111   and name CA) (resid  111   and name C )   1.00  -119.0 15.0  2 
 
!  112   A   TALOS  PHI = -127.62 +/- 16.44 
ASSIGN  (resid  111   and name C ) (resid  112   and name N )
        (resid  112   and name CA) (resid  112   and name C )   1.00  -128.0 24.0  2 
 
!  113   M   TALOS  PHI = -121.43 +/- 15.48 
ASSIGN  (resid  112   and name C ) (resid  113   and name N )
        (resid  113   and name CA) (resid  113   and name C )   1.00  -121.0 22.5  2 
 
!  114   V   TALOS  PHI = -118.39 +/- 8.19 
ASSIGN  (resid  113   and name C ) (resid  114   and name N )
        (resid  114   and name CA) (resid  114   and name C )   1.00  -118.0 12.0  2 
 
!  115   T   TALOS  PHI = -117.94 +/- 16.7 
ASSIGN  (resid  114   and name C ) (resid  115   and name N )
        (resid  115   and name CA) (resid  115   and name C )   1.00  -118.0 25.5  2 
 
!  116   A   TALOS  PHI = -133.64 +/- 19.04 
ASSIGN  (resid  115   and name C ) (resid  116   and name N )
        (resid  116   and name CA) (resid  116   and name C )   1.00  -134.0 28.5  2 
 
!  117   D   TALOS  PHI = -104.38 +/- 34.16 
ASSIGN  (resid  116   and name C ) (resid  117   and name N )
        (resid  117   and name CA) (resid  117   and name C )   1.00  -104.0 51.0  2 
 
!  118   S   TALOS  PHI = -61.57 +/- 7.29 
ASSIGN  (resid  117   and name C ) (resid  118   and name N )
        (resid  118   and name CA) (resid  118   and name C )   1.00  -62.0 10.5  2 
 
!  119   K   TALOS  PHI = -65.86 +/- 7.07 
ASSIGN  (resid  118   and name C ) (resid  119   and name N )
        (resid  119   and name CA) (resid  119   and name C )   1.00  -66.0 10.5  2 
 
!  125   Q   TALOS  PHI = -78.78 +/- 15.16 
ASSIGN  (resid  124   and name C ) (resid  125   and name N )
        (resid  125   and name CA) (resid  125   and name C )   1.00  -79.0 22.5  2 
 
!  127   S   TALOS  PHI = -112.31 +/- 11.47 
ASSIGN  (resid  126   and name C ) (resid  127   and name N )
        (resid  127   and name CA) (resid  127   and name C )   1.00  -112.0 16.5  2 
 
!  130   P   TALOS  PHI = -80.26 +/- 30.15 
ASSIGN  (resid  129   and name C ) (resid  130   and name N )
        (resid  130   and name CA) (resid  130   and name C )   1.00  -80.0 45.0  2 
 
!  131   Y   TALOS  PHI = -84.99 +/- 19.1 
ASSIGN  (resid  130   and name C ) (resid  131   and name N )
        (resid  131   and name CA) (resid  131   and name C )   1.00  -85.0 28.5  2 
 
!  132   I   TALOS  PHI = -111.82 +/- 29.72 
ASSIGN  (resid  131   and name C ) (resid  132   and name N )
        (resid  132   and name CA) (resid  132   and name C )   1.00  -112.0 45.0  2 
 
!  134   P   TALOS  PHI = -56.47 +/- 5.47 
ASSIGN  (resid  133   and name C ) (resid  134   and name N )
        (resid  134   and name CA) (resid  134   and name C )   1.00  -56.0 7.5  2 
 
!  136   A   TALOS  PHI = -93.49 +/- 31.71 
ASSIGN  (resid  135   and name C ) (resid  136   and name N )
        (resid  136   and name CA) (resid  136   and name C )   1.00  -93.0 48.0  2 
 
!  137   A   TALOS  PHI = -92.83 +/- 11.53 
ASSIGN  (resid  136   and name C ) (resid  137   and name N )
        (resid  137   and name CA) (resid  137   and name C )   1.00  -93.0 18.0  2 
 
!  138   L   TALOS  PHI = -122.94 +/- 23.46 
ASSIGN  (resid  137   and name C ) (resid  138   and name N )
        (resid  138   and name CA) (resid  138   and name C )   1.00  -123.0 34.5  2 
 
!  139   C   TALOS  PHI = -111.88 +/- 15.64 
ASSIGN  (resid  138   and name C ) (resid  139   and name N )
        (resid  139   and name CA) (resid  139   and name C )   1.00  -112.0 24.0  2 
 
!  140   L   TALOS  PHI = -111.31 +/- 12.2 
ASSIGN  (resid  139   and name C ) (resid  140   and name N )
        (resid  140   and name CA) (resid  140   and name C )   1.00  -111.0 18.0  2 
 
!  141   E   TALOS  PHI = -110.48 +/- 16.26 
ASSIGN  (resid  140   and name C ) (resid  141   and name N )
        (resid  141   and name CA) (resid  141   and name C )   1.00  -110.0 24.0  2 
 
!  142   V   TALOS  PHI = -117.42 +/- 8.92 
ASSIGN  (resid  141   and name C ) (resid  142   and name N )
        (resid  142   and name CA) (resid  142   and name C )   1.00  -117.0 13.5  2 
 
!  143   T   TALOS  PHI = -111.62 +/- 15.34 
ASSIGN  (resid  142   and name C ) (resid  143   and name N )
        (resid  143   and name CA) (resid  143   and name C )   1.00  -112.0 22.5  2 
 
!  144   L   TALOS  PHI = -99.97 +/- 14.96 
ASSIGN  (resid  143   and name C ) (resid  144   and name N )
        (resid  144   and name CA) (resid  144   and name C )   1.00  -100.0 22.5  2 
 
!  146   T   TALOS  PHI = -157.13 +/- 14.84 
ASSIGN  (resid  145   and name C ) (resid  146   and name N )
        (resid  146   and name CA) (resid  146   and name C )   1.00  -157.0 22.5  2 
 
!  147   A   TALOS  PHI = -131.74 +/- 23.88 
ASSIGN  (resid  146   and name C ) (resid  147   and name N )
        (resid  147   and name CA) (resid  147   and name C )   1.00  -132.0 36.0  2 
 
!  148   V   TALOS  PHI = -127.9 +/- 15.47 
ASSIGN  (resid  147   and name C ) (resid  148   and name N )
        (resid  148   and name CA) (resid  148   and name C )   1.00  -128.0 22.5  2 
 
!  149   D   TALOS  PHI = -83.55 +/- 14.64 
ASSIGN  (resid  148   and name C ) (resid  149   and name N )
        (resid  149   and name CA) (resid  149   and name C )   1.00  -84.0 22.5  2 
 
! using 1.5 times the talos error! 

!  5   P   TALOS  PSI = 144.66 +/- 14.33 
ASSIGN  (resid  5   and name N ) (resid  5   and name CA)
        (resid  5   and name C ) (resid  6   and name N )   1.00  145.0 21.0  2 
 
!  26   E   TALOS  PSI = 142.86 +/- 14.82 
ASSIGN  (resid  26   and name N ) (resid  26   and name CA)
        (resid  26   and name C ) (resid  27   and name N )   1.00  143.0 22.5  2 
 
!  28   A   TALOS  PSI = 138.87 +/- 33.26 
ASSIGN  (resid  28   and name N ) (resid  28   and name CA)
        (resid  28   and name C ) (resid  29   and name N )   1.00  139.0 49.5  2 
 
!  29   P   TALOS  PSI = 146.28 +/- 11.34 
ASSIGN  (resid  29   and name N ) (resid  29   and name CA)
        (resid  29   and name C ) (resid  30   and name N )   1.00  146.0 16.5  2 
 
!  32   A   TALOS  PSI = 144.78 +/- 20.63 
ASSIGN  (resid  32   and name N ) (resid  32   and name CA)
        (resid  32   and name C ) (resid  33   and name N )   1.00  145.0 31.5  2 
 
!  37   L   TALOS  PSI = 135.84 +/- 16.11 
ASSIGN  (resid  37   and name N ) (resid  37   and name CA)
        (resid  37   and name C ) (resid  38   and name N )   1.00  136.0 24.0  2 
 
!  38   D   TALOS  PSI = 120.75 +/- 32.52 
ASSIGN  (resid  38   and name N ) (resid  38   and name CA)
        (resid  38   and name C ) (resid  39   and name N )   1.00  121.0 49.5  2 
 
!  39   I   TALOS  PSI = -29.48 +/- 15.64 
ASSIGN  (resid  39   and name N ) (resid  39   and name CA)
        (resid  39   and name C ) (resid  40   and name N )   1.00  -29.0 24.0  2 
 
!  45   L   TALOS  PSI = 125.52 +/- 16.22 
ASSIGN  (resid  45   and name N ) (resid  45   and name CA)
        (resid  45   and name C ) (resid  46   and name N )   1.00  126.0 24.0  2 
 
!  46   R   TALOS  PSI = 137.84 +/- 11.89 
ASSIGN  (resid  46   and name N ) (resid  46   and name CA)
        (resid  46   and name C ) (resid  47   and name N )   1.00  138.0 18.0  2 
 
!  47   K   TALOS  PSI = 139.03 +/- 10.12 
ASSIGN  (resid  47   and name N ) (resid  47   and name CA)
        (resid  47   and name C ) (resid  48   and name N )   1.00  139.0 15.0  2 
 
!  48   K   TALOS  PSI = 120.07 +/- 24.77 
ASSIGN  (resid  48   and name N ) (resid  48   and name CA)
        (resid  48   and name C ) (resid  49   and name N )   1.00  120.0 37.5  2 
 
!  51   V   TALOS  PSI = 145.54 +/- 12.92 
ASSIGN  (resid  51   and name N ) (resid  51   and name CA)
        (resid  51   and name C ) (resid  52   and name N )   1.00  146.0 19.5  2 
 
!  58   S   TALOS  PSI = 155.1 +/- 17.94 
ASSIGN  (resid  58   and name N ) (resid  58   and name CA)
        (resid  58   and name C ) (resid  59   and name N )   1.00  155.0 27.0  2 
 
!  59   R   TALOS  PSI = 121.75 +/- 30.8 
ASSIGN  (resid  59   and name N ) (resid  59   and name CA)
        (resid  59   and name C ) (resid  60   and name N )   1.00  122.0 46.5  2 
 
!  61   V   TALOS  PSI = 158.25 +/- 18.49 
ASSIGN  (resid  61   and name N ) (resid  61   and name CA)
        (resid  61   and name C ) (resid  62   and name N )   1.00  158.0 27.0  2 
 
!  64   Q   TALOS  PSI = 145.62 +/- 23.46 
ASSIGN  (resid  64   and name N ) (resid  64   and name CA)
        (resid  64   and name C ) (resid  65   and name N )   1.00  146.0 34.5  2 
 
!  65   V   TALOS  PSI = 120.39 +/- 10.28 
ASSIGN  (resid  65   and name N ) (resid  65   and name CA)
        (resid  65   and name C ) (resid  66   and name N )   1.00  120.0 15.0  2 
 
!  66   V   TALOS  PSI = 158.33 +/- 18.76 
ASSIGN  (resid  66   and name N ) (resid  66   and name CA)
        (resid  66   and name C ) (resid  67   and name N )   1.00  158.0 28.5  2 
 
!  67   T   TALOS  PSI = 134.52 +/- 13.95 
ASSIGN  (resid  67   and name N ) (resid  67   and name CA)
        (resid  67   and name C ) (resid  68   and name N )   1.00  135.0 21.0  2 
 
!  68   V   TALOS  PSI = 152.51 +/- 9.68 
ASSIGN  (resid  68   and name N ) (resid  68   and name CA)
        (resid  68   and name C ) (resid  69   and name N )   1.00  153.0 15.0  2 
 
!  69   H   TALOS  PSI = 131.11 +/- 14.44 
ASSIGN  (resid  69   and name N ) (resid  69   and name CA)
        (resid  69   and name C ) (resid  70   and name N )   1.00  131.0 21.0  2 
 
!  70   L   TALOS  PSI = 130.42 +/- 8.07 
ASSIGN  (resid  70   and name N ) (resid  70   and name CA)
        (resid  70   and name C ) (resid  71   and name N )   1.00  130.0 12.0  2 
 
!  71   Q   TALOS  PSI = 128.74 +/- 8.94 
ASSIGN  (resid  71   and name N ) (resid  71   and name CA)
        (resid  71   and name C ) (resid  72   and name N )   1.00  129.0 13.5  2 
 
!  72   T   TALOS  PSI = 124.16 +/- 8.89 
ASSIGN  (resid  72   and name N ) (resid  72   and name CA)
        (resid  72   and name C ) (resid  73   and name N )   1.00  124.0 13.5  2 
 
!  73   S   TALOS  PSI = 149.7 +/- 14.46 
ASSIGN  (resid  73   and name N ) (resid  73   and name CA)
        (resid  73   and name C ) (resid  74   and name N )   1.00  150.0 21.0  2 
 
!  74   L   TALOS  PSI = 142.75 +/- 13.96 
ASSIGN  (resid  74   and name N ) (resid  74   and name CA)
        (resid  74   and name C ) (resid  75   and name N )   1.00  143.0 21.0  2 
 
!  75   E   TALOS  PSI = -19.02 +/- 8.53 
ASSIGN  (resid  75   and name N ) (resid  75   and name CA)
        (resid  75   and name C ) (resid  76   and name N )   1.00  -19.0 13.5  2 
 
!  76   N   TALOS  PSI = 1.6 +/- 11.29 
ASSIGN  (resid  76   and name N ) (resid  76   and name CA)
        (resid  76   and name C ) (resid  77   and name N )   1.00  2.0 16.5  2 
 
!  78   T   TALOS  PSI = 126.58 +/- 11.49 
ASSIGN  (resid  78   and name N ) (resid  78   and name CA)
        (resid  78   and name C ) (resid  79   and name N )   1.00  127.0 16.5  2 
 
!  80   V   TALOS  PSI = -26.44 +/- 11.43 
ASSIGN  (resid  80   and name N ) (resid  80   and name CA)
        (resid  80   and name C ) (resid  81   and name N )   1.00  -26.0 16.5  2 
 
!  81   Q   TALOS  PSI = 140.53 +/- 10.6 
ASSIGN  (resid  81   and name N ) (resid  81   and name CA)
        (resid  81   and name C ) (resid  82   and name N )   1.00  141.0 16.5  2 
 
!  82   E   TALOS  PSI = 129.74 +/- 15.4 
ASSIGN  (resid  82   and name N ) (resid  82   and name CA)
        (resid  82   and name C ) (resid  83   and name N )   1.00  130.0 22.5  2 
 
!  83   E   TALOS  PSI = 134.47 +/- 23.34 
ASSIGN  (resid  83   and name N ) (resid  83   and name CA)
        (resid  83   and name C ) (resid  84   and name N )   1.00  134.0 34.5  2 
 
!  87   V   TALOS  PSI = 126.49 +/- 7.88 
ASSIGN  (resid  87   and name N ) (resid  87   and name CA)
        (resid  87   and name C ) (resid  88   and name N )   1.00  126.0 12.0  2 
 
!  88   F   TALOS  PSI = 146.28 +/- 17.39 
ASSIGN  (resid  88   and name N ) (resid  88   and name CA)
        (resid  88   and name C ) (resid  89   and name N )   1.00  146.0 25.5  2 
 
!  89   T   TALOS  PSI = 126.73 +/- 14.16 
ASSIGN  (resid  89   and name N ) (resid  89   and name CA)
        (resid  89   and name C ) (resid  90   and name N )   1.00  127.0 21.0  2 
 
!  90   L   TALOS  PSI = 131.77 +/- 12.36 
ASSIGN  (resid  90   and name N ) (resid  90   and name CA)
        (resid  90   and name C ) (resid  91   and name N )   1.00  132.0 18.0  2 
 
!  94   D   TALOS  PSI = -18.93 +/- 16.86 
ASSIGN  (resid  94   and name N ) (resid  94   and name CA)
        (resid  94   and name C ) (resid  95   and name N )   1.00  -19.0 25.5  2 
 
!  98   A   TALOS  PSI = -32.88 +/- 10.64 
ASSIGN  (resid  98   and name N ) (resid  98   and name CA)
        (resid  98   and name C ) (resid  99   and name N )   1.00  -33.0 16.5  2 
 
!  99   L   TALOS  PSI = -32.75 +/- 16.48 
ASSIGN  (resid  99   and name N ) (resid  99   and name CA)
        (resid  99   and name C ) (resid  100   and name N )   1.00  -33.0 24.0  2 
 
!  100   D   TALOS  PSI = -34.29 +/- 9.9 
ASSIGN  (resid  100   and name N ) (resid  100   and name CA)
        (resid  100   and name C ) (resid  101   and name N )   1.00  -34.0 15.0  2 
 
!  101   L   TALOS  PSI = -24.71 +/- 11.58 
ASSIGN  (resid  101   and name N ) (resid  101   and name CA)
        (resid  101   and name C ) (resid  102   and name N )   1.00  -25.0 18.0  2 
 
!  103   V   TALOS  PSI = -45.32 +/- 5.62 
ASSIGN  (resid  103   and name N ) (resid  103   and name CA)
        (resid  103   and name C ) (resid  104   and name N )   1.00  -45.0 9.0  2 
 
!  104   P   TALOS  PSI = -18.86 +/- 9.98 
ASSIGN  (resid  104   and name N ) (resid  104   and name CA)
        (resid  104   and name C ) (resid  105   and name N )   1.00  -19.0 15.0  2 
 
!  107   D   TALOS  PSI = 151.39 +/- 18.24 
ASSIGN  (resid  107   and name N ) (resid  107   and name CA)
        (resid  107   and name C ) (resid  108   and name N )   1.00  151.0 27.0  2 
 
!  108   V   TALOS  PSI = 135.13 +/- 5.31 
ASSIGN  (resid  108   and name N ) (resid  108   and name CA)
        (resid  108   and name C ) (resid  109   and name N )   1.00  135.0 7.5  2 
 
!  110   E   TALOS  PSI = 142.5 +/- 16.15 
ASSIGN  (resid  110   and name N ) (resid  110   and name CA)
        (resid  110   and name C ) (resid  111   and name N )   1.00  143.0 24.0  2 
 
!  111   T   TALOS  PSI = 129.7 +/- 8.34 
ASSIGN  (resid  111   and name N ) (resid  111   and name CA)
        (resid  111   and name C ) (resid  112   and name N )   1.00  130.0 12.0  2 
 
!  112   A   TALOS  PSI = 137.74 +/- 16.56 
ASSIGN  (resid  112   and name N ) (resid  112   and name CA)
        (resid  112   and name C ) (resid  113   and name N )   1.00  138.0 25.5  2 
 
!  113   M   TALOS  PSI = 126.67 +/- 5.44 
ASSIGN  (resid  113   and name N ) (resid  113   and name CA)
        (resid  113   and name C ) (resid  114   and name N )   1.00  127.0 7.5  2 
 
!  114   V   TALOS  PSI = 128.12 +/- 9.15 
ASSIGN  (resid  114   and name N ) (resid  114   and name CA)
        (resid  114   and name C ) (resid  115   and name N )   1.00  128.0 13.5  2 
 
!  115   T   TALOS  PSI = 129.27 +/- 9.22 
ASSIGN  (resid  115   and name N ) (resid  115   and name CA)
        (resid  115   and name C ) (resid  116   and name N )   1.00  129.0 13.5  2 
 
!  116   A   TALOS  PSI = 147.88 +/- 17.41 
ASSIGN  (resid  116   and name N ) (resid  116   and name CA)
        (resid  116   and name C ) (resid  117   and name N )   1.00  148.0 25.5  2 
 
!  117   D   TALOS  PSI = 138.6 +/- 20.4 
ASSIGN  (resid  117   and name N ) (resid  117   and name CA)
        (resid  117   and name C ) (resid  118   and name N )   1.00  139.0 30.0  2 
 
!  118   S   TALOS  PSI = -40.87 +/- 9.93 
ASSIGN  (resid  118   and name N ) (resid  118   and name CA)
        (resid  118   and name C ) (resid  119   and name N )   1.00  -41.0 15.0  2 
 
!  119   K   TALOS  PSI = -32.89 +/- 7.83 
ASSIGN  (resid  119   and name N ) (resid  119   and name CA)
        (resid  119   and name C ) (resid  120   and name N )   1.00  -33.0 12.0  2 
 
!  125   Q   TALOS  PSI = -17.35 +/- 23.28 
ASSIGN  (resid  125   and name N ) (resid  125   and name CA)
        (resid  125   and name C ) (resid  126   and name N )   1.00  -17.0 34.5  2 
 
!  127   S   TALOS  PSI = 142.69 +/- 15.17 
ASSIGN  (resid  127   and name N ) (resid  127   and name CA)
        (resid  127   and name C ) (resid  128   and name N )   1.00  143.0 22.5  2 
 
!  130   P   TALOS  PSI = 147.2 +/- 11.29 
ASSIGN  (resid  130   and name N ) (resid  130   and name CA)
        (resid  130   and name C ) (resid  131   and name N )   1.00  147.0 16.5  2 
 
!  131   Y   TALOS  PSI = 122.6 +/- 16.52 
ASSIGN  (resid  131   and name N ) (resid  131   and name CA)
        (resid  131   and name C ) (resid  132   and name N )   1.00  123.0 25.5  2 
 
!  132   I   TALOS  PSI = 138.74 +/- 21.73 
ASSIGN  (resid  132   and name N ) (resid  132   and name CA)
        (resid  132   and name C ) (resid  133   and name N )   1.00  139.0 33.0  2 
 
!  134   P   TALOS  PSI = 142.39 +/- 10.2 
ASSIGN  (resid  134   and name N ) (resid  134   and name CA)
        (resid  134   and name C ) (resid  135   and name N )   1.00  142.0 15.0  2 
 
!  136   A   TALOS  PSI = 138.35 +/- 15.02 
ASSIGN  (resid  136   and name N ) (resid  136   and name CA)
        (resid  136   and name C ) (resid  137   and name N )   1.00  138.0 22.5  2 
 
!  137   A   TALOS  PSI = 131.83 +/- 11.66 
ASSIGN  (resid  137   and name N ) (resid  137   and name CA)
        (resid  137   and name C ) (resid  138   and name N )   1.00  132.0 18.0  2 
 
!  138   L   TALOS  PSI = 151.34 +/- 11.61 
ASSIGN  (resid  138   and name N ) (resid  138   and name CA)
        (resid  138   and name C ) (resid  139   and name N )   1.00  151.0 18.0  2 
 
!  139   C   TALOS  PSI = 123.01 +/- 14.48 
ASSIGN  (resid  139   and name N ) (resid  139   and name CA)
        (resid  139   and name C ) (resid  140   and name N )   1.00  123.0 21.0  2 
 
!  140   L   TALOS  PSI = 121.56 +/- 8.29 
ASSIGN  (resid  140   and name N ) (resid  140   and name CA)
        (resid  140   and name C ) (resid  141   and name N )   1.00  122.0 12.0  2 
 
!  141   E   TALOS  PSI = 122.97 +/- 8.67 
ASSIGN  (resid  141   and name N ) (resid  141   and name CA)
        (resid  141   and name C ) (resid  142   and name N )   1.00  123.0 13.5  2 
 
!  142   V   TALOS  PSI = 129.46 +/- 11.26 
ASSIGN  (resid  142   and name N ) (resid  142   and name CA)
        (resid  142   and name C ) (resid  143   and name N )   1.00  129.0 16.5  2 
 
!  143   T   TALOS  PSI = 123.9 +/- 10.47 
ASSIGN  (resid  143   and name N ) (resid  143   and name CA)
        (resid  143   and name C ) (resid  144   and name N )   1.00  124.0 15.0  2 
 
!  144   L   TALOS  PSI = 115.53 +/- 14.8 
ASSIGN  (resid  144   and name N ) (resid  144   and name CA)
        (resid  144   and name C ) (resid  145   and name N )   1.00  116.0 22.5  2 
 
!  146   T   TALOS  PSI = 158.48 +/- 14.42 
ASSIGN  (resid  146   and name N ) (resid  146   and name CA)
        (resid  146   and name C ) (resid  147   and name N )   1.00  158.0 21.0  2 
 
!  147   A   TALOS  PSI = 145.42 +/- 9.66 
ASSIGN  (resid  147   and name N ) (resid  147   and name CA)
        (resid  147   and name C ) (resid  148   and name N )   1.00  145.0 15.0  2 
 
!  148   V   TALOS  PSI = 144.4 +/- 22.29 
ASSIGN  (resid  148   and name N ) (resid  148   and name CA)
        (resid  148   and name C ) (resid  149   and name N )   1.00  144.0 33.0  2 
 
!  149   D   TALOS  PSI = 134.5 +/- 11.45 
ASSIGN  (resid  149   and name N ) (resid  149   and name CA)
        (resid  149   and name C ) (resid  150   and name N )   1.00  135.0 16.5  2 
 
! Hydrogen bonds :
assign ( residue  100 and name HN  ) ( residue   96  and name O )  1.80  0.00  0.50
assign ( residue  100 and name N  )  ( residue   96  and name O )  2.80  0.00  0.50

assign ( residue  101 and name HN  ) ( residue   97  and name O )  1.80  0.00  0.50
assign ( residue  101 and name N  )  ( residue   97  and name O )  2.80  0.00  0.50

assign ( residue  102 and name HN  ) ( residue   98  and name O )  1.80  0.00  0.50
assign ( residue  102 and name N  )  ( residue   98  and name O )  2.80  0.00  0.50

assign ( residue  103 and name HN  ) ( residue   99  and name O )  1.80  0.00  0.50
assign ( residue  103 and name N  )  ( residue   99  and name O )  2.80  0.00  0.50

assign ( residue  105 and name HN  ) ( residue  101  and name O )  1.80  0.00  0.50
assign ( residue  105 and name N  )  ( residue  101  and name O )  2.80  0.00  0.50

assign ( residue  106 and name HN  ) ( residue  102  and name O )  1.80  0.00  0.50
assign ( residue  106 and name N  )  ( residue  102  and name O )  2.80  0.00  0.50

assign ( residue  111 and name HN  ) ( residue   51  and name O )  1.80  0.00  0.50
assign ( residue  111 and name N  )  ( residue   51  and name O )  2.80  0.00  0.50

assign ( residue   51 and name HN  ) ( residue  111  and name O )  1.80  0.00  0.50
assign ( residue   51 and name N  )  ( residue  111  and name O )  2.80  0.00  0.50

assign ( residue  113 and name HN  ) ( residue   48  and name O )  1.80  0.00  0.50
assign ( residue  113 and name N  )  ( residue   48  and name O )  2.80  0.00  0.50

assign ( residue   48 and name HN  ) ( residue  113  and name O )  1.80  0.00  0.50
assign ( residue   48 and name N  )  ( residue  113  and name O )  2.80  0.00  0.50

assign ( residue   46 and name HN  ) ( residue  115  and name O )  1.80  0.00  0.50
assign ( residue   46 and name N  )  ( residue  115  and name O )  2.80  0.00  0.50

assign ( residue  115 and name HN  ) ( residue   46  and name O )  1.80  0.00  0.50
assign ( residue  115 and name N  )  ( residue   46  and name O )  2.80  0.00  0.50

assign ( residue   47 and name HN  ) ( residue   37  and name O )  1.80  0.00  0.50
assign ( residue   47 and name N  )  ( residue   37  and name O )  2.80  0.00  0.50

assign ( residue  112 and name HN  ) ( residue  142  and name O )  1.80  0.00  0.50
assign ( residue  112 and name N  )  ( residue  142  and name O )  2.80  0.00  0.50

assign ( residue  142 and name HN  ) ( residue  112  and name O )  1.80  0.00  0.50
assign ( residue  142 and name N  )  ( residue  112  and name O )  2.80  0.00  0.50

assign ( residue  110 and name HN  ) ( residue  107  and name O )  1.80  0.00  0.50
assign ( residue  110 and name N  )  ( residue  107  and name O )  2.80  0.00  0.50

assign ( residue  144 and name HN  ) ( residue  110  and name O )  1.80  0.00  0.50
assign ( residue  144 and name N  )  ( residue  110  and name O )  2.80  0.00  0.50

assign ( residue  114 and name HN  ) ( residue  140  and name O )  1.80  0.00  0.50
assign ( residue  114 and name N  )  ( residue  140  and name O )  2.80  0.00  0.50

assign ( residue  140 and name HN  ) ( residue  114  and name O )  1.80  0.00  0.50
assign ( residue  140 and name N  )  ( residue  114  and name O )  2.80  0.00  0.50

assign ( residue  116 and name HN  ) ( residue  138  and name O )  1.80  0.00  0.50
assign ( residue  116 and name N  )  ( residue  138  and name O )  2.80  0.00  0.50

assign ( residue  138 and name HN  ) ( residue  116  and name O )  1.80  0.00  0.50
assign ( residue  138 and name N  )  ( residue  116  and name O )  2.80  0.00  0.50

assign ( residue  139 and name HN  ) ( residue   73  and name O )  1.80  0.00  0.50
assign ( residue  139 and name N  )  ( residue   73  and name O )  2.80  0.00  0.50

assign ( residue  141 and name HN  ) ( residue   71  and name O )  1.80  0.00  0.50
assign ( residue  141 and name N  )  ( residue   71  and name O )  2.80  0.00  0.50

assign ( residue   71 and name HN  ) ( residue  141  and name O )  1.80  0.00  0.50
assign ( residue   71 and name N  )  ( residue  141  and name O )  2.80  0.00  0.50

assign ( residue  143 and name HN  ) ( residue   69  and name O )  1.80  0.00  0.50
assign ( residue  143 and name N  )  ( residue   69  and name O )  2.80  0.00  0.50

assign ( residue   69 and name HN  ) ( residue  143  and name O )  1.80  0.00  0.50
assign ( residue   69 and name N  )  ( residue  143  and name O )  2.80  0.00  0.50

assign ( residue  145 and name HN  ) ( residue   67  and name O )  1.80  0.00  0.50
assign ( residue  145 and name N  )  ( residue   67  and name O )  2.80  0.00  0.50

assign ( residue   67 and name HN  ) ( residue  146  and name O )  1.80  0.00  0.50
assign ( residue   67 and name N  )  ( residue  146  and name O )  2.80  0.00  0.50

assign ( residue   65 and name HN  ) ( residue  148  and name O )  1.80  0.00  0.50
assign ( residue   65 and name N  )  ( residue  148  and name O )  2.80  0.00  0.50

assign ( residue   70 and name HN  ) ( residue   83  and name O )  1.80  0.00  0.50
assign ( residue   70 and name N  )  ( residue   83  and name O )  2.80  0.00  0.50

assign ( residue  117 and name HN  ) ( residue   44  and name O )  1.80  0.00  0.50
assign ( residue  117 and name N  )  ( residue   44  and name O )  2.80  0.00  0.50

assign ( residue   66 and name HN  ) ( residue   88  and name O )  1.80  0.00  0.50
assign ( residue   66 and name N  )  ( residue   88  and name O )  2.80  0.00  0.50

assign ( residue   88 and name HN  ) ( residue   66  and name O )  1.80  0.00  0.50
assign ( residue   88 and name N  )  ( residue   66  and name O )  2.80  0.00  0.50

assign ( residue   68 and name HN  ) ( residue   86  and name O )  1.80  0.00  0.50
assign ( residue   68 and name N  )  ( residue   86  and name O )  2.80  0.00  0.50

assign ( residue   86 and name HN  ) ( residue   68  and name O )  1.80  0.00  0.50
assign ( residue   86 and name N  )  ( residue   68  and name O )  2.80  0.00  0.50

assign ( residue  109 and name HN  ) ( residue  144  and name O )  1.80  0.00  0.50
assign ( residue  109 and name N  )  ( residue  144  and name O )  2.80  0.00  0.50

assign ( residue   64 and name HN  ) ( residue   61  and name O )  1.80  0.00  0.50
assign ( residue   64 and name N  )  ( residue   61  and name O )  2.80  0.00  0.50

assign ( residue   90 and name HN  ) ( residue   64  and name O )  1.80  0.00  0.50
assign ( residue   90 and name N  )  ( residue   64  and name O )  2.80  0.00  0.50

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           HT1      MET   1 -50.097  10.941  16.415
    2    H2   MET   1           HT2      MET   1 -51.488  11.456  15.599
    3    H3   MET   1           HT3      MET   1 -50.052  12.348  15.472
    4    HA   MET   1           HA       MET   1 -50.550   9.623  14.422
    5    HB2  MET   1           HB2      MET   1 -49.869  12.185  12.967
    6    HB3  MET   1           HB1      MET   1 -50.235  10.633  12.232
    7    HG2  MET   1           HG2      MET   1 -52.141  12.328  13.825
    8    HG3  MET   1           HG1      MET   1 -52.107  12.172  12.072
    9    HE1  MET   1           HE1      MET   1 -55.397  10.309  13.091
   10    HE2  MET   1           HE2      MET   1 -54.698  11.644  12.174
   11    HE3  MET   1           HE3      MET   1 -54.709  11.695  13.938
   12    H    GLY   2           HN       GLY   2 -48.785   8.482  13.705
   13    HA2  GLY   2           HA2      GLY   2 -46.218   9.454  14.731
   14    HA3  GLY   2           HA1      GLY   2 -46.600   7.797  14.286
   15    H    GLN   3           HN       GLN   3 -46.383   7.138  12.165
   16    HA   GLN   3           HA       GLN   3 -44.719   8.940  10.538
   17    HB2  GLN   3           HB2      GLN   3 -44.938   5.924  10.489
   18    HB3  GLN   3           HB1      GLN   3 -43.875   6.883   9.469
   19    HG2  GLN   3           HG2      GLN   3 -42.645   7.640  11.407
   20    HG3  GLN   3           HG1      GLN   3 -43.750   6.777  12.470
   21   HE21  GLN   3          HE21      GLN   3 -42.610   5.519   9.413
   22   HE22  GLN   3          HE22      GLN   3 -41.661   4.237  10.080
   23    HA   PRO   4           HA       PRO   4 -47.774   9.076   7.311
   24    HB2  PRO   4           HB2      PRO   4 -45.539   8.943   5.383
   25    HB3  PRO   4           HB1      PRO   4 -46.737  10.218   5.628
   26    HG2  PRO   4           HG2      PRO   4 -44.181  10.537   6.366
   27    HG3  PRO   4           HG1      PRO   4 -45.519  11.229   7.303
   28    HD2  PRO   4           HD2      PRO   4 -43.895   8.771   7.843
   29    HD3  PRO   4           HD1      PRO   4 -44.476  10.009   8.978
   30    HA   PRO   5           HA       PRO   5 -48.090   4.733   6.365
   31    HB2  PRO   5           HB2      PRO   5 -50.423   5.474   4.741
   32    HB3  PRO   5           HB1      PRO   5 -50.342   4.491   6.206
   33    HG2  PRO   5           HG2      PRO   5 -51.432   6.959   6.189
   34    HG3  PRO   5           HG1      PRO   5 -50.578   6.307   7.600
   35    HD2  PRO   5           HD2      PRO   5 -49.611   8.239   5.525
   36    HD3  PRO   5           HD1      PRO   5 -49.366   8.261   7.284
   37    H    ALA   6           HN       ALA   6 -46.867   3.754   4.915
   38    HA   ALA   6           HA       ALA   6 -47.192   4.440   2.072
   39    HB1  ALA   6           HB1      ALA   6 -45.139   5.501   2.874
   40    HB2  ALA   6           HB2      ALA   6 -44.765   4.195   1.749
   41    HB3  ALA   6           HB3      ALA   6 -44.564   3.950   3.483
   42    H    GLU   7           HN       GLU   7 -48.048   2.253   4.027
   43    HA   GLU   7           HA       GLU   7 -46.821  -0.046   2.672
   44    HB2  GLU   7           HB2      GLU   7 -46.513   0.163   5.157
   45    HB3  GLU   7           HB1      GLU   7 -48.254  -0.019   5.333
   46    HG2  GLU   7           HG2      GLU   7 -48.213  -2.236   4.605
   47    HG3  GLU   7           HG1      GLU   7 -46.597  -2.073   3.916
   48    H    GLU   8           HN       GLU   8 -48.051  -1.058   1.255
   49    HA   GLU   8           HA       GLU   8 -50.984  -0.795   1.462
   50    HB2  GLU   8           HB2      GLU   8 -49.455   0.138  -0.564
   51    HB3  GLU   8           HB1      GLU   8 -49.728  -1.496  -1.140
   52    HG2  GLU   8           HG2      GLU   8 -51.970   0.324  -0.315
   53    HG3  GLU   8           HG1      GLU   8 -51.321   0.296  -1.950
   54    H    ALA   9           HN       ALA   9 -52.208  -2.625   0.655
   55    HA   ALA   9           HA       ALA   9 -52.800  -4.806   0.573
   56    HB1  ALA   9           HB1      ALA   9 -51.208  -6.491  -0.147
   57    HB2  ALA   9           HB2      ALA   9 -49.868  -5.390   0.163
   58    HB3  ALA   9           HB3      ALA   9 -51.022  -5.031  -1.120
   59    H    GLU  10           HN       GLU  10 -51.917  -7.100   1.628
   60    HA   GLU  10           HA       GLU  10 -51.275  -6.450   4.426
   61    HB2  GLU  10           HB2      GLU  10 -53.702  -6.915   4.132
   62    HB3  GLU  10           HB1      GLU  10 -53.296  -8.506   3.506
   63    HG2  GLU  10           HG2      GLU  10 -52.106  -8.898   5.715
   64    HG3  GLU  10           HG1      GLU  10 -52.941  -7.453   6.286
   65    H    GLN  11           HN       GLN  11 -51.945  -9.505   2.737
   66    HA   GLN  11           HA       GLN  11 -49.166 -10.331   3.259
   67    HB2  GLN  11           HB2      GLN  11 -51.553 -12.157   3.551
   68    HB3  GLN  11           HB1      GLN  11 -49.880 -12.521   3.936
   69    HG2  GLN  11           HG2      GLN  11 -49.965 -10.822   5.732
   70    HG3  GLN  11           HG1      GLN  11 -51.679 -10.590   5.380
   71   HE21  GLN  11          HE21      GLN  11 -52.473 -11.299   7.286
   72   HE22  GLN  11          HE22      GLN  11 -52.337 -12.934   7.838
   73    HA   PRO  12           HA       PRO  12 -49.697 -11.388  -1.094
   74    HB2  PRO  12           HB2      PRO  12 -46.839 -11.548  -1.277
   75    HB3  PRO  12           HB1      PRO  12 -47.896 -10.270  -1.877
   76    HG2  PRO  12           HG2      PRO  12 -46.084  -9.955   0.172
   77    HG3  PRO  12           HG1      PRO  12 -47.518  -8.941  -0.068
   78    HD2  PRO  12           HD2      PRO  12 -47.118 -11.250   1.799
   79    HD3  PRO  12           HD1      PRO  12 -47.961  -9.708   2.077
   80    H    GLY  13           HN       GLY  13 -49.205 -13.260   1.392
   81    HA2  GLY  13           HA2      GLY  13 -49.585 -15.661   0.907
   82    HA3  GLY  13           HA1      GLY  13 -48.226 -15.542  -0.203
   83    H    ALA  14           HN       ALA  14 -46.214 -14.514   0.982
   84    HA   ALA  14           HA       ALA  14 -45.751 -16.250   3.291
   85    HB1  ALA  14           HB1      ALA  14 -44.195 -16.453   1.406
   86    HB2  ALA  14           HB2      ALA  14 -43.374 -15.884   2.861
   87    HB3  ALA  14           HB3      ALA  14 -43.773 -14.749   1.573
   88    H    LEU  15           HN       LEU  15 -44.186 -15.332   4.944
   89    HA   LEU  15           HA       LEU  15 -44.698 -12.477   5.437
   90    HB2  LEU  15           HB2      LEU  15 -46.279 -13.730   6.786
   91    HB3  LEU  15           HB1      LEU  15 -44.989 -14.729   7.423
   92    HG   LEU  15           HG       LEU  15 -44.017 -12.697   8.493
   93   HD11  LEU  15          HD11      LEU  15 -45.439 -10.721   8.728
   94   HD12  LEU  15          HD12      LEU  15 -46.610 -11.432   7.619
   95   HD13  LEU  15          HD13      LEU  15 -44.998 -11.005   7.044
   96   HD21  LEU  15          HD21      LEU  15 -45.630 -12.611  10.305
   97   HD22  LEU  15          HD22      LEU  15 -45.419 -14.269   9.738
   98   HD23  LEU  15          HD23      LEU  15 -46.852 -13.350   9.273
   99    H    ALA  16           HN       ALA  16 -42.820 -15.331   6.352
  100    HA   ALA  16           HA       ALA  16 -40.681 -15.656   7.000
  101    HB1  ALA  16           HB1      ALA  16 -40.114 -14.417   4.954
  102    HB2  ALA  16           HB2      ALA  16 -38.944 -14.118   6.244
  103    HB3  ALA  16           HB3      ALA  16 -40.167 -12.905   5.861
  104    H    ARG  17           HN       ARG  17 -40.844 -15.788   9.164
  105    HA   ARG  17           HA       ARG  17 -41.148 -13.444  10.819
  106    HB2  ARG  17           HB2      ARG  17 -40.705 -16.346  11.559
  107    HB3  ARG  17           HB1      ARG  17 -41.074 -15.059  12.697
  108    HG2  ARG  17           HG2      ARG  17 -43.238 -14.724  11.618
  109    HG3  ARG  17           HG1      ARG  17 -42.862 -16.020  10.476
  110    HD2  ARG  17           HD2      ARG  17 -44.263 -16.869  12.256
  111    HD3  ARG  17           HD1      ARG  17 -42.656 -17.590  12.368
  112    HE   ARG  17           HE       ARG  17 -43.001 -15.231  13.994
  113   HH11  ARG  17          HH11      ARG  17 -43.394 -18.719  13.880
  114   HH12  ARG  17          HH12      ARG  17 -43.315 -18.899  15.601
  115   HH21  ARG  17          HH21      ARG  17 -42.921 -15.475  16.238
  116   HH22  ARG  17          HH22      ARG  17 -43.075 -17.057  16.954
  117    H    GLU  18           HN       GLU  18 -39.683 -13.521  12.903
  118    HA   GLU  18           HA       GLU  18 -36.982 -13.012  12.120
  119    HB2  GLU  18           HB2      GLU  18 -36.655 -12.665  14.605
  120    HB3  GLU  18           HB1      GLU  18 -37.890 -11.660  13.861
  121    HG2  GLU  18           HG2      GLU  18 -39.634 -13.067  14.730
  122    HG3  GLU  18           HG1      GLU  18 -38.447 -14.206  15.365
  123    H    PHE  19           HN       PHE  19 -36.988 -15.341  11.229
  124    HA   PHE  19           HA       PHE  19 -36.656 -17.457  13.145
  125    HB2  PHE  19           HB2      PHE  19 -37.757 -17.747  10.928
  126    HB3  PHE  19           HB1      PHE  19 -36.199 -17.497  10.157
  127    HD1  PHE  19           HD1      PHE  19 -37.479 -19.572  12.989
  128    HD2  PHE  19           HD2      PHE  19 -35.268 -19.416   9.355
  129    HE1  PHE  19           HE1      PHE  19 -37.033 -21.983  13.164
  130    HE2  PHE  19           HE2      PHE  19 -34.819 -21.832   9.522
  131    HZ   PHE  19           HZ       PHE  19 -35.703 -23.116  11.429
  132    H    LEU  20           HN       LEU  20 -34.502 -16.219  10.552
  133    HA   LEU  20           HA       LEU  20 -32.237 -17.131  12.199
  134    HB2  LEU  20           HB2      LEU  20 -32.441 -16.852   9.203
  135    HB3  LEU  20           HB1      LEU  20 -30.961 -17.237  10.059
  136    HG   LEU  20           HG       LEU  20 -33.457 -18.941  10.025
  137   HD11  LEU  20          HD11      LEU  20 -30.794 -19.313   8.661
  138   HD12  LEU  20          HD12      LEU  20 -32.323 -18.934   7.871
  139   HD13  LEU  20          HD13      LEU  20 -32.112 -20.483   8.684
  140   HD21  LEU  20          HD21      LEU  20 -30.730 -19.478  11.199
  141   HD22  LEU  20          HD22      LEU  20 -32.083 -20.609  11.149
  142   HD23  LEU  20          HD23      LEU  20 -32.200 -19.137  12.115
  143    H    ALA  21           HN       ALA  21 -31.323 -15.514  13.209
  144    HA   ALA  21           HA       ALA  21 -30.747 -13.052  11.711
  145    HB1  ALA  21           HB1      ALA  21 -32.642 -12.671  13.262
  146    HB2  ALA  21           HB2      ALA  21 -31.223 -11.702  13.664
  147    HB3  ALA  21           HB3      ALA  21 -31.602 -13.144  14.607
  148    H    ALA  22           HN       ALA  22 -28.656 -12.968  11.471
  149    HA   ALA  22           HA       ALA  22 -26.925 -13.102  13.807
  150    HB1  ALA  22           HB1      ALA  22 -25.305 -14.576  12.731
  151    HB2  ALA  22           HB2      ALA  22 -26.354 -14.728  11.320
  152    HB3  ALA  22           HB3      ALA  22 -26.866 -15.384  12.873
  153    H    MET  23           HN       MET  23 -27.916 -10.961  12.278
  154    HA   MET  23           HA       MET  23 -25.523 -10.069  10.791
  155    HB2  MET  23           HB2      MET  23 -27.511 -10.641   9.350
  156    HB3  MET  23           HB1      MET  23 -28.399  -9.357  10.153
  157    HG2  MET  23           HG2      MET  23 -26.848  -7.707   9.311
  158    HG3  MET  23           HG1      MET  23 -25.868  -8.975   8.578
  159    HE1  MET  23           HE1      MET  23 -30.185  -8.065   7.203
  160    HE2  MET  23           HE2      MET  23 -29.394  -7.184   8.510
  161    HE3  MET  23           HE3      MET  23 -29.785  -8.891   8.710
  162    H    GLU  24           HN       GLU  24 -26.703  -9.773  13.584
  163    HA   GLU  24           HA       GLU  24 -27.612  -7.135  13.953
  164    HB2  GLU  24           HB2      GLU  24 -26.311  -9.040  15.913
  165    HB3  GLU  24           HB1      GLU  24 -27.114  -7.542  16.359
  166    HG2  GLU  24           HG2      GLU  24 -28.611  -9.347  16.775
  167    HG3  GLU  24           HG1      GLU  24 -29.216  -8.446  15.389
  168    HA   PRO  25           HA       PRO  25 -23.567  -5.315  13.451
  169    HB2  PRO  25           HB2      PRO  25 -24.754  -2.773  13.071
  170    HB3  PRO  25           HB1      PRO  25 -24.233  -3.901  11.819
  171    HG2  PRO  25           HG2      PRO  25 -26.873  -3.154  12.364
  172    HG3  PRO  25           HG1      PRO  25 -26.365  -4.540  11.386
  173    HD2  PRO  25           HD2      PRO  25 -27.271  -4.451  14.225
  174    HD3  PRO  25           HD1      PRO  25 -27.517  -5.711  12.996
  175    H    GLU  26           HN       GLU  26 -22.888  -5.496  15.628
  176    HA   GLU  26           HA       GLU  26 -23.677  -3.292  17.390
  177    HB2  GLU  26           HB2      GLU  26 -22.182  -5.856  17.981
  178    HB3  GLU  26           HB1      GLU  26 -22.490  -4.597  19.168
  179    HG2  GLU  26           HG2      GLU  26 -24.924  -4.905  18.790
  180    HG3  GLU  26           HG1      GLU  26 -24.542  -6.258  17.730
  181    HA   PRO  27           HA       PRO  27 -20.018  -0.968  16.710
  182    HB2  PRO  27           HB2      PRO  27 -19.517  -0.134  19.298
  183    HB3  PRO  27           HB1      PRO  27 -20.652   0.638  18.190
  184    HG2  PRO  27           HG2      PRO  27 -21.174  -1.311  20.387
  185    HG3  PRO  27           HG1      PRO  27 -22.123   0.104  19.894
  186    HD2  PRO  27           HD2      PRO  27 -22.877  -2.385  19.237
  187    HD3  PRO  27           HD1      PRO  27 -23.114  -1.020  18.127
  188    H    ALA  28           HN       ALA  28 -18.134  -1.864  16.284
  189    HA   ALA  28           HA       ALA  28 -16.872  -3.615  18.279
  190    HB1  ALA  28           HB1      ALA  28 -16.355  -3.404  15.311
  191    HB2  ALA  28           HB2      ALA  28 -17.286  -4.670  16.112
  192    HB3  ALA  28           HB3      ALA  28 -15.554  -4.514  16.423
  193    HA   PRO  29           HA       PRO  29 -13.730  -0.581  19.008
  194    HB2  PRO  29           HB2      PRO  29 -11.669  -2.292  19.601
  195    HB3  PRO  29           HB1      PRO  29 -12.933  -1.834  20.746
  196    HG2  PRO  29           HG2      PRO  29 -12.667  -4.307  19.092
  197    HG3  PRO  29           HG1      PRO  29 -13.235  -4.129  20.764
  198    HD2  PRO  29           HD2      PRO  29 -14.928  -4.474  18.695
  199    HD3  PRO  29           HD1      PRO  29 -15.347  -3.489  20.109
  200    H    ALA  30           HN       ALA  30 -11.782   0.197  18.177
  201    HA   ALA  30           HA       ALA  30 -10.338   0.773  16.546
  202    HB1  ALA  30           HB1      ALA  30 -10.269  -2.164  15.874
  203    HB2  ALA  30           HB2      ALA  30  -9.308  -1.383  17.130
  204    HB3  ALA  30           HB3      ALA  30  -9.067  -0.950  15.438
  205    HA   PRO  31           HA       PRO  31 -13.568   0.913  13.241
  206    HB2  PRO  31           HB2      PRO  31 -13.295   3.614  12.891
  207    HB3  PRO  31           HB1      PRO  31 -14.441   2.883  14.019
  208    HG2  PRO  31           HG2      PRO  31 -11.736   4.051  14.554
  209    HG3  PRO  31           HG1      PRO  31 -13.232   4.211  15.494
  210    HD2  PRO  31           HD2      PRO  31 -11.260   2.517  16.213
  211    HD3  PRO  31           HD1      PRO  31 -12.971   2.149  16.496
  212    H    ALA  32           HN       ALA  32 -12.212  -0.195  11.838
  213    HA   ALA  32           HA       ALA  32 -10.180   1.426  10.455
  214    HB1  ALA  32           HB1      ALA  32  -9.317  -0.625  11.494
  215    HB2  ALA  32           HB2      ALA  32  -9.167  -0.663   9.738
  216    HB3  ALA  32           HB3      ALA  32 -10.448  -1.579  10.532
  217    HA   PRO  33           HA       PRO  33 -13.017   1.495   7.028
  218    HB2  PRO  33           HB2      PRO  33 -11.255   2.355   5.131
  219    HB3  PRO  33           HB1      PRO  33 -11.992   3.421   6.332
  220    HG2  PRO  33           HG2      PRO  33  -9.283   2.159   6.322
  221    HG3  PRO  33           HG1      PRO  33  -9.747   3.804   6.787
  222    HD2  PRO  33           HD2      PRO  33  -9.257   1.871   8.611
  223    HD3  PRO  33           HD1      PRO  33 -10.462   3.147   8.884
  224    H    GLU  34           HN       GLU  34 -10.097  -0.320   7.161
  225    HA   GLU  34           HA       GLU  34  -9.444  -2.305   6.319
  226    HB2  GLU  34           HB2      GLU  34 -11.715  -3.099   6.696
  227    HB3  GLU  34           HB1      GLU  34 -12.221  -2.453   5.140
  228    HG2  GLU  34           HG2      GLU  34 -10.874  -4.033   3.963
  229    HG3  GLU  34           HG1      GLU  34 -10.101  -4.557   5.459
  230    H    GLU  35           HN       GLU  35 -11.384  -0.673   3.806
  231    HA   GLU  35           HA       GLU  35  -9.300  -1.258   1.851
  232    HB2  GLU  35           HB2      GLU  35 -11.914   0.219   1.480
  233    HB3  GLU  35           HB1      GLU  35 -10.858  -0.379   0.206
  234    HG2  GLU  35           HG2      GLU  35 -11.292  -2.679   0.941
  235    HG3  GLU  35           HG1      GLU  35 -12.368  -2.062   2.192
  236    H    TRP  36           HN       TRP  36  -7.593   0.078   1.903
  237    HA   TRP  36           HA       TRP  36  -7.975   2.841   2.776
  238    HB2  TRP  36           HB2      TRP  36  -5.286   1.720   2.098
  239    HB3  TRP  36           HB1      TRP  36  -5.720   2.900   3.325
  240    HD1  TRP  36           HD1      TRP  36  -7.763   1.269   5.068
  241    HE1  TRP  36           HE1      TRP  36  -6.965  -0.775   6.421
  242    HE3  TRP  36           HE3      TRP  36  -3.464   0.197   2.495
  243    HZ2  TRP  36           HZ2      TRP  36  -4.783  -2.583   6.398
  244    HZ3  TRP  36           HZ3      TRP  36  -2.108  -1.689   3.223
  245    HH2  TRP  36           HH2      TRP  36  -2.746  -3.065   5.115
  246    H    LEU  37           HN       LEU  37  -5.797   4.015   1.589
  247    HA   LEU  37           HA       LEU  37  -6.784   4.726  -0.974
  248    HB2  LEU  37           HB2      LEU  37  -5.586   6.293   0.453
  249    HB3  LEU  37           HB1      LEU  37  -4.154   5.294   0.400
  250    HG   LEU  37           HG       LEU  37  -4.023   5.723  -2.063
  251   HD11  LEU  37          HD11      LEU  37  -6.197   7.711  -1.426
  252   HD12  LEU  37          HD12      LEU  37  -6.333   6.311  -2.489
  253   HD13  LEU  37          HD13      LEU  37  -5.281   7.655  -2.932
  254   HD21  LEU  37          HD21      LEU  37  -3.947   8.133  -0.257
  255   HD22  LEU  37          HD22      LEU  37  -3.140   7.989  -1.817
  256   HD23  LEU  37          HD23      LEU  37  -2.651   6.956  -0.474
  257    H    ASP  38           HN       ASP  38  -6.688   3.218  -2.595
  258    HA   ASP  38           HA       ASP  38  -4.463   1.476  -2.893
  259    HB2  ASP  38           HB2      ASP  38  -6.818   1.055  -3.789
  260    HB3  ASP  38           HB1      ASP  38  -6.359   2.115  -5.123
  261    H    ILE  39           HN       ILE  39  -2.603   1.823  -3.694
  262    HA   ILE  39           HA       ILE  39  -1.607   4.270  -4.518
  263    HB   ILE  39           HB       ILE  39  -0.552   1.503  -5.126
  264   HG12  ILE  39          HG12      ILE  39  -0.311   3.328  -2.752
  265   HG13  ILE  39          HG11      ILE  39  -0.816   1.648  -2.795
  266   HG21  ILE  39          HG21      ILE  39   0.870   4.153  -5.090
  267   HG22  ILE  39          HG22      ILE  39   0.530   3.163  -6.511
  268   HG23  ILE  39          HG23      ILE  39   1.640   2.575  -5.271
  269   HD11  ILE  39          HD11      ILE  39   1.469   0.972  -3.318
  270   HD12  ILE  39          HD12      ILE  39   1.388   1.876  -1.807
  271   HD13  ILE  39          HD13      ILE  39   1.977   2.660  -3.273
  272    H    LEU  40           HN       LEU  40  -2.943   1.618  -6.416
  273    HA   LEU  40           HA       LEU  40  -2.465   3.191  -8.874
  274    HB2  LEU  40           HB2      LEU  40  -2.983   0.227  -8.593
  275    HB3  LEU  40           HB1      LEU  40  -2.697   1.079 -10.100
  276    HG   LEU  40           HG       LEU  40  -0.700   0.725  -7.855
  277   HD11  LEU  40          HD11      LEU  40  -0.825  -0.450 -10.629
  278   HD12  LEU  40          HD12      LEU  40  -1.141  -1.312  -9.122
  279   HD13  LEU  40          HD13      LEU  40   0.473  -0.685  -9.457
  280   HD21  LEU  40          HD21      LEU  40  -0.396   2.868  -8.969
  281   HD22  LEU  40          HD22      LEU  40  -0.426   2.073 -10.544
  282   HD23  LEU  40          HD23      LEU  40   0.894   1.752  -9.418
  283    H    GLY  41           HN       GLY  41  -4.746   2.595  -6.672
  284    HA2  GLY  41           HA2      GLY  41  -7.026   2.645  -6.592
  285    HA3  GLY  41           HA1      GLY  41  -6.978   3.351  -8.196
  286    H    ASN  42           HN       ASN  42  -5.500   0.287  -7.581
  287    HA   ASN  42           HA       ASN  42  -7.418  -0.940  -9.422
  288    HB2  ASN  42           HB2      ASN  42  -5.832  -2.646  -9.846
  289    HB3  ASN  42           HB1      ASN  42  -4.970  -1.133  -9.887
  290   HD21  ASN  42          HD21      ASN  42  -4.707  -0.916  -6.969
  291   HD22  ASN  42          HD22      ASN  42  -3.548  -2.116  -6.526
  292    H    GLY  43           HN       GLY  43  -6.485  -1.054  -6.101
  293    HA2  GLY  43           HA2      GLY  43  -8.204  -1.742  -4.554
  294    HA3  GLY  43           HA1      GLY  43  -8.669  -2.993  -5.697
  295    H    LEU  44           HN       LEU  44  -5.587  -3.308  -6.047
  296    HA   LEU  44           HA       LEU  44  -5.503  -5.448  -4.056
  297    HB2  LEU  44           HB2      LEU  44  -3.395  -5.202  -6.148
  298    HB3  LEU  44           HB1      LEU  44  -4.148  -6.635  -5.479
  299    HG   LEU  44           HG       LEU  44  -5.321  -4.792  -7.556
  300   HD11  LEU  44          HD11      LEU  44  -5.208  -6.811  -8.970
  301   HD12  LEU  44          HD12      LEU  44  -4.289  -7.603  -7.689
  302   HD13  LEU  44          HD13      LEU  44  -3.639  -6.175  -8.495
  303   HD21  LEU  44          HD21      LEU  44  -7.071  -5.620  -6.096
  304   HD22  LEU  44          HD22      LEU  44  -6.499  -7.270  -6.333
  305   HD23  LEU  44          HD23      LEU  44  -7.169  -6.365  -7.691
  306    H    LEU  45           HN       LEU  45  -4.077  -2.404  -4.743
  307    HA   LEU  45           HA       LEU  45  -1.838  -2.949  -2.907
  308    HB2  LEU  45           HB2      LEU  45  -0.893  -2.951  -5.042
  309    HB3  LEU  45           HB1      LEU  45  -1.871  -1.607  -5.578
  310    HG   LEU  45           HG       LEU  45  -0.543  -0.068  -4.222
  311   HD11  LEU  45          HD11      LEU  45  -0.023  -1.599  -2.384
  312   HD12  LEU  45          HD12      LEU  45   1.436  -0.849  -3.032
  313   HD13  LEU  45          HD13      LEU  45   1.041  -2.516  -3.451
  314   HD21  LEU  45          HD21      LEU  45   0.165  -0.608  -6.504
  315   HD22  LEU  45          HD22      LEU  45   1.160  -1.923  -5.877
  316   HD23  LEU  45          HD23      LEU  45   1.542  -0.252  -5.460
  317    H    ARG  46           HN       ARG  46  -2.472  -1.875  -1.074
  318    HA   ARG  46           HA       ARG  46  -3.305   0.951  -1.387
  319    HB2  ARG  46           HB2      ARG  46  -4.537  -1.149   0.404
  320    HB3  ARG  46           HB1      ARG  46  -4.920   0.569   0.471
  321    HG2  ARG  46           HG2      ARG  46  -5.829   0.515  -1.723
  322    HG3  ARG  46           HG1      ARG  46  -5.274  -1.135  -1.976
  323    HD2  ARG  46           HD2      ARG  46  -7.275  -0.301   0.112
  324    HD3  ARG  46           HD1      ARG  46  -7.696  -0.971  -1.464
  325    HE   ARG  46           HE       ARG  46  -5.906  -2.551   0.205
  326   HH11  ARG  46          HH11      ARG  46  -9.165  -2.078  -1.000
  327   HH12  ARG  46          HH12      ARG  46  -9.702  -3.662  -0.517
  328   HH21  ARG  46          HH21      ARG  46  -6.604  -4.628   0.827
  329   HH22  ARG  46          HH22      ARG  46  -8.243  -5.118   0.529
  330    H    LYS  47           HN       LYS  47  -2.545   2.378   0.142
  331    HA   LYS  47           HA       LYS  47  -0.578   1.306   2.072
  332    HB2  LYS  47           HB2      LYS  47   0.064   2.874   0.067
  333    HB3  LYS  47           HB1      LYS  47  -0.609   4.139   1.082
  334    HG2  LYS  47           HG2      LYS  47   1.012   3.117   2.881
  335    HG3  LYS  47           HG1      LYS  47   1.852   2.510   1.450
  336    HD2  LYS  47           HD2      LYS  47   2.879   4.552   1.868
  337    HD3  LYS  47           HD1      LYS  47   1.722   4.922   0.593
  338    HE2  LYS  47           HE2      LYS  47   0.342   6.115   1.975
  339    HE3  LYS  47           HE1      LYS  47   0.817   5.219   3.415
  340    HZ1  LYS  47           HZ1      LYS  47   1.600   7.550   3.383
  341    HZ2  LYS  47           HZ2      LYS  47   2.571   7.200   2.042
  342    HZ3  LYS  47           HZ3      LYS  47   2.862   6.440   3.527
  343    H    LYS  48           HN       LYS  48  -1.057   1.584   4.191
  344    HA   LYS  48           HA       LYS  48  -2.936   3.746   4.895
  345    HB2  LYS  48           HB2      LYS  48  -3.824   1.471   5.313
  346    HB3  LYS  48           HB1      LYS  48  -2.471   1.159   6.392
  347    HG2  LYS  48           HG2      LYS  48  -3.222   2.818   7.935
  348    HG3  LYS  48           HG1      LYS  48  -4.455   3.380   6.807
  349    HD2  LYS  48           HD2      LYS  48  -5.579   2.049   8.399
  350    HD3  LYS  48           HD1      LYS  48  -5.462   1.078   6.933
  351    HE2  LYS  48           HE2      LYS  48  -4.971  -0.281   8.875
  352    HE3  LYS  48           HE1      LYS  48  -3.518  -0.102   7.890
  353    HZ1  LYS  48           HZ1      LYS  48  -3.161   0.162  10.328
  354    HZ2  LYS  48           HZ2      LYS  48  -4.120   1.560  10.285
  355    HZ3  LYS  48           HZ3      LYS  48  -2.672   1.499   9.418
  356    H    THR  49           HN       THR  49  -2.080   5.359   6.004
  357    HA   THR  49           HA       THR  49   0.582   5.249   7.052
  358    HB   THR  49           HB       THR  49  -0.059   7.580   7.901
  359    HG1  THR  49           HG1      THR  49  -2.304   7.370   7.884
  360   HG21  THR  49          HG21      THR  49  -0.282   6.988   4.947
  361   HG22  THR  49          HG22      THR  49   1.219   7.198   5.851
  362   HG23  THR  49          HG23      THR  49   0.105   8.553   5.660
  363    H    LEU  50           HN       LEU  50   0.952   4.106   8.856
  364    HA   LEU  50           HA       LEU  50  -0.820   4.079  11.119
  365    HB2  LEU  50           HB2      LEU  50   2.146   3.622  11.250
  366    HB3  LEU  50           HB1      LEU  50   0.885   2.879  12.219
  367    HG   LEU  50           HG       LEU  50   1.204   2.328   9.275
  368   HD11  LEU  50          HD11      LEU  50   3.269   1.736  10.389
  369   HD12  LEU  50          HD12      LEU  50   2.377   0.288   9.920
  370   HD13  LEU  50          HD13      LEU  50   2.375   0.818  11.603
  371   HD21  LEU  50          HD21      LEU  50  -0.966   1.818  10.273
  372   HD22  LEU  50          HD22      LEU  50  -0.170   0.813  11.485
  373   HD23  LEU  50          HD23      LEU  50  -0.108   0.358   9.782
  374    H    VAL  51           HN       VAL  51   2.297   5.482  10.367
  375    HA   VAL  51           HA       VAL  51   1.556   8.001  11.696
  376    HB   VAL  51           HB       VAL  51   4.300   6.746  11.671
  377   HG11  VAL  51          HG11      VAL  51   4.368   9.168  11.581
  378   HG12  VAL  51          HG12      VAL  51   4.925   8.598  13.155
  379   HG13  VAL  51          HG13      VAL  51   3.304   9.269  12.985
  380   HG21  VAL  51          HG21      VAL  51   2.924   5.540  13.228
  381   HG22  VAL  51          HG22      VAL  51   2.343   7.047  13.937
  382   HG23  VAL  51          HG23      VAL  51   4.032   6.575  14.134
  383    HA   PRO  52           HA       PRO  52   3.002   9.115   7.599
  384    HB2  PRO  52           HB2      PRO  52   1.449  11.217   7.317
  385    HB3  PRO  52           HB1      PRO  52   0.739   9.619   7.609
  386    HG2  PRO  52           HG2      PRO  52   1.010  11.922   9.483
  387    HG3  PRO  52           HG1      PRO  52  -0.260  10.689   9.394
  388    HD2  PRO  52           HD2      PRO  52   2.097  10.719  11.056
  389    HD3  PRO  52           HD1      PRO  52   0.813   9.492  10.991
  390    H    GLY  53           HN       GLY  53   5.073   9.672   9.278
  391    HA2  GLY  53           HA2      GLY  53   6.946  11.023   9.181
  392    HA3  GLY  53           HA1      GLY  53   6.025  12.177   8.230
  393    HA   PRO  54           HA       PRO  54   5.476  12.922  13.100
  394    HB2  PRO  54           HB2      PRO  54   8.352  12.458  13.682
  395    HB3  PRO  54           HB1      PRO  54   6.924  12.081  14.655
  396    HG2  PRO  54           HG2      PRO  54   8.243  10.147  13.384
  397    HG3  PRO  54           HG1      PRO  54   6.472  10.133  13.471
  398    HD2  PRO  54           HD2      PRO  54   8.253  10.911  11.195
  399    HD3  PRO  54           HD1      PRO  54   6.735   9.990  11.176
  400    HA   PRO  55           HA       PRO  55   8.497  16.493  12.607
  401    HB2  PRO  55           HB2      PRO  55  10.798  16.202  11.148
  402    HB3  PRO  55           HB1      PRO  55  10.652  15.781  12.853
  403    HG2  PRO  55           HG2      PRO  55  11.039  14.028  10.605
  404    HG3  PRO  55           HG1      PRO  55  10.980  13.614  12.324
  405    HD2  PRO  55           HD2      PRO  55   8.878  13.408  10.272
  406    HD3  PRO  55           HD1      PRO  55   9.017  12.572  11.832
  407    H    GLY  56           HN       GLY  56   9.929  17.811  10.660
  408    HA2  GLY  56           HA2      GLY  56   8.013  18.242   8.540
  409    HA3  GLY  56           HA1      GLY  56   9.571  19.047   8.728
  410    H    SER  57           HN       SER  57   8.144  15.925   7.894
  411    HA   SER  57           HA       SER  57  10.494  14.749   6.981
  412    HB2  SER  57           HB2      SER  57   7.627  14.068   6.352
  413    HB3  SER  57           HB1      SER  57   9.012  13.013   6.154
  414    HG   SER  57           HG       SER  57   8.920  12.537   8.173
  415    H    SER  58           HN       SER  58  10.495  13.690   4.760
  416    HA   SER  58           HA       SER  58   9.647  15.398   2.574
  417    HB2  SER  58           HB2      SER  58  12.524  14.521   2.941
  418    HB3  SER  58           HB1      SER  58  11.888  15.531   1.638
  419    HG   SER  58           HG       SER  58  11.252  16.605   4.013
  420    H    ARG  59           HN       ARG  59   9.210  14.142   0.747
  421    HA   ARG  59           HA       ARG  59   9.441  11.272   1.135
  422    HB2  ARG  59           HB2      ARG  59   8.156  12.824  -1.124
  423    HB3  ARG  59           HB1      ARG  59   8.034  11.079  -0.858
  424    HG2  ARG  59           HG2      ARG  59   6.977  11.554   1.334
  425    HG3  ARG  59           HG1      ARG  59   6.974  13.262   0.917
  426    HD2  ARG  59           HD2      ARG  59   5.555  12.806  -1.006
  427    HD3  ARG  59           HD1      ARG  59   5.585  11.083  -0.625
  428    HE   ARG  59           HE       ARG  59   4.710  12.310   1.667
  429   HH11  ARG  59          HH11      ARG  59   3.604  12.185  -1.657
  430   HH12  ARG  59          HH12      ARG  59   1.936  12.423  -1.242
  431   HH21  ARG  59          HH21      ARG  59   2.527  12.572   2.223
  432   HH22  ARG  59          HH22      ARG  59   1.310  12.630   0.975
  433    HA   PRO  60           HA       PRO  60  13.374  11.139  -1.008
  434    HB2  PRO  60           HB2      PRO  60  13.127   8.370  -1.382
  435    HB3  PRO  60           HB1      PRO  60  13.930   9.170  -0.028
  436    HG2  PRO  60           HG2      PRO  60  11.167   8.059  -0.207
  437    HG3  PRO  60           HG1      PRO  60  12.300   8.048   1.160
  438    HD2  PRO  60           HD2      PRO  60  10.244   9.737   1.128
  439    HD3  PRO  60           HD1      PRO  60  11.837  10.262   1.718
  440    H    VAL  61           HN       VAL  61  14.037  10.872  -3.123
  441    HA   VAL  61           HA       VAL  61  11.862  10.633  -5.069
  442    HB   VAL  61           HB       VAL  61  14.723  11.414  -5.619
  443   HG11  VAL  61          HG11      VAL  61  13.472  10.781  -7.587
  444   HG12  VAL  61          HG12      VAL  61  13.749  12.525  -7.593
  445   HG13  VAL  61          HG13      VAL  61  12.168  11.883  -7.145
  446   HG21  VAL  61          HG21      VAL  61  14.018  13.754  -5.491
  447   HG22  VAL  61          HG22      VAL  61  13.830  12.936  -3.940
  448   HG23  VAL  61          HG23      VAL  61  12.418  13.240  -4.953
  449    H    LYS  62           HN       LYS  62  12.055   9.204  -6.856
  450    HA   LYS  62           HA       LYS  62  13.258   6.695  -6.318
  451    HB2  LYS  62           HB2      LYS  62  12.187   7.870  -8.908
  452    HB3  LYS  62           HB1      LYS  62  12.672   6.192  -8.705
  453    HG2  LYS  62           HG2      LYS  62  10.963   6.071  -6.826
  454    HG3  LYS  62           HG1      LYS  62  10.369   7.626  -7.413
  455    HD2  LYS  62           HD2      LYS  62   9.749   6.717  -9.500
  456    HD3  LYS  62           HD1      LYS  62  10.664   5.234  -9.212
  457    HE2  LYS  62           HE2      LYS  62   9.046   5.047  -7.143
  458    HE3  LYS  62           HE1      LYS  62   8.019   6.082  -8.132
  459    HZ1  LYS  62           HZ1      LYS  62   7.362   4.002  -8.775
  460    HZ2  LYS  62           HZ2      LYS  62   8.900   3.318  -8.617
  461    HZ3  LYS  62           HZ3      LYS  62   8.544   4.315  -9.950
  462    H    GLY  63           HN       GLY  63  15.176   6.055  -6.551
  463    HA2  GLY  63           HA2      GLY  63  17.271   6.140  -7.931
  464    HA3  GLY  63           HA1      GLY  63  17.120   7.891  -7.774
  465    H    GLN  64           HN       GLN  64  16.235   8.049  -5.140
  466    HA   GLN  64           HA       GLN  64  18.727   7.808  -3.765
  467    HB2  GLN  64           HB2      GLN  64  16.142   8.143  -2.286
  468    HB3  GLN  64           HB1      GLN  64  17.721   8.864  -1.962
  469    HG2  GLN  64           HG2      GLN  64  15.800   9.654  -4.143
  470    HG3  GLN  64           HG1      GLN  64  16.108  10.528  -2.651
  471   HE21  GLN  64          HE21      GLN  64  18.540   9.058  -4.742
  472   HE22  GLN  64          HE22      GLN  64  19.319  10.549  -5.165
  473    H    VAL  65           HN       VAL  65  19.472   6.160  -2.535
  474    HA   VAL  65           HA       VAL  65  17.770   3.835  -2.304
  475    HB   VAL  65           HB       VAL  65  19.649   2.622  -1.414
  476   HG11  VAL  65          HG11      VAL  65  20.501   4.326  -3.752
  477   HG12  VAL  65          HG12      VAL  65  19.539   2.850  -3.832
  478   HG13  VAL  65          HG13      VAL  65  21.214   2.784  -3.285
  479   HG21  VAL  65          HG21      VAL  65  21.112   5.245  -1.382
  480   HG22  VAL  65          HG22      VAL  65  21.865   3.666  -1.150
  481   HG23  VAL  65          HG23      VAL  65  20.663   4.249   0.003
  482    H    VAL  66           HN       VAL  66  16.528   3.480  -0.686
  483    HA   VAL  66           HA       VAL  66  16.840   5.135   1.707
  484    HB   VAL  66           HB       VAL  66  14.375   5.054   1.899
  485   HG11  VAL  66          HG11      VAL  66  15.489   6.166  -0.675
  486   HG12  VAL  66          HG12      VAL  66  15.324   7.006   0.868
  487   HG13  VAL  66          HG13      VAL  66  13.889   6.547  -0.043
  488   HG21  VAL  66          HG21      VAL  66  14.194   2.932   0.497
  489   HG22  VAL  66          HG22      VAL  66  14.337   3.990  -0.916
  490   HG23  VAL  66          HG23      VAL  66  12.990   4.185   0.205
  491    H    THR  67           HN       THR  67  16.472   4.282   3.687
  492    HA   THR  67           HA       THR  67  16.581   1.393   3.862
  493    HB   THR  67           HB       THR  67  17.027   1.681   6.210
  494    HG1  THR  67           HG1      THR  67  17.225   4.063   6.882
  495   HG21  THR  67          HG21      THR  67  18.947   2.014   4.769
  496   HG22  THR  67          HG22      THR  67  19.050   3.060   6.184
  497   HG23  THR  67          HG23      THR  67  18.566   3.729   4.625
  498    H    VAL  68           HN       VAL  68  14.677   0.339   3.795
  499    HA   VAL  68           HA       VAL  68  12.533   1.488   5.423
  500    HB   VAL  68           HB       VAL  68  10.966  -0.058   4.259
  501   HG11  VAL  68          HG11      VAL  68  12.479   1.862   2.489
  502   HG12  VAL  68          HG12      VAL  68  11.147   2.267   3.571
  503   HG13  VAL  68          HG13      VAL  68  10.865   1.230   2.173
  504   HG21  VAL  68          HG21      VAL  68  11.659  -1.129   2.184
  505   HG22  VAL  68          HG22      VAL  68  12.629  -1.720   3.535
  506   HG23  VAL  68          HG23      VAL  68  13.308  -0.543   2.411
  507    H    HIS  69           HN       HIS  69  11.664   0.332   7.070
  508    HA   HIS  69           HA       HIS  69  12.778  -2.346   7.533
  509    HB2  HIS  69           HB2      HIS  69  12.931  -0.855   9.488
  510    HB3  HIS  69           HB1      HIS  69  11.200  -0.539   9.405
  511    HD1  HIS  69           HD1      HIS  69  12.568  -1.826  11.967
  512    HD2  HIS  69           HD2      HIS  69  10.625  -3.897   8.930
  513    HE1  HIS  69           HE1      HIS  69  11.870  -4.060  12.942
  514    HE2  HIS  69           HE2      HIS  69  10.554  -5.175  11.168
  515    H    LEU  70           HN       LEU  70  11.543  -3.982   6.772
  516    HA   LEU  70           HA       LEU  70   8.664  -3.468   6.861
  517    HB2  LEU  70           HB2      LEU  70   8.250  -4.345   4.837
  518    HB3  LEU  70           HB1      LEU  70   9.878  -3.779   4.532
  519    HG   LEU  70           HG       LEU  70   9.231  -6.606   5.342
  520   HD11  LEU  70          HD11      LEU  70   8.120  -6.073   3.229
  521   HD12  LEU  70          HD12      LEU  70   9.468  -7.181   2.978
  522   HD13  LEU  70          HD13      LEU  70   9.645  -5.473   2.573
  523   HD21  LEU  70          HD21      LEU  70  11.667  -5.363   4.064
  524   HD22  LEU  70          HD22      LEU  70  11.453  -7.076   4.437
  525   HD23  LEU  70          HD23      LEU  70  11.532  -5.888   5.740
  526    H    GLN  71           HN       GLN  71   7.434  -4.836   7.852
  527    HA   GLN  71           HA       GLN  71   8.327  -7.611   8.200
  528    HB2  GLN  71           HB2      GLN  71   6.477  -6.523  10.236
  529    HB3  GLN  71           HB1      GLN  71   7.697  -7.772  10.407
  530    HG2  GLN  71           HG2      GLN  71   8.682  -6.191  11.664
  531    HG3  GLN  71           HG1      GLN  71   9.320  -5.715  10.095
  532   HE21  GLN  71          HE21      GLN  71   6.607  -4.782   9.311
  533   HE22  GLN  71          HE22      GLN  71   6.484  -3.227  10.039
  534    H    THR  72           HN       THR  72   7.028  -8.756   7.095
  535    HA   THR  72           HA       THR  72   4.551  -7.512   6.209
  536    HB   THR  72           HB       THR  72   6.230  -9.667   4.963
  537    HG1  THR  72           HG1      THR  72   7.006  -8.025   3.657
  538   HG21  THR  72          HG21      THR  72   4.859  -9.135   2.949
  539   HG22  THR  72          HG22      THR  72   3.816  -8.157   3.987
  540   HG23  THR  72          HG23      THR  72   3.962  -9.895   4.262
  541    H    SER  73           HN       SER  73   2.672  -8.411   6.537
  542    HA   SER  73           HA       SER  73   2.554 -11.053   7.793
  543    HB2  SER  73           HB2      SER  73   0.339  -8.991   7.585
  544    HB3  SER  73           HB1      SER  73   0.402 -10.393   8.646
  545    HG   SER  73           HG       SER  73   0.983  -8.791   9.954
  546    H    LEU  74           HN       LEU  74   1.007 -12.514   7.010
  547    HA   LEU  74           HA       LEU  74   0.302 -12.301   4.238
  548    HB2  LEU  74           HB2      LEU  74  -0.316 -14.300   6.394
  549    HB3  LEU  74           HB1      LEU  74  -0.919 -14.454   4.757
  550    HG   LEU  74           HG       LEU  74   1.871 -14.713   5.788
  551   HD11  LEU  74          HD11      LEU  74   0.221 -16.338   3.863
  552   HD12  LEU  74          HD12      LEU  74   0.512 -16.724   5.559
  553   HD13  LEU  74          HD13      LEU  74   1.851 -16.725   4.412
  554   HD21  LEU  74          HD21      LEU  74   2.081 -13.070   4.056
  555   HD22  LEU  74          HD22      LEU  74   1.076 -14.036   2.969
  556   HD23  LEU  74          HD23      LEU  74   2.670 -14.624   3.448
  557    H    GLU  75           HN       GLU  75  -2.058 -12.664   3.610
  558    HA   GLU  75           HA       GLU  75  -3.589 -10.555   4.595
  559    HB2  GLU  75           HB2      GLU  75  -5.456 -11.545   3.305
  560    HB3  GLU  75           HB1      GLU  75  -3.965 -11.390   2.392
  561    HG2  GLU  75           HG2      GLU  75  -3.521 -13.770   2.741
  562    HG3  GLU  75           HG1      GLU  75  -5.064 -13.923   3.583
  563    H    ASN  76           HN       ASN  76  -3.115 -13.654   5.943
  564    HA   ASN  76           HA       ASN  76  -5.583 -13.523   7.495
  565    HB2  ASN  76           HB2      ASN  76  -5.244 -15.728   8.109
  566    HB3  ASN  76           HB1      ASN  76  -4.488 -15.693   6.520
  567   HD21  ASN  76          HD21      ASN  76  -2.307 -15.956   6.330
  568   HD22  ASN  76          HD22      ASN  76  -1.302 -16.448   7.661
  569    H    GLY  77           HN       GLY  77  -2.371 -12.491   7.704
  570    HA2  GLY  77           HA2      GLY  77  -1.914 -10.910   9.517
  571    HA3  GLY  77           HA1      GLY  77  -2.691 -12.050  10.602
  572    H    THR  78           HN       THR  78  -0.939 -13.965   8.607
  573    HA   THR  78           HA       THR  78   1.019 -14.438  10.620
  574    HB   THR  78           HB       THR  78   0.918 -15.630   7.853
  575    HG1  THR  78           HG1      THR  78  -0.450 -16.250  10.254
  576   HG21  THR  78          HG21      THR  78   2.182 -16.628  10.411
  577   HG22  THR  78          HG22      THR  78   3.047 -15.968   9.022
  578   HG23  THR  78          HG23      THR  78   2.156 -17.482   8.867
  579    H    ARG  79           HN       ARG  79   2.712 -13.130  10.874
  580    HA   ARG  79           HA       ARG  79   3.819 -11.698   8.657
  581    HB2  ARG  79           HB2      ARG  79   4.600 -11.928  11.542
  582    HB3  ARG  79           HB1      ARG  79   5.561 -11.021  10.366
  583    HG2  ARG  79           HG2      ARG  79   3.069 -10.115   9.821
  584    HG3  ARG  79           HG1      ARG  79   2.961 -10.388  11.565
  585    HD2  ARG  79           HD2      ARG  79   4.679  -8.880  12.028
  586    HD3  ARG  79           HD1      ARG  79   5.283  -8.919  10.369
  587    HE   ARG  79           HE       ARG  79   2.865  -7.873   9.991
  588   HH11  ARG  79          HH11      ARG  79   5.229  -7.078  12.457
  589   HH12  ARG  79          HH12      ARG  79   4.826  -5.391  12.479
  590   HH21  ARG  79          HH21      ARG  79   2.324  -5.650  10.041
  591   HH22  ARG  79          HH22      ARG  79   3.164  -4.565  11.111
  592    H    VAL  80           HN       VAL  80   5.064 -12.454   7.247
  593    HA   VAL  80           HA       VAL  80   6.272 -15.076   7.672
  594    HB   VAL  80           HB       VAL  80   6.326 -15.171   5.206
  595   HG11  VAL  80          HG11      VAL  80   3.648 -14.520   6.396
  596   HG12  VAL  80          HG12      VAL  80   4.452 -16.088   6.449
  597   HG13  VAL  80          HG13      VAL  80   3.922 -15.420   4.905
  598   HG21  VAL  80          HG21      VAL  80   6.508 -12.816   4.687
  599   HG22  VAL  80          HG22      VAL  80   4.920 -12.513   5.395
  600   HG23  VAL  80          HG23      VAL  80   5.063 -13.484   3.928
  601    H    GLN  81           HN       GLN  81   7.190 -11.838   7.431
  602    HA   GLN  81           HA       GLN  81   9.969 -12.538   7.182
  603    HB2  GLN  81           HB2      GLN  81  10.387 -11.119   5.206
  604    HB3  GLN  81           HB1      GLN  81   9.350 -12.487   4.828
  605    HG2  GLN  81           HG2      GLN  81   7.386 -10.947   5.059
  606    HG3  GLN  81           HG1      GLN  81   8.529  -9.621   5.175
  607   HE21  GLN  81          HE21      GLN  81   7.082 -11.988   3.110
  608   HE22  GLN  81          HE22      GLN  81   7.653 -11.330   1.614
  609    H    GLU  82           HN       GLU  82  11.219 -11.117   8.222
  610    HA   GLU  82           HA       GLU  82  10.226  -8.402   8.647
  611    HB2  GLU  82           HB2      GLU  82   9.703  -9.477  10.735
  612    HB3  GLU  82           HB1      GLU  82  11.289 -10.237  10.799
  613    HG2  GLU  82           HG2      GLU  82  12.354  -8.097  11.108
  614    HG3  GLU  82           HG1      GLU  82  10.813  -7.266  10.913
  615    H    GLU  83           HN       GLU  83  11.686  -6.930   8.229
  616    HA   GLU  83           HA       GLU  83  14.503  -7.525   8.532
  617    HB2  GLU  83           HB2      GLU  83  14.509  -8.106   6.328
  618    HB3  GLU  83           HB1      GLU  83  13.087  -7.150   5.958
  619    HG2  GLU  83           HG2      GLU  83  14.359  -5.177   5.721
  620    HG3  GLU  83           HG1      GLU  83  15.793  -5.930   6.430
  621    HA   PRO  84           HA       PRO  84  13.820  -3.675  10.507
  622    HB2  PRO  84           HB2      PRO  84  16.693  -3.769  11.108
  623    HB3  PRO  84           HB1      PRO  84  15.315  -3.832  12.209
  624    HG2  PRO  84           HG2      PRO  84  16.864  -5.981  11.734
  625    HG3  PRO  84           HG1      PRO  84  15.124  -6.123  12.055
  626    HD2  PRO  84           HD2      PRO  84  16.588  -6.222   9.441
  627    HD3  PRO  84           HD1      PRO  84  15.241  -7.226  10.019
  628    H    GLU  85           HN       GLU  85  15.965  -4.168   7.871
  629    HA   GLU  85           HA       GLU  85  15.876  -1.441   7.123
  630    HB2  GLU  85           HB2      GLU  85  17.562  -1.350   8.959
  631    HB3  GLU  85           HB1      GLU  85  18.570  -2.450   8.032
  632    HG2  GLU  85           HG2      GLU  85  19.009  -0.856   6.395
  633    HG3  GLU  85           HG1      GLU  85  17.662   0.166   6.903
  634    H    LEU  86           HN       LEU  86  15.532  -1.650   5.164
  635    HA   LEU  86           HA       LEU  86  17.325  -3.257   3.489
  636    HB2  LEU  86           HB2      LEU  86  15.160  -4.307   3.515
  637    HB3  LEU  86           HB1      LEU  86  14.357  -2.770   3.275
  638    HG   LEU  86           HG       LEU  86  15.363  -2.624   1.041
  639   HD11  LEU  86          HD11      LEU  86  17.325  -4.033   1.425
  640   HD12  LEU  86          HD12      LEU  86  16.393  -4.598   0.040
  641   HD13  LEU  86          HD13      LEU  86  16.282  -5.446   1.583
  642   HD21  LEU  86          HD21      LEU  86  13.947  -4.392   0.027
  643   HD22  LEU  86          HD22      LEU  86  13.120  -3.459   1.275
  644   HD23  LEU  86          HD23      LEU  86  13.720  -5.078   1.642
  645    H    VAL  87           HN       VAL  87  18.592  -1.798   2.482
  646    HA   VAL  87           HA       VAL  87  17.409   0.777   1.698
  647    HB   VAL  87           HB       VAL  87  20.312   0.163   1.355
  648   HG11  VAL  87          HG11      VAL  87  19.527   2.245   0.472
  649   HG12  VAL  87          HG12      VAL  87  20.542   2.556   1.883
  650   HG13  VAL  87          HG13      VAL  87  18.787   2.655   2.019
  651   HG21  VAL  87          HG21      VAL  87  19.055   0.948   3.963
  652   HG22  VAL  87          HG22      VAL  87  20.787   0.909   3.632
  653   HG23  VAL  87          HG23      VAL  87  19.850  -0.586   3.613
  654    H    PHE  88           HN       PHE  88  16.964   1.163  -0.406
  655    HA   PHE  88           HA       PHE  88  18.103  -0.554  -2.486
  656    HB2  PHE  88           HB2      PHE  88  15.968  -1.293  -3.302
  657    HB3  PHE  88           HB1      PHE  88  16.114  -1.739  -1.608
  658    HD1  PHE  88           HD2      PHE  88  14.800  -0.591   0.104
  659    HD2  PHE  88           HD1      PHE  88  14.348   0.297  -4.034
  660    HE1  PHE  88           HE2      PHE  88  12.667   0.520   0.585
  661    HE2  PHE  88           HE1      PHE  88  12.201   1.400  -3.575
  662    HZ   PHE  88           HZ       PHE  88  11.349   1.505  -1.268
  663    H    THR  89           HN       THR  89  17.536   0.111  -4.639
  664    HA   THR  89           HA       THR  89  17.561   2.987  -4.867
  665    HB   THR  89           HB       THR  89  17.347   1.043  -7.165
  666    HG1  THR  89           HG1      THR  89  19.090   0.557  -5.525
  667   HG21  THR  89          HG21      THR  89  18.675   3.741  -6.850
  668   HG22  THR  89          HG22      THR  89  17.171   3.415  -7.712
  669   HG23  THR  89          HG23      THR  89  18.692   2.758  -8.313
  670    H    LEU  90           HN       LEU  90  15.664   4.003  -4.574
  671    HA   LEU  90           HA       LEU  90  13.095   2.966  -4.994
  672    HB2  LEU  90           HB2      LEU  90  13.830   5.080  -3.719
  673    HB3  LEU  90           HB1      LEU  90  13.782   5.878  -5.258
  674    HG   LEU  90           HG       LEU  90  11.433   5.462  -5.483
  675   HD11  LEU  90          HD11      LEU  90  11.637   3.963  -2.872
  676   HD12  LEU  90          HD12      LEU  90  11.394   3.235  -4.460
  677   HD13  LEU  90          HD13      LEU  90  10.159   4.290  -3.775
  678   HD21  LEU  90          HD21      LEU  90  10.584   6.727  -3.568
  679   HD22  LEU  90          HD22      LEU  90  12.083   7.420  -4.186
  680   HD23  LEU  90          HD23      LEU  90  12.101   6.450  -2.714
  681    H    GLY  91           HN       GLY  91  11.858   2.725  -6.784
  682    HA2  GLY  91           HA2      GLY  91  10.935   3.322  -8.831
  683    HA3  GLY  91           HA1      GLY  91  12.171   4.554  -9.002
  684    H    ASP  92           HN       ASP  92  13.858   1.903  -8.227
  685    HA   ASP  92           HA       ASP  92  14.277   1.331 -11.076
  686    HB2  ASP  92           HB2      ASP  92  16.184   2.422  -9.881
  687    HB3  ASP  92           HB1      ASP  92  16.280   1.022  -8.828
  688    H    CYS  93           HN       CYS  93  12.490   0.268  -8.877
  689    HA   CYS  93           HA       CYS  93  11.540  -1.711  -8.321
  690    HB2  CYS  93           HB2      CYS  93  12.835  -2.730 -10.852
  691    HB3  CYS  93           HB1      CYS  93  11.386  -3.362 -10.065
  692    HG   CYS  93           HG       CYS  93  11.392  -0.144 -11.166
  693    H    ASP  94           HN       ASP  94  13.976  -1.161  -7.127
  694    HA   ASP  94           HA       ASP  94  15.730  -3.411  -7.287
  695    HB2  ASP  94           HB2      ASP  94  16.309  -0.991  -6.669
  696    HB3  ASP  94           HB1      ASP  94  15.614  -1.340  -5.093
  697    H    VAL  95           HN       VAL  95  12.759  -2.974  -6.172
  698    HA   VAL  95           HA       VAL  95  12.872  -5.039  -4.090
  699    HB   VAL  95           HB       VAL  95  11.133  -3.687  -2.825
  700   HG11  VAL  95          HG11      VAL  95  13.929  -2.610  -3.051
  701   HG12  VAL  95          HG12      VAL  95  13.394  -3.941  -2.021
  702   HG13  VAL  95          HG13      VAL  95  12.821  -2.301  -1.714
  703   HG21  VAL  95          HG21      VAL  95  10.532  -2.115  -4.555
  704   HG22  VAL  95          HG22      VAL  95  12.190  -1.512  -4.639
  705   HG23  VAL  95          HG23      VAL  95  11.219  -1.236  -3.189
  706    H    ILE  96           HN       ILE  96  10.126  -4.761  -3.404
  707    HA   ILE  96           HA       ILE  96   8.840  -5.861  -5.734
  708    HB   ILE  96           HB       ILE  96   6.896  -6.183  -4.254
  709   HG12  ILE  96          HG12      ILE  96   8.637  -4.934  -2.113
  710   HG13  ILE  96          HG11      ILE  96   7.225  -4.174  -2.842
  711   HG21  ILE  96          HG21      ILE  96   8.653  -7.895  -4.349
  712   HG22  ILE  96          HG22      ILE  96   7.887  -7.839  -2.762
  713   HG23  ILE  96          HG23      ILE  96   9.478  -7.117  -2.998
  714   HD11  ILE  96          HD11      ILE  96   6.705  -5.096  -0.662
  715   HD12  ILE  96          HD12      ILE  96   7.227  -6.694  -1.196
  716   HD13  ILE  96          HD13      ILE  96   5.810  -5.937  -1.926
  717    H    GLN  97           HN       GLN  97   7.222  -4.829  -6.844
  718    HA   GLN  97           HA       GLN  97   7.665  -2.101  -7.191
  719    HB2  GLN  97           HB2      GLN  97   6.636  -3.826  -8.830
  720    HB3  GLN  97           HB1      GLN  97   5.102  -3.356  -8.104
  721    HG2  GLN  97           HG2      GLN  97   5.329  -1.990  -9.991
  722    HG3  GLN  97           HG1      GLN  97   5.765  -0.963  -8.625
  723   HE21  GLN  97          HE21      GLN  97   8.022  -0.530  -8.244
  724   HE22  GLN  97          HE22      GLN  97   9.141  -0.621  -9.556
  725    H    ALA  98           HN       ALA  98   5.269  -3.787  -5.273
  726    HA   ALA  98           HA       ALA  98   3.519  -1.701  -4.660
  727    HB1  ALA  98           HB1      ALA  98   3.081  -2.938  -2.573
  728    HB2  ALA  98           HB2      ALA  98   4.497  -3.942  -2.886
  729    HB3  ALA  98           HB3      ALA  98   3.115  -4.000  -3.978
  730    H    LEU  99           HN       LEU  99   6.607  -2.596  -3.241
  731    HA   LEU  99           HA       LEU  99   6.512  -0.562  -1.219
  732    HB2  LEU  99           HB2      LEU  99   7.781  -2.632  -0.868
  733    HB3  LEU  99           HB1      LEU  99   8.843  -2.190  -2.202
  734    HG   LEU  99           HG       LEU  99   9.604  -0.218  -0.961
  735   HD11  LEU  99          HD11      LEU  99   7.847  -1.235   1.266
  736   HD12  LEU  99          HD12      LEU  99   7.592   0.232   0.319
  737   HD13  LEU  99          HD13      LEU  99   8.994   0.100   1.380
  738   HD21  LEU  99          HD21      LEU  99   9.822  -2.761   0.641
  739   HD22  LEU  99          HD22      LEU  99  10.871  -1.348   0.780
  740   HD23  LEU  99          HD23      LEU  99  10.850  -2.287  -0.713
  741    H    ASP 100           HN       ASP 100   7.900  -0.943  -4.372
  742    HA   ASP 100           HA       ASP 100   9.762   1.156  -4.314
  743    HB2  ASP 100           HB2      ASP 100   9.774  -0.671  -5.963
  744    HB3  ASP 100           HB1      ASP 100   8.272  -0.074  -6.644
  745    H    LEU 101           HN       LEU 101   6.355   0.999  -4.951
  746    HA   LEU 101           HA       LEU 101   6.192   3.791  -5.699
  747    HB2  LEU 101           HB2      LEU 101   4.014   1.748  -5.246
  748    HB3  LEU 101           HB1      LEU 101   3.819   3.316  -5.981
  749    HG   LEU 101           HG       LEU 101   5.389   1.017  -7.125
  750   HD11  LEU 101          HD11      LEU 101   3.650   0.983  -8.839
  751   HD12  LEU 101          HD12      LEU 101   2.768   2.234  -7.962
  752   HD13  LEU 101          HD13      LEU 101   3.007   0.647  -7.233
  753   HD21  LEU 101          HD21      LEU 101   4.867   3.761  -8.262
  754   HD22  LEU 101          HD22      LEU 101   5.597   2.415  -9.136
  755   HD23  LEU 101          HD23      LEU 101   6.424   3.114  -7.746
  756    H    SER 102           HN       SER 102   5.511   1.745  -2.914
  757    HA   SER 102           HA       SER 102   3.786   3.516  -1.583
  758    HB2  SER 102           HB2      SER 102   3.875   1.141  -1.035
  759    HB3  SER 102           HB1      SER 102   5.532   1.320  -0.455
  760    HG   SER 102           HG       SER 102   4.792   2.592   1.220
  761    H    VAL 103           HN       VAL 103   7.258   3.245  -1.704
  762    HA   VAL 103           HA       VAL 103   7.873   4.796   0.568
  763    HB   VAL 103           HB       VAL 103   9.430   4.298  -1.938
  764   HG11  VAL 103          HG11      VAL 103  11.406   5.063  -0.714
  765   HG12  VAL 103          HG12      VAL 103  10.409   5.453   0.687
  766   HG13  VAL 103          HG13      VAL 103  10.214   6.355  -0.816
  767   HG21  VAL 103          HG21      VAL 103   9.185   2.265  -0.885
  768   HG22  VAL 103          HG22      VAL 103   9.215   2.977   0.728
  769   HG23  VAL 103          HG23      VAL 103  10.706   2.854  -0.202
  770    HA   PRO 104           HA       PRO 104   8.112   8.596  -2.656
  771    HB2  PRO 104           HB2      PRO 104   6.065   7.402  -4.460
  772    HB3  PRO 104           HB1      PRO 104   7.398   8.484  -4.857
  773    HG2  PRO 104           HG2      PRO 104   7.444   5.845  -5.394
  774    HG3  PRO 104           HG1      PRO 104   8.905   6.759  -5.003
  775    HD2  PRO 104           HD2      PRO 104   7.481   4.750  -3.409
  776    HD3  PRO 104           HD1      PRO 104   9.145   5.334  -3.262
  777    H    LEU 105           HN       LEU 105   5.364   6.506  -2.017
  778    HA   LEU 105           HA       LEU 105   3.540   8.724  -1.659
  779    HB2  LEU 105           HB2      LEU 105   3.420   5.772  -1.658
  780    HB3  LEU 105           HB1      LEU 105   2.189   6.616  -0.721
  781    HG   LEU 105           HG       LEU 105   1.494   7.848  -2.720
  782   HD11  LEU 105          HD11      LEU 105   3.629   7.903  -3.908
  783   HD12  LEU 105          HD12      LEU 105   2.337   7.265  -4.923
  784   HD13  LEU 105          HD13      LEU 105   3.512   6.168  -4.197
  785   HD21  LEU 105          HD21      LEU 105   0.524   5.967  -3.943
  786   HD22  LEU 105          HD22      LEU 105   0.389   5.769  -2.195
  787   HD23  LEU 105          HD23      LEU 105   1.611   4.869  -3.095
  788    H    MET 106           HN       MET 106   5.815   7.119   0.189
  789    HA   MET 106           HA       MET 106   4.615   7.847   2.751
  790    HB2  MET 106           HB2      MET 106   6.500   5.837   1.801
  791    HB3  MET 106           HB1      MET 106   7.111   6.691   3.207
  792    HG2  MET 106           HG2      MET 106   5.598   5.773   4.574
  793    HG3  MET 106           HG1      MET 106   4.326   5.730   3.347
  794    HE1  MET 106           HE1      MET 106   7.746   2.660   3.733
  795    HE2  MET 106           HE2      MET 106   7.465   3.994   4.860
  796    HE3  MET 106           HE3      MET 106   8.011   4.322   3.213
  797    H    ASP 107           HN       ASP 107   5.491   9.432   4.071
  798    HA   ASP 107           HA       ASP 107   7.644  11.053   2.927
  799    HB2  ASP 107           HB2      ASP 107   5.571  11.463   5.001
  800    HB3  ASP 107           HB1      ASP 107   7.139  12.159   5.396
  801    H    VAL 108           HN       VAL 108   9.557  11.561   4.252
  802    HA   VAL 108           HA       VAL 108  10.666   9.148   5.183
  803    HB   VAL 108           HB       VAL 108  11.881  11.244   4.211
  804   HG11  VAL 108          HG11      VAL 108  12.482  11.854   7.067
  805   HG12  VAL 108          HG12      VAL 108  11.099  12.610   6.282
  806   HG13  VAL 108          HG13      VAL 108  12.722  12.850   5.630
  807   HG21  VAL 108          HG21      VAL 108  13.058   9.566   6.419
  808   HG22  VAL 108          HG22      VAL 108  13.985  10.502   5.244
  809   HG23  VAL 108          HG23      VAL 108  12.981   9.155   4.705
  810    H    GLY 109           HN       GLY 109  10.556   8.216   7.068
  811    HA2  GLY 109           HA2      GLY 109  10.959   8.275   9.431
  812    HA3  GLY 109           HA1      GLY 109  10.219   9.870   9.479
  813    H    GLU 110           HN       GLU 110   8.313   8.099   7.446
  814    HA   GLU 110           HA       GLU 110   6.459   7.652   9.655
  815    HB2  GLU 110           HB2      GLU 110   4.675   7.819   8.172
  816    HB3  GLU 110           HB1      GLU 110   5.799   9.059   7.642
  817    HG2  GLU 110           HG2      GLU 110   6.447   7.773   5.764
  818    HG3  GLU 110           HG1      GLU 110   5.598   6.351   6.366
  819    H    THR 111           HN       THR 111   4.928   5.811   9.341
  820    HA   THR 111           HA       THR 111   6.282   3.489   8.218
  821    HB   THR 111           HB       THR 111   4.784   3.400  10.836
  822    HG1  THR 111           HG1      THR 111   7.481   3.956  10.250
  823   HG21  THR 111          HG21      THR 111   4.961   1.286   9.598
  824   HG22  THR 111          HG22      THR 111   5.910   1.248  11.083
  825   HG23  THR 111          HG23      THR 111   6.715   1.485   9.533
  826    H    ALA 112           HN       ALA 112   5.026   2.648   6.726
  827    HA   ALA 112           HA       ALA 112   2.133   3.117   6.954
  828    HB1  ALA 112           HB1      ALA 112   2.056   3.175   4.525
  829    HB2  ALA 112           HB2      ALA 112   3.790   2.858   4.443
  830    HB3  ALA 112           HB3      ALA 112   3.205   4.374   5.128
  831    H    MET 113           HN       MET 113   0.817   1.430   6.848
  832    HA   MET 113           HA       MET 113   1.995  -1.224   6.391
  833    HB2  MET 113           HB2      MET 113   0.713  -1.284   8.373
  834    HB3  MET 113           HB1      MET 113  -0.541  -0.248   7.705
  835    HG2  MET 113           HG2      MET 113  -1.212  -2.085   6.199
  836    HG3  MET 113           HG1      MET 113  -0.002  -3.115   6.959
  837    HE1  MET 113           HE1      MET 113  -0.508  -4.618   8.904
  838    HE2  MET 113           HE2      MET 113  -1.401  -4.047  10.315
  839    HE3  MET 113           HE3      MET 113   0.022  -3.166   9.755
  840    H    VAL 114           HN       VAL 114   1.833  -1.966   4.397
  841    HA   VAL 114           HA       VAL 114  -0.298  -0.865   2.670
  842    HB   VAL 114           HB       VAL 114   2.191  -2.168   1.648
  843   HG11  VAL 114          HG11      VAL 114   0.424  -1.747   0.048
  844   HG12  VAL 114          HG12      VAL 114   1.834  -0.742  -0.295
  845   HG13  VAL 114          HG13      VAL 114   0.419  -0.039   0.493
  846   HG21  VAL 114          HG21      VAL 114   1.950   0.723   2.402
  847   HG22  VAL 114          HG22      VAL 114   3.312  -0.014   1.557
  848   HG23  VAL 114          HG23      VAL 114   2.941  -0.483   3.217
  849    H    THR 115           HN       THR 115  -1.756  -2.277   1.909
  850    HA   THR 115           HA       THR 115  -0.956  -5.095   1.977
  851    HB   THR 115           HB       THR 115  -3.742  -3.936   1.802
  852    HG1  THR 115           HG1      THR 115  -2.115  -4.525   3.861
  853   HG21  THR 115          HG21      THR 115  -3.466  -6.044   0.565
  854   HG22  THR 115          HG22      THR 115  -4.475  -6.248   1.998
  855   HG23  THR 115          HG23      THR 115  -2.794  -6.785   2.020
  856    H    ALA 116           HN       ALA 116  -0.214  -5.766   0.227
  857    HA   ALA 116           HA       ALA 116  -1.169  -4.709  -2.364
  858    HB1  ALA 116           HB1      ALA 116   1.650  -5.389  -1.549
  859    HB2  ALA 116           HB2      ALA 116   1.007  -3.779  -1.865
  860    HB3  ALA 116           HB3      ALA 116   1.135  -4.948  -3.177
  861    H    ASP 117           HN       ASP 117  -1.776  -6.230  -3.748
  862    HA   ASP 117           HA       ASP 117  -1.992  -8.912  -3.183
  863    HB2  ASP 117           HB2      ASP 117  -2.975  -7.598  -5.175
  864    HB3  ASP 117           HB1      ASP 117  -1.441  -7.930  -5.951
  865    H    SER 118           HN       SER 118  -0.703 -10.706  -3.595
  866    HA   SER 118           HA       SER 118   2.014 -10.504  -3.223
  867    HB2  SER 118           HB2      SER 118   0.371 -12.550  -3.136
  868    HB3  SER 118           HB1      SER 118   0.889 -12.785  -4.807
  869    HG   SER 118           HG       SER 118   2.130 -13.915  -3.141
  870    H    LYS 119           HN       LYS 119   0.178 -10.355  -6.198
  871    HA   LYS 119           HA       LYS 119   2.218 -10.688  -8.054
  872    HB2  LYS 119           HB2      LYS 119   0.835  -9.178  -9.507
  873    HB3  LYS 119           HB1      LYS 119   0.004 -10.586  -8.860
  874    HG2  LYS 119           HG2      LYS 119  -1.060  -9.168  -7.185
  875    HG3  LYS 119           HG1      LYS 119  -0.151  -7.781  -7.794
  876    HD2  LYS 119           HD2      LYS 119  -2.433  -7.809  -8.651
  877    HD3  LYS 119           HD1      LYS 119  -1.260  -7.988  -9.953
  878    HE2  LYS 119           HE2      LYS 119  -2.997  -9.533 -10.385
  879    HE3  LYS 119           HE1      LYS 119  -1.630 -10.469  -9.792
  880    HZ1  LYS 119           HZ1      LYS 119  -3.595 -11.266  -8.753
  881    HZ2  LYS 119           HZ2      LYS 119  -4.073  -9.712  -8.285
  882    HZ3  LYS 119           HZ3      LYS 119  -2.713 -10.431  -7.570
  883    H    TYR 120           HN       TYR 120   1.560  -7.914  -5.968
  884    HA   TYR 120           HA       TYR 120   3.688  -6.415  -7.336
  885    HB2  TYR 120           HB2      TYR 120   1.832  -5.555  -5.104
  886    HB3  TYR 120           HB1      TYR 120   3.023  -4.524  -5.893
  887    HD1  TYR 120           HD1      TYR 120   2.666  -3.687  -8.118
  888    HD2  TYR 120           HD2      TYR 120  -0.205  -6.186  -6.219
  889    HE1  TYR 120           HE1      TYR 120   1.004  -3.087  -9.837
  890    HE2  TYR 120           HE2      TYR 120  -1.864  -5.592  -7.917
  891    HH   TYR 120           HH       TYR 120  -2.311  -3.764  -9.512
  892    H    CYS 121           HN       CYS 121   3.470  -8.727  -5.172
  893    HA   CYS 121           HA       CYS 121   5.676  -7.717  -3.519
  894    HB2  CYS 121           HB2      CYS 121   3.527  -9.698  -2.736
  895    HB3  CYS 121           HB1      CYS 121   4.842  -9.154  -1.706
  896    HG   CYS 121           HG       CYS 121   1.865  -7.850  -2.090
  897    H    TYR 122           HN       TYR 122   4.485 -11.043  -3.471
  898    HA   TYR 122           HA       TYR 122   6.702 -11.865  -5.204
  899    HB2  TYR 122           HB2      TYR 122   6.252 -13.279  -2.582
  900    HB3  TYR 122           HB1      TYR 122   7.616 -13.397  -3.675
  901    HD1  TYR 122           HD2      TYR 122   9.357 -11.689  -3.703
  902    HD2  TYR 122           HD1      TYR 122   6.122 -11.482  -0.951
  903    HE1  TYR 122           HE2      TYR 122  10.607 -10.055  -2.358
  904    HE2  TYR 122           HE1      TYR 122   7.361  -9.851   0.394
  905    HH   TYR 122           HH       TYR 122   9.655  -9.145   0.794
  906    H    GLY 123           HN       GLY 123   3.944 -11.896  -5.876
  907    HA2  GLY 123           HA2      GLY 123   2.469 -14.140  -5.382
  908    HA3  GLY 123           HA1      GLY 123   2.493 -13.329  -6.935
  909    HA   PRO 124           HA       PRO 124   4.455 -17.068  -8.432
  910    HB2  PRO 124           HB2      PRO 124   5.191 -15.821 -10.892
  911    HB3  PRO 124           HB1      PRO 124   3.791 -16.846 -10.582
  912    HG2  PRO 124           HG2      PRO 124   3.667 -14.151 -11.202
  913    HG3  PRO 124           HG1      PRO 124   2.384 -15.071 -10.401
  914    HD2  PRO 124           HD2      PRO 124   4.440 -13.259  -9.209
  915    HD3  PRO 124           HD1      PRO 124   2.733 -13.477  -8.766
  916    H    GLN 125           HN       GLN 125   5.935 -14.663  -7.134
  917    HA   GLN 125           HA       GLN 125   8.578 -15.013  -8.370
  918    HB2  GLN 125           HB2      GLN 125   7.726 -12.893  -6.392
  919    HB3  GLN 125           HB1      GLN 125   9.169 -12.904  -7.398
  920    HG2  GLN 125           HG2      GLN 125   7.885 -12.559  -9.375
  921    HG3  GLN 125           HG1      GLN 125   6.374 -12.789  -8.501
  922   HE21  GLN 125          HE21      GLN 125   5.639 -11.166  -7.136
  923   HE22  GLN 125          HE22      GLN 125   6.245  -9.555  -7.203
  924    H    GLY 126           HN       GLY 126   6.811 -14.950  -5.337
  925    HA2  GLY 126           HA2      GLY 126   7.134 -16.048  -3.379
  926    HA3  GLY 126           HA1      GLY 126   8.474 -16.910  -4.114
  927    H    SER 127           HN       SER 127   8.126 -15.636  -1.493
  928    HA   SER 127           HA       SER 127   9.958 -13.433  -1.589
  929    HB2  SER 127           HB2      SER 127   8.083 -12.989  -0.218
  930    HB3  SER 127           HB1      SER 127   8.189 -14.553   0.567
  931    HG   SER 127           HG       SER 127   8.993 -12.963   1.944
  932    H    ARG 128           HN       ARG 128  11.709 -13.276   0.015
  933    HA   ARG 128           HA       ARG 128  13.651 -15.150  -0.583
  934    HB2  ARG 128           HB2      ARG 128  13.766 -13.542   1.953
  935    HB3  ARG 128           HB1      ARG 128  15.082 -13.992   0.880
  936    HG2  ARG 128           HG2      ARG 128  14.283 -12.419  -0.792
  937    HG3  ARG 128           HG1      ARG 128  12.911 -12.003   0.244
  938    HD2  ARG 128           HD2      ARG 128  14.713 -11.459   2.007
  939    HD3  ARG 128           HD1      ARG 128  15.826 -11.420   0.639
  940    HE   ARG 128           HE       ARG 128  13.901  -9.760  -0.185
  941   HH11  ARG 128          HH11      ARG 128  15.628 -10.002   2.836
  942   HH12  ARG 128          HH12      ARG 128  15.461  -8.315   3.228
  943   HH21  ARG 128          HH21      ARG 128  13.667  -7.507   0.343
  944   HH22  ARG 128          HH22      ARG 128  14.341  -6.915   1.837
  945    H    SER 129           HN       SER 129  12.072 -14.690   2.576
  946    HA   SER 129           HA       SER 129  13.085 -17.163   3.554
  947    HB2  SER 129           HB2      SER 129  10.959 -15.348   4.707
  948    HB3  SER 129           HB1      SER 129  11.718 -16.702   5.548
  949    HG   SER 129           HG       SER 129  13.764 -15.513   4.983
  950    HA   PRO 130           HA       PRO 130   8.982 -18.999   2.403
  951    HB2  PRO 130           HB2      PRO 130   6.674 -17.516   2.647
  952    HB3  PRO 130           HB1      PRO 130   7.451 -18.344   3.993
  953    HG2  PRO 130           HG2      PRO 130   7.155 -15.538   3.648
  954    HG3  PRO 130           HG1      PRO 130   8.073 -16.369   4.917
  955    HD2  PRO 130           HD2      PRO 130   9.025 -15.217   2.324
  956    HD3  PRO 130           HD1      PRO 130   9.844 -15.285   3.892
  957    H    TYR 131           HN       TYR 131   8.897 -19.367   0.175
  958    HA   TYR 131           HA       TYR 131   8.278 -17.504  -1.785
  959    HB2  TYR 131           HB2      TYR 131   9.038 -19.801  -2.293
  960    HB3  TYR 131           HB1      TYR 131   7.496 -20.438  -1.731
  961    HD1  TYR 131           HD1      TYR 131   5.399 -19.833  -3.024
  962    HD2  TYR 131           HD2      TYR 131   9.308 -19.031  -4.499
  963    HE1  TYR 131           HE1      TYR 131   4.486 -19.595  -5.294
  964    HE2  TYR 131           HE2      TYR 131   8.404 -18.783  -6.771
  965    HH   TYR 131           HH       TYR 131   6.436 -19.512  -8.069
  966    H    ILE 132           HN       ILE 132   6.702 -16.100  -1.316
  967    HA   ILE 132           HA       ILE 132   4.338 -16.710   0.070
  968    HB   ILE 132           HB       ILE 132   4.799 -14.376  -1.783
  969   HG12  ILE 132          HG12      ILE 132   6.608 -14.368  -0.222
  970   HG13  ILE 132          HG11      ILE 132   5.467 -13.117   0.255
  971   HG21  ILE 132          HG21      ILE 132   3.134 -13.246  -0.412
  972   HG22  ILE 132          HG22      ILE 132   2.982 -14.685   0.599
  973   HG23  ILE 132          HG23      ILE 132   2.476 -14.734  -1.092
  974   HD11  ILE 132          HD11      ILE 132   5.696 -15.829   1.499
  975   HD12  ILE 132          HD12      ILE 132   4.608 -14.531   2.003
  976   HD13  ILE 132          HD13      ILE 132   6.360 -14.329   2.138
  977    HA   PRO 133           HA       PRO 133   1.950 -18.716  -3.127
  978    HB2  PRO 133           HB2      PRO 133  -0.330 -17.454  -1.687
  979    HB3  PRO 133           HB1      PRO 133  -0.074 -19.146  -2.129
  980    HG2  PRO 133           HG2      PRO 133   0.229 -18.322   0.390
  981    HG3  PRO 133           HG1      PRO 133   1.296 -19.552  -0.310
  982    HD2  PRO 133           HD2      PRO 133   1.825 -16.670   0.234
  983    HD3  PRO 133           HD1      PRO 133   2.920 -18.063   0.349
  984    HA   PRO 134           HA       PRO 134   1.341 -15.478  -6.090
  985    HB2  PRO 134           HB2      PRO 134  -0.614 -17.381  -7.266
  986    HB3  PRO 134           HB1      PRO 134   0.761 -16.562  -8.018
  987    HG2  PRO 134           HG2      PRO 134   0.880 -19.160  -7.393
  988    HG3  PRO 134           HG1      PRO 134   2.289 -18.101  -7.197
  989    HD2  PRO 134           HD2      PRO 134   0.412 -19.166  -5.128
  990    HD3  PRO 134           HD1      PRO 134   2.167 -18.907  -5.033
  991    H    HIS 135           HN       HIS 135   0.007 -13.847  -6.330
  992    HA   HIS 135           HA       HIS 135  -1.579 -12.355  -5.778
  993    HB2  HIS 135           HB2      HIS 135  -3.813 -12.831  -6.580
  994    HB3  HIS 135           HB1      HIS 135  -2.600 -13.393  -7.710
  995    HD1  HIS 135           HD1      HIS 135  -5.297 -14.614  -5.410
  996    HD2  HIS 135           HD2      HIS 135  -2.607 -16.127  -8.202
  997    HE1  HIS 135           HE1      HIS 135  -6.045 -16.969  -5.875
  998    HE2  HIS 135           HE2      HIS 135  -4.537 -17.771  -7.730
  999    H    ALA 136           HN       ALA 136  -0.750 -14.106  -3.558
 1000    HA   ALA 136           HA       ALA 136  -3.079 -13.968  -1.822
 1001    HB1  ALA 136           HB1      ALA 136  -0.184 -14.568  -1.177
 1002    HB2  ALA 136           HB2      ALA 136  -1.462 -15.757  -1.432
 1003    HB3  ALA 136           HB3      ALA 136  -1.529 -14.676  -0.041
 1004    H    ALA 137           HN       ALA 137  -3.454 -12.300  -0.349
 1005    HA   ALA 137           HA       ALA 137  -2.241  -9.830  -1.222
 1006    HB1  ALA 137           HB1      ALA 137  -3.880  -8.747   0.287
 1007    HB2  ALA 137           HB2      ALA 137  -4.417 -10.341   0.805
 1008    HB3  ALA 137           HB3      ALA 137  -4.623  -9.849  -0.871
 1009    H    LEU 138           HN       LEU 138  -0.415  -9.133  -0.411
 1010    HA   LEU 138           HA       LEU 138   0.529 -10.104   2.160
 1011    HB2  LEU 138           HB2      LEU 138   1.744  -9.528  -0.273
 1012    HB3  LEU 138           HB1      LEU 138   2.253  -8.219   0.773
 1013    HG   LEU 138           HG       LEU 138   3.181  -9.797   2.362
 1014   HD11  LEU 138          HD11      LEU 138   2.243 -11.914   0.453
 1015   HD12  LEU 138          HD12      LEU 138   1.575 -11.588   2.051
 1016   HD13  LEU 138          HD13      LEU 138   3.229 -12.181   1.889
 1017   HD21  LEU 138          HD21      LEU 138   4.997 -10.685   1.008
 1018   HD22  LEU 138          HD22      LEU 138   4.595  -9.035   0.532
 1019   HD23  LEU 138          HD23      LEU 138   4.053 -10.392  -0.455
 1020    H    CYS 139           HN       CYS 139   0.599  -8.864   3.972
 1021    HA   CYS 139           HA       CYS 139  -0.037  -5.996   3.671
 1022    HB2  CYS 139           HB2      CYS 139  -1.700  -7.564   4.879
 1023    HB3  CYS 139           HB1      CYS 139  -0.500  -7.617   6.159
 1024    HG   CYS 139           HG       CYS 139  -2.726  -5.270   5.445
 1025    H    LEU 140           HN       LEU 140   1.879  -5.012   3.747
 1026    HA   LEU 140           HA       LEU 140   3.859  -6.007   5.684
 1027    HB2  LEU 140           HB2      LEU 140   5.543  -5.036   4.127
 1028    HB3  LEU 140           HB1      LEU 140   4.658  -6.415   3.503
 1029    HG   LEU 140           HG       LEU 140   3.172  -4.270   2.626
 1030   HD11  LEU 140          HD11      LEU 140   4.805  -2.739   1.622
 1031   HD12  LEU 140          HD12      LEU 140   6.107  -3.606   2.442
 1032   HD13  LEU 140          HD13      LEU 140   4.900  -2.733   3.384
 1033   HD21  LEU 140          HD21      LEU 140   4.086  -4.826   0.430
 1034   HD22  LEU 140          HD22      LEU 140   3.747  -6.286   1.360
 1035   HD23  LEU 140          HD23      LEU 140   5.407  -5.710   1.193
 1036    H    GLU 141           HN       GLU 141   4.835  -4.650   7.035
 1037    HA   GLU 141           HA       GLU 141   3.814  -1.900   7.106
 1038    HB2  GLU 141           HB2      GLU 141   3.295  -3.323   9.022
 1039    HB3  GLU 141           HB1      GLU 141   4.996  -3.683   9.239
 1040    HG2  GLU 141           HG2      GLU 141   5.420  -1.343   9.807
 1041    HG3  GLU 141           HG1      GLU 141   3.693  -0.999   9.606
 1042    H    VAL 142           HN       VAL 142   5.222  -0.459   6.259
 1043    HA   VAL 142           HA       VAL 142   8.075  -1.113   6.448
 1044    HB   VAL 142           HB       VAL 142   8.269   0.420   4.392
 1045   HG11  VAL 142          HG11      VAL 142   7.848  -1.466   2.901
 1046   HG12  VAL 142          HG12      VAL 142   6.931  -2.274   4.174
 1047   HG13  VAL 142          HG13      VAL 142   8.662  -1.989   4.374
 1048   HG21  VAL 142          HG21      VAL 142   5.343  -0.305   4.218
 1049   HG22  VAL 142          HG22      VAL 142   6.298   0.450   2.944
 1050   HG23  VAL 142          HG23      VAL 142   5.992   1.321   4.447
 1051    H    THR 143           HN       THR 143   9.115   0.039   7.820
 1052    HA   THR 143           HA       THR 143   8.504   2.821   8.420
 1053    HB   THR 143           HB       THR 143  11.017   1.408   9.303
 1054    HG1  THR 143           HG1      THR 143   9.012   1.005  11.084
 1055   HG21  THR 143          HG21      THR 143  10.721   3.712   9.971
 1056   HG22  THR 143          HG22      THR 143  10.536   2.675  11.388
 1057   HG23  THR 143          HG23      THR 143   9.111   3.364  10.607
 1058    H    LEU 144           HN       LEU 144   9.074   4.219   6.817
 1059    HA   LEU 144           HA       LEU 144  11.610   3.938   5.434
 1060    HB2  LEU 144           HB2      LEU 144   9.663   4.921   4.296
 1061    HB3  LEU 144           HB1      LEU 144   9.593   6.197   5.494
 1062    HG   LEU 144           HG       LEU 144  11.781   7.025   4.710
 1063   HD11  LEU 144          HD11      LEU 144  12.717   4.940   3.874
 1064   HD12  LEU 144          HD12      LEU 144  12.709   6.167   2.607
 1065   HD13  LEU 144          HD13      LEU 144  11.495   4.888   2.600
 1066   HD21  LEU 144          HD21      LEU 144   9.712   7.946   3.816
 1067   HD22  LEU 144          HD22      LEU 144   9.690   6.707   2.562
 1068   HD23  LEU 144          HD23      LEU 144  10.971   7.918   2.581
 1069    H    LYS 145           HN       LYS 145  13.223   4.038   6.880
 1070    HA   LYS 145           HA       LYS 145  13.053   5.965   9.055
 1071    HB2  LYS 145           HB2      LYS 145  15.291   4.006   8.606
 1072    HB3  LYS 145           HB1      LYS 145  14.749   4.723  10.115
 1073    HG2  LYS 145           HG2      LYS 145  12.730   3.406  10.067
 1074    HG3  LYS 145           HG1      LYS 145  13.179   2.739   8.497
 1075    HD2  LYS 145           HD2      LYS 145  14.736   2.388  11.057
 1076    HD3  LYS 145           HD1      LYS 145  13.682   1.173  10.315
 1077    HE2  LYS 145           HE2      LYS 145  15.067   0.944   8.458
 1078    HE3  LYS 145           HE1      LYS 145  15.971   2.417   8.820
 1079    HZ1  LYS 145           HZ1      LYS 145  16.159  -0.235  10.113
 1080    HZ2  LYS 145           HZ2      LYS 145  16.637   1.156  10.953
 1081    HZ3  LYS 145           HZ3      LYS 145  17.409   0.745   9.503
 1082    H    THR 146           HN       THR 146  14.849   5.384   6.121
 1083    HA   THR 146           HA       THR 146  16.180   7.941   6.461
 1084    HB   THR 146           HB       THR 146  17.802   5.500   5.761
 1085    HG1  THR 146           HG1      THR 146  17.069   6.520   8.273
 1086   HG21  THR 146          HG21      THR 146  18.629   8.238   6.756
 1087   HG22  THR 146          HG22      THR 146  18.708   7.688   5.079
 1088   HG23  THR 146          HG23      THR 146  19.708   6.915   6.312
 1089    H    ALA 147           HN       ALA 147  16.898   8.860   4.542
 1090    HA   ALA 147           HA       ALA 147  16.679   7.288   2.091
 1091    HB1  ALA 147           HB1      ALA 147  14.586   8.565   2.285
 1092    HB2  ALA 147           HB2      ALA 147  15.568   9.140   0.936
 1093    HB3  ALA 147           HB3      ALA 147  15.519  10.055   2.443
 1094    H    VAL 148           HN       VAL 148  18.482   7.542   0.855
 1095    HA   VAL 148           HA       VAL 148  20.028  10.011   1.270
 1096    HB   VAL 148           HB       VAL 148  22.142   8.838   1.323
 1097   HG11  VAL 148          HG11      VAL 148  20.188   7.675   3.303
 1098   HG12  VAL 148          HG12      VAL 148  21.078   9.190   3.465
 1099   HG13  VAL 148          HG13      VAL 148  21.946   7.656   3.474
 1100   HG21  VAL 148          HG21      VAL 148  21.608   6.934  -0.084
 1101   HG22  VAL 148          HG22      VAL 148  20.539   6.292   1.163
 1102   HG23  VAL 148          HG23      VAL 148  22.275   6.392   1.456
 1103    H    ASP 149           HN       ASP 149  21.247  10.698  -0.504
 1104    HA   ASP 149           HA       ASP 149  20.036   9.780  -2.996
 1105    HB2  ASP 149           HB2      ASP 149  19.846  12.127  -2.651
 1106    HB3  ASP 149           HB1      ASP 149  21.552  12.278  -2.234
 1107    H    LEU 150           HN       LEU 150  21.113   8.467  -4.307
 1108    HA   LEU 150           HA       LEU 150  24.040   8.481  -4.317
 1109    HB2  LEU 150           HB2      LEU 150  23.084   6.797  -2.631
 1110    HB3  LEU 150           HB1      LEU 150  22.477   5.915  -4.017
 1111    HG   LEU 150           HG       LEU 150  24.847   5.749  -4.848
 1112   HD11  LEU 150          HD11      LEU 150  25.505   6.716  -2.064
 1113   HD12  LEU 150          HD12      LEU 150  25.748   7.634  -3.551
 1114   HD13  LEU 150          HD13      LEU 150  26.649   6.144  -3.278
 1115   HD21  LEU 150          HD21      LEU 150  23.737   3.892  -3.734
 1116   HD22  LEU 150          HD22      LEU 150  24.228   4.521  -2.163
 1117   HD23  LEU 150          HD23      LEU 150  25.446   3.948  -3.302
 1118    H    GLU 151           HN       GLU 151  21.492   8.954  -6.052
 1119    HA   GLU 151           HA       GLU 151  22.236   7.172  -8.273
 1120    HB2  GLU 151           HB2      GLU 151  19.997   6.740  -7.326
 1121    HB3  GLU 151           HB1      GLU 151  19.544   8.402  -7.658
 1122    HG2  GLU 151           HG2      GLU 151  18.728   6.620  -9.260
 1123    HG3  GLU 151           HG1      GLU 151  19.512   8.054  -9.955
 1124    H    HIS 152           HN       HIS 152  23.490   8.335  -9.566
 1125    HA   HIS 152           HA       HIS 152  22.474  10.870 -10.613
 1126    HB2  HIS 152           HB2      HIS 152  25.341  10.561  -9.686
 1127    HB3  HIS 152           HB1      HIS 152  24.588  12.011 -10.330
 1128    HD1  HIS 152           HD1      HIS 152  25.133  10.108  -7.226
 1129    HD2  HIS 152           HD2      HIS 152  22.800  13.314  -8.492
 1130    HE1  HIS 152           HE1      HIS 152  24.330  11.236  -5.125
 1131    HE2  HIS 152           HE2      HIS 152  22.734  13.011  -5.915
 1132    H    HIS 153           HN       HIS 153  22.967   7.973 -11.501
 1133    HA   HIS 153           HA       HIS 153  24.928   8.529 -13.638
 1134    HB2  HIS 153           HB2      HIS 153  25.404   6.106 -13.713
 1135    HB3  HIS 153           HB1      HIS 153  25.773   6.796 -12.141
 1136    HD1  HIS 153           HD1      HIS 153  23.260   4.564 -13.843
 1137    HD2  HIS 153           HD2      HIS 153  24.414   5.672 -10.021
 1138    HE1  HIS 153           HE1      HIS 153  22.021   3.028 -12.308
 1139    HE2  HIS 153           HE2      HIS 153  22.465   3.974 -10.023
 1140    H    HIS 154           HN       HIS 154  24.502   7.903 -15.715
 1141    HA   HIS 154           HA       HIS 154  23.279   7.509 -17.570
 1142    HB2  HIS 154           HB2      HIS 154  21.822   5.743 -15.634
 1143    HB3  HIS 154           HB1      HIS 154  21.194   5.977 -17.257
 1144    HD1  HIS 154           HD1      HIS 154  22.295   3.255 -16.052
 1145    HD2  HIS 154           HD2      HIS 154  24.303   5.823 -18.640
 1146    HE1  HIS 154           HE1      HIS 154  24.003   1.836 -17.235
 1147    HE2  HIS 154           HE2      HIS 154  25.013   3.360 -18.967
 1148    H    HIS 155           HN       HIS 155  20.729   7.414 -18.230
 1149    HA   HIS 155           HA       HIS 155  18.952   9.130 -16.867
 1150    HB2  HIS 155           HB2      HIS 155  18.919  11.022 -18.433
 1151    HB3  HIS 155           HB1      HIS 155  20.494  10.896 -17.664
 1152    HD1  HIS 155           HD1      HIS 155  22.432  11.030 -19.214
 1153    HD2  HIS 155           HD2      HIS 155  18.958   9.847 -21.169
 1154    HE1  HIS 155           HE1      HIS 155  23.033  10.898 -21.648
 1155    HE2  HIS 155           HE2      HIS 155  20.867  10.373 -22.832
 1156    H    HIS 156           HN       HIS 156  16.981   9.551 -18.356
 1157    HA   HIS 156           HA       HIS 156  16.939   7.799 -20.676
 1158    HB2  HIS 156           HB2      HIS 156  15.110   6.439 -20.033
 1159    HB3  HIS 156           HB1      HIS 156  16.247   6.387 -18.697
 1160    HD1  HIS 156           HD1      HIS 156  15.353   7.009 -16.413
 1161    HD2  HIS 156           HD2      HIS 156  12.760   8.018 -19.513
 1162    HE1  HIS 156           HE1      HIS 156  13.194   7.692 -15.305
 1163    HE2  HIS 156           HE2      HIS 156  11.586   8.088 -17.211
 1164    H    HIS 157           HN       HIS 157  15.447   8.323 -22.205
 1165    HA   HIS 157           HA       HIS 157  13.441  10.337 -21.686
 1166    HB2  HIS 157           HB2      HIS 157  15.534  11.647 -22.117
 1167    HB3  HIS 157           HB1      HIS 157  15.658  10.870 -23.689
 1168    HD1  HIS 157           HD1      HIS 157  14.015  11.629 -25.527
 1169    HD2  HIS 157           HD2      HIS 157  13.620  13.691 -21.938
 1170    HE1  HIS 157           HE1      HIS 157  12.608  13.644 -26.057
 1171    HE2  HIS 157           HE2      HIS 157  12.264  14.804 -23.848
  Start of MODEL    2
    1    H1   MET   1           HT1      MET   1 -32.207   2.867 -43.420
    2    H2   MET   1           HT2      MET   1 -31.369   3.998 -44.361
    3    H3   MET   1           HT3      MET   1 -33.002   3.687 -44.673
    4    HA   MET   1           HA       MET   1 -31.851   4.976 -42.272
    5    HB2  MET   1           HB2      MET   1 -33.709   6.034 -44.417
    6    HB3  MET   1           HB1      MET   1 -33.232   6.912 -42.975
    7    HG2  MET   1           HG2      MET   1 -31.924   7.739 -44.760
    8    HG3  MET   1           HG1      MET   1 -30.862   6.750 -43.761
    9    HE1  MET   1           HE1      MET   1 -30.174   7.714 -46.729
   10    HE2  MET   1           HE2      MET   1 -29.496   6.244 -47.427
   11    HE3  MET   1           HE3      MET   1 -29.071   6.710 -45.783
   12    H    GLY   2           HN       GLY   2 -32.856   4.304 -40.520
   13    HA2  GLY   2           HA2      GLY   2 -35.752   3.732 -40.682
   14    HA3  GLY   2           HA1      GLY   2 -34.659   3.026 -39.494
   15    H    GLN   3           HN       GLN   3 -33.296   5.669 -39.266
   16    HA   GLN   3           HA       GLN   3 -35.312   7.061 -37.631
   17    HB2  GLN   3           HB2      GLN   3 -33.542   5.928 -36.312
   18    HB3  GLN   3           HB1      GLN   3 -32.326   6.855 -37.174
   19    HG2  GLN   3           HG2      GLN   3 -32.762   7.761 -34.958
   20    HG3  GLN   3           HG1      GLN   3 -33.173   8.912 -36.230
   21   HE21  GLN   3          HE21      GLN   3 -35.292   9.450 -36.575
   22   HE22  GLN   3          HE22      GLN   3 -36.557   9.075 -35.454
   23    HA   PRO   4           HA       PRO   4 -34.092   9.773 -41.172
   24    HB2  PRO   4           HB2      PRO   4 -36.748  10.925 -40.565
   25    HB3  PRO   4           HB1      PRO   4 -36.068  10.402 -42.110
   26    HG2  PRO   4           HG2      PRO   4 -37.934   8.951 -40.867
   27    HG3  PRO   4           HG1      PRO   4 -36.595   8.172 -41.731
   28    HD2  PRO   4           HD2      PRO   4 -36.959   8.602 -38.790
   29    HD3  PRO   4           HD1      PRO   4 -36.334   7.180 -39.652
   30    HA   PRO   5           HA       PRO   5 -34.567  13.767 -38.608
   31    HB2  PRO   5           HB2      PRO   5 -35.738  13.120 -36.017
   32    HB3  PRO   5           HB1      PRO   5 -36.254  14.320 -37.204
   33    HG2  PRO   5           HG2      PRO   5 -37.682  12.084 -36.675
   34    HG3  PRO   5           HG1      PRO   5 -37.659  12.852 -38.274
   35    HD2  PRO   5           HD2      PRO   5 -36.150  10.450 -37.299
   36    HD3  PRO   5           HD1      PRO   5 -36.971  10.711 -38.854
   37    H    ALA   6           HN       ALA   6 -32.549  14.171 -38.031
   38    HA   ALA   6           HA       ALA   6 -31.113  12.455 -36.190
   39    HB1  ALA   6           HB1      ALA   6 -30.244  14.980 -37.608
   40    HB2  ALA   6           HB2      ALA   6 -29.986  13.331 -38.184
   41    HB3  ALA   6           HB3      ALA   6 -29.192  13.887 -36.708
   42    H    GLU   7           HN       GLU   7 -33.327  14.709 -35.730
   43    HA   GLU   7           HA       GLU   7 -32.039  16.428 -33.813
   44    HB2  GLU   7           HB2      GLU   7 -34.965  16.173 -34.529
   45    HB3  GLU   7           HB1      GLU   7 -34.220  17.493 -33.634
   46    HG2  GLU   7           HG2      GLU   7 -32.937  18.142 -35.571
   47    HG3  GLU   7           HG1      GLU   7 -33.558  16.765 -36.477
   48    H    GLU   8           HN       GLU   8 -33.330  13.335 -33.681
   49    HA   GLU   8           HA       GLU   8 -34.314  13.551 -30.952
   50    HB2  GLU   8           HB2      GLU   8 -34.216  11.344 -32.981
   51    HB3  GLU   8           HB1      GLU   8 -34.449  10.951 -31.284
   52    HG2  GLU   8           HG2      GLU   8 -36.429  12.433 -31.260
   53    HG3  GLU   8           HG1      GLU   8 -36.210  12.701 -32.987
   54    H    ALA   9           HN       ALA   9 -31.456  14.015 -31.755
   55    HA   ALA   9           HA       ALA   9 -30.306  12.624 -29.511
   56    HB1  ALA   9           HB1      ALA   9 -29.156  12.147 -32.268
   57    HB2  ALA   9           HB2      ALA   9 -30.025  10.953 -31.302
   58    HB3  ALA   9           HB3      ALA   9 -28.474  11.580 -30.741
   59    H    GLU  10           HN       GLU  10 -28.907  13.924 -28.533
   60    HA   GLU  10           HA       GLU  10 -27.224  15.707 -30.041
   61    HB2  GLU  10           HB2      GLU  10 -27.833  17.681 -28.582
   62    HB3  GLU  10           HB1      GLU  10 -29.025  17.238 -29.796
   63    HG2  GLU  10           HG2      GLU  10 -30.506  16.414 -28.217
   64    HG3  GLU  10           HG1      GLU  10 -29.248  16.214 -26.998
   65    H    GLN  11           HN       GLN  11 -25.311  15.296 -29.266
   66    HA   GLN  11           HA       GLN  11 -24.876  15.275 -26.413
   67    HB2  GLN  11           HB2      GLN  11 -23.745  13.121 -26.369
   68    HB3  GLN  11           HB1      GLN  11 -25.413  12.940 -26.867
   69    HG2  GLN  11           HG2      GLN  11 -22.981  12.802 -28.636
   70    HG3  GLN  11           HG1      GLN  11 -23.992  11.460 -28.120
   71   HE21  GLN  11          HE21      GLN  11 -23.616  14.087 -30.311
   72   HE22  GLN  11          HE22      GLN  11 -24.982  13.722 -31.317
   73    HA   PRO  12           HA       PRO  12 -21.451  17.289 -28.580
   74    HB2  PRO  12           HB2      PRO  12 -21.590  19.415 -26.675
   75    HB3  PRO  12           HB1      PRO  12 -22.083  19.447 -28.369
   76    HG2  PRO  12           HG2      PRO  12 -23.803  19.641 -26.201
   77    HG3  PRO  12           HG1      PRO  12 -24.278  19.185 -27.846
   78    HD2  PRO  12           HD2      PRO  12 -23.776  17.447 -25.464
   79    HD3  PRO  12           HD1      PRO  12 -24.979  17.269 -26.762
   80    H    GLY  13           HN       GLY  13 -21.446  18.329 -25.192
   81    HA2  GLY  13           HA2      GLY  13 -19.353  16.407 -24.519
   82    HA3  GLY  13           HA1      GLY  13 -18.882  18.101 -24.541
   83    H    ALA  14           HN       ALA  14 -21.724  16.320 -23.371
   84    HA   ALA  14           HA       ALA  14 -21.880  18.038 -21.051
   85    HB1  ALA  14           HB1      ALA  14 -23.909  17.354 -22.257
   86    HB2  ALA  14           HB2      ALA  14 -23.950  16.853 -20.566
   87    HB3  ALA  14           HB3      ALA  14 -23.589  15.673 -21.827
   88    H    LEU  15           HN       LEU  15 -19.544  16.324 -21.217
   89    HA   LEU  15           HA       LEU  15 -20.003  14.323 -19.138
   90    HB2  LEU  15           HB2      LEU  15 -17.622  14.896 -20.900
   91    HB3  LEU  15           HB1      LEU  15 -17.555  13.773 -19.558
   92    HG   LEU  15           HG       LEU  15 -19.438  12.499 -20.691
   93   HD11  LEU  15          HD11      LEU  15 -19.692  12.824 -23.102
   94   HD12  LEU  15          HD12      LEU  15 -18.641  14.238 -23.024
   95   HD13  LEU  15          HD13      LEU  15 -20.198  14.249 -22.200
   96   HD21  LEU  15          HD21      LEU  15 -17.141  11.716 -20.667
   97   HD22  LEU  15          HD22      LEU  15 -16.762  12.712 -22.070
   98   HD23  LEU  15          HD23      LEU  15 -17.889  11.364 -22.225
   99    H    ALA  16           HN       ALA  16 -20.103  15.257 -17.193
  100    HA   ALA  16           HA       ALA  16 -18.056  17.235 -16.459
  101    HB1  ALA  16           HB1      ALA  16 -20.391  17.871 -16.000
  102    HB2  ALA  16           HB2      ALA  16 -19.471  17.711 -14.503
  103    HB3  ALA  16           HB3      ALA  16 -20.583  16.434 -14.995
  104    H    ARG  17           HN       ARG  17 -16.269  16.203 -15.848
  105    HA   ARG  17           HA       ARG  17 -16.459  14.207 -13.716
  106    HB2  ARG  17           HB2      ARG  17 -14.736  12.832 -14.869
  107    HB3  ARG  17           HB1      ARG  17 -16.271  12.887 -15.726
  108    HG2  ARG  17           HG2      ARG  17 -15.389  14.477 -17.303
  109    HG3  ARG  17           HG1      ARG  17 -13.879  14.583 -16.393
  110    HD2  ARG  17           HD2      ARG  17 -13.671  13.147 -18.365
  111    HD3  ARG  17           HD1      ARG  17 -13.393  12.263 -16.867
  112    HE   ARG  17           HE       ARG  17 -16.070  11.910 -17.458
  113   HH11  ARG  17          HH11      ARG  17 -13.003  11.192 -18.980
  114   HH12  ARG  17          HH12      ARG  17 -13.602   9.803 -19.836
  115   HH21  ARG  17          HH21      ARG  17 -16.874  10.090 -18.583
  116   HH22  ARG  17          HH22      ARG  17 -15.813   9.191 -19.628
  117    H    GLU  18           HN       GLU  18 -13.800  13.590 -13.499
  118    HA   GLU  18           HA       GLU  18 -12.720  15.936 -12.275
  119    HB2  GLU  18           HB2      GLU  18 -12.416  13.737 -11.278
  120    HB3  GLU  18           HB1      GLU  18 -11.571  13.174 -12.710
  121    HG2  GLU  18           HG2      GLU  18  -9.762  14.744 -12.271
  122    HG3  GLU  18           HG1      GLU  18 -10.609  15.327 -10.838
  123    H    PHE  19           HN       PHE  19 -11.600  17.454 -13.274
  124    HA   PHE  19           HA       PHE  19 -10.071  16.726 -15.681
  125    HB2  PHE  19           HB2      PHE  19 -10.470  18.997 -16.519
  126    HB3  PHE  19           HB1      PHE  19 -11.996  18.168 -16.221
  127    HD1  PHE  19           HD1      PHE  19 -13.402  18.806 -14.315
  128    HD2  PHE  19           HD2      PHE  19  -9.832  20.921 -15.261
  129    HE1  PHE  19           HE1      PHE  19 -14.155  20.689 -12.920
  130    HE2  PHE  19           HE2      PHE  19 -10.576  22.802 -13.865
  131    HZ   PHE  19           HZ       PHE  19 -12.695  22.637 -12.606
  132    H    LEU  20           HN       LEU  20  -9.752  17.523 -12.530
  133    HA   LEU  20           HA       LEU  20  -7.267  19.018 -12.984
  134    HB2  LEU  20           HB2      LEU  20  -7.655  20.314 -10.977
  135    HB3  LEU  20           HB1      LEU  20  -8.985  20.526 -12.095
  136    HG   LEU  20           HG       LEU  20  -9.152  18.612  -9.783
  137   HD11  LEU  20          HD11      LEU  20  -8.615  20.802  -8.877
  138   HD12  LEU  20          HD12      LEU  20 -10.297  20.393  -8.543
  139   HD13  LEU  20          HD13      LEU  20  -9.905  21.532  -9.833
  140   HD21  LEU  20          HD21      LEU  20 -11.543  18.879 -10.072
  141   HD22  LEU  20          HD22      LEU  20 -10.808  18.377 -11.596
  142   HD23  LEU  20          HD23      LEU  20 -11.279  20.059 -11.357
  143    H    ALA  21           HN       ALA  21  -5.729  18.826 -11.151
  144    HA   ALA  21           HA       ALA  21  -5.635  16.007 -10.368
  145    HB1  ALA  21           HB1      ALA  21  -3.503  18.144 -10.293
  146    HB2  ALA  21           HB2      ALA  21  -3.706  16.934 -11.561
  147    HB3  ALA  21           HB3      ALA  21  -3.259  16.436  -9.926
  148    H    ALA  22           HN       ALA  22  -5.959  19.182  -9.051
  149    HA   ALA  22           HA       ALA  22  -6.541  19.960  -7.006
  150    HB1  ALA  22           HB1      ALA  22  -6.635  17.088  -6.085
  151    HB2  ALA  22           HB2      ALA  22  -7.983  17.966  -6.807
  152    HB3  ALA  22           HB3      ALA  22  -7.321  18.487  -5.258
  153    H    MET  23           HN       MET  23  -5.532  20.651  -5.156
  154    HA   MET  23           HA       MET  23  -2.704  19.902  -4.977
  155    HB2  MET  23           HB2      MET  23  -4.217  22.261  -3.844
  156    HB3  MET  23           HB1      MET  23  -2.504  21.962  -3.577
  157    HG2  MET  23           HG2      MET  23  -3.815  22.432  -6.245
  158    HG3  MET  23           HG1      MET  23  -2.885  23.614  -5.328
  159    HE1  MET  23           HE1      MET  23  -1.332  24.048  -7.481
  160    HE2  MET  23           HE2      MET  23  -2.313  22.881  -8.365
  161    HE3  MET  23           HE3      MET  23  -0.552  22.747  -8.380
  162    H    GLU  24           HN       GLU  24  -5.532  20.393  -2.918
  163    HA   GLU  24           HA       GLU  24  -4.739  18.180  -1.249
  164    HB2  GLU  24           HB2      GLU  24  -3.504  20.067  -0.221
  165    HB3  GLU  24           HB1      GLU  24  -5.017  20.939  -0.031
  166    HG2  GLU  24           HG2      GLU  24  -5.844  19.255   1.493
  167    HG3  GLU  24           HG1      GLU  24  -4.386  18.293   1.259
  168    HA   PRO  25           HA       PRO  25  -9.209  18.255  -1.700
  169    HB2  PRO  25           HB2      PRO  25  -9.071  15.496  -0.783
  170    HB3  PRO  25           HB1      PRO  25  -9.570  16.120  -2.356
  171    HG2  PRO  25           HG2      PRO  25  -7.279  14.714  -1.980
  172    HG3  PRO  25           HG1      PRO  25  -7.459  15.951  -3.236
  173    HD2  PRO  25           HD2      PRO  25  -6.127  16.144  -0.563
  174    HD3  PRO  25           HD1      PRO  25  -5.612  16.810  -2.128
  175    H    GLU  26           HN       GLU  26 -10.732  18.690  -0.226
  176    HA   GLU  26           HA       GLU  26 -10.058  18.625   2.568
  177    HB2  GLU  26           HB2      GLU  26 -12.606  19.457   1.159
  178    HB3  GLU  26           HB1      GLU  26 -12.284  19.678   2.875
  179    HG2  GLU  26           HG2      GLU  26 -10.378  21.114   2.320
  180    HG3  GLU  26           HG1      GLU  26 -10.741  20.914   0.608
  181    HA   PRO  27           HA       PRO  27 -11.483  14.573   3.391
  182    HB2  PRO  27           HB2      PRO  27 -12.051  15.562   6.123
  183    HB3  PRO  27           HB1      PRO  27 -10.969  14.273   5.588
  184    HG2  PRO  27           HG2      PRO  27 -10.005  16.605   6.453
  185    HG3  PRO  27           HG1      PRO  27  -9.241  15.734   5.110
  186    HD2  PRO  27           HD2      PRO  27 -11.069  18.109   5.036
  187    HD3  PRO  27           HD1      PRO  27  -9.610  17.779   4.076
  188    H    ALA  28           HN       ALA  28 -13.381  14.019   2.528
  189    HA   ALA  28           HA       ALA  28 -15.821  14.887   3.932
  190    HB1  ALA  28           HB1      ALA  28 -15.775  15.752   1.655
  191    HB2  ALA  28           HB2      ALA  28 -17.034  14.533   1.831
  192    HB3  ALA  28           HB3      ALA  28 -15.518  14.129   1.026
  193    HA   PRO  29           HA       PRO  29 -15.987  10.598   5.095
  194    HB2  PRO  29           HB2      PRO  29 -18.805  11.182   5.745
  195    HB3  PRO  29           HB1      PRO  29 -17.503  10.626   6.800
  196    HG2  PRO  29           HG2      PRO  29 -18.447  13.125   6.954
  197    HG3  PRO  29           HG1      PRO  29 -16.724  12.769   7.186
  198    HD2  PRO  29           HD2      PRO  29 -18.123  13.870   4.773
  199    HD3  PRO  29           HD1      PRO  29 -16.569  14.350   5.492
  200    H    ALA  30           HN       ALA  30 -16.314   8.904   3.823
  201    HA   ALA  30           HA       ALA  30 -18.783   8.261   2.626
  202    HB1  ALA  30           HB1      ALA  30 -18.224   8.415   0.271
  203    HB2  ALA  30           HB2      ALA  30 -16.657   9.118   0.668
  204    HB3  ALA  30           HB3      ALA  30 -18.137  10.009   1.024
  205    HA   PRO  31           HA       PRO  31 -15.645   4.857   1.524
  206    HB2  PRO  31           HB2      PRO  31 -13.005   5.220   1.673
  207    HB3  PRO  31           HB1      PRO  31 -13.932   5.807   0.286
  208    HG2  PRO  31           HG2      PRO  31 -12.925   7.312   2.665
  209    HG3  PRO  31           HG1      PRO  31 -12.905   7.781   0.955
  210    HD2  PRO  31           HD2      PRO  31 -14.784   8.646   2.775
  211    HD3  PRO  31           HD1      PRO  31 -15.060   8.551   1.025
  212    H    ALA  32           HN       ALA  32 -14.292   3.265   2.698
  213    HA   ALA  32           HA       ALA  32 -14.665   3.554   5.561
  214    HB1  ALA  32           HB1      ALA  32 -15.379   1.487   4.461
  215    HB2  ALA  32           HB2      ALA  32 -14.119   1.170   5.656
  216    HB3  ALA  32           HB3      ALA  32 -13.721   1.191   3.939
  217    HA   PRO  33           HA       PRO  33 -10.491   4.668   6.525
  218    HB2  PRO  33           HB2      PRO  33 -10.766   2.900   8.891
  219    HB3  PRO  33           HB1      PRO  33 -10.401   4.626   8.815
  220    HG2  PRO  33           HG2      PRO  33 -12.796   3.785   9.617
  221    HG3  PRO  33           HG1      PRO  33 -12.633   5.221   8.583
  222    HD2  PRO  33           HD2      PRO  33 -13.431   2.430   7.835
  223    HD3  PRO  33           HD1      PRO  33 -14.118   3.979   7.299
  224    H    GLU  34           HN       GLU  34 -11.427   1.345   6.219
  225    HA   GLU  34           HA       GLU  34  -8.638   0.480   6.202
  226    HB2  GLU  34           HB2      GLU  34 -11.229  -1.053   6.175
  227    HB3  GLU  34           HB1      GLU  34  -9.668  -1.824   5.918
  228    HG2  GLU  34           HG2      GLU  34 -10.382  -0.206   8.352
  229    HG3  GLU  34           HG1      GLU  34 -10.503  -1.960   8.252
  230    H    GLU  35           HN       GLU  35 -10.749   1.797   4.081
  231    HA   GLU  35           HA       GLU  35  -9.495   0.466   1.790
  232    HB2  GLU  35           HB2      GLU  35 -12.009   1.873   2.187
  233    HB3  GLU  35           HB1      GLU  35 -11.099   2.551   0.844
  234    HG2  GLU  35           HG2      GLU  35 -12.583   0.880   0.003
  235    HG3  GLU  35           HG1      GLU  35 -10.930   0.289  -0.130
  236    H    TRP  36           HN       TRP  36  -7.426   1.286   2.371
  237    HA   TRP  36           HA       TRP  36  -6.996   4.068   2.809
  238    HB2  TRP  36           HB2      TRP  36  -4.732   2.333   1.964
  239    HB3  TRP  36           HB1      TRP  36  -4.804   3.531   3.244
  240    HD1  TRP  36           HD1      TRP  36  -7.163   2.252   4.989
  241    HE1  TRP  36           HE1      TRP  36  -6.742   0.050   6.271
  242    HE3  TRP  36           HE3      TRP  36  -3.137   0.551   2.330
  243    HZ2  TRP  36           HZ2      TRP  36  -4.877  -2.102   6.165
  244    HZ3  TRP  36           HZ3      TRP  36  -2.107  -1.553   2.994
  245    HH2  TRP  36           HH2      TRP  36  -2.949  -2.860   4.848
  246    H    LEU  37           HN       LEU  37  -4.909   4.887   1.448
  247    HA   LEU  37           HA       LEU  37  -5.957   5.537  -1.112
  248    HB2  LEU  37           HB2      LEU  37  -4.443   6.976   0.277
  249    HB3  LEU  37           HB1      LEU  37  -3.132   5.892  -0.106
  250    HG   LEU  37           HG       LEU  37  -3.429   6.419  -2.510
  251   HD11  LEU  37          HD11      LEU  37  -5.365   8.486  -1.473
  252   HD12  LEU  37          HD12      LEU  37  -5.771   7.081  -2.455
  253   HD13  LEU  37          HD13      LEU  37  -4.774   8.367  -3.129
  254   HD21  LEU  37          HD21      LEU  37  -2.429   8.646  -2.385
  255   HD22  LEU  37          HD22      LEU  37  -1.749   7.563  -1.169
  256   HD23  LEU  37          HD23      LEU  37  -2.936   8.782  -0.702
  257    H    ASP  38           HN       ASP  38  -6.069   3.998  -2.649
  258    HA   ASP  38           HA       ASP  38  -4.066   1.979  -2.905
  259    HB2  ASP  38           HB2      ASP  38  -6.477   1.717  -3.668
  260    HB3  ASP  38           HB1      ASP  38  -6.032   2.707  -5.057
  261    H    ILE  39           HN       ILE  39  -2.290   1.991  -3.990
  262    HA   ILE  39           HA       ILE  39  -1.157   4.431  -4.818
  263    HB   ILE  39           HB       ILE  39  -0.181   1.621  -5.326
  264   HG12  ILE  39          HG12      ILE  39   0.008   3.444  -2.936
  265   HG13  ILE  39          HG11      ILE  39  -0.535   1.778  -3.002
  266   HG21  ILE  39          HG21      ILE  39   1.345   4.214  -5.201
  267   HG22  ILE  39          HG22      ILE  39   0.979   3.297  -6.663
  268   HG23  ILE  39          HG23      ILE  39   2.037   2.608  -5.431
  269   HD11  ILE  39          HD11      ILE  39   1.734   1.022  -3.396
  270   HD12  ILE  39          HD12      ILE  39   1.633   1.982  -1.920
  271   HD13  ILE  39          HD13      ILE  39   2.307   2.692  -3.385
  272    H    LEU  40           HN       LEU  40  -2.923   1.978  -6.473
  273    HA   LEU  40           HA       LEU  40  -2.384   3.338  -9.028
  274    HB2  LEU  40           HB2      LEU  40  -3.349   0.514  -8.603
  275    HB3  LEU  40           HB1      LEU  40  -2.970   1.263 -10.143
  276    HG   LEU  40           HG       LEU  40  -0.985   0.639  -7.945
  277   HD11  LEU  40          HD11      LEU  40  -1.434  -0.613 -10.651
  278   HD12  LEU  40          HD12      LEU  40  -1.784  -1.349  -9.087
  279   HD13  LEU  40          HD13      LEU  40  -0.117  -0.999  -9.545
  280   HD21  LEU  40          HD21      LEU  40  -0.379   2.658  -9.192
  281   HD22  LEU  40          HD22      LEU  40  -0.551   1.775 -10.711
  282   HD23  LEU  40          HD23      LEU  40   0.713   1.322  -9.564
  283    H    GLY  41           HN       GLY  41  -4.537   3.026  -6.593
  284    HA2  GLY  41           HA2      GLY  41  -6.747   3.577  -6.328
  285    HA3  GLY  41           HA1      GLY  41  -6.734   4.162  -7.978
  286    H    ASN  42           HN       ASN  42  -5.732   0.902  -7.469
  287    HA   ASN  42           HA       ASN  42  -8.181   0.084  -8.852
  288    HB2  ASN  42           HB2      ASN  42  -7.052  -1.786  -9.738
  289    HB3  ASN  42           HB1      ASN  42  -5.984  -0.415  -9.928
  290   HD21  ASN  42          HD21      ASN  42  -5.008  -0.534  -7.129
  291   HD22  ASN  42          HD22      ASN  42  -3.981  -1.918  -7.087
  292    H    GLY  43           HN       GLY  43  -6.393  -0.633  -5.893
  293    HA2  GLY  43           HA2      GLY  43  -7.919  -1.087  -4.003
  294    HA3  GLY  43           HA1      GLY  43  -8.786  -2.181  -5.069
  295    H    LEU  44           HN       LEU  44  -5.637  -2.512  -5.803
  296    HA   LEU  44           HA       LEU  44  -5.429  -4.983  -4.242
  297    HB2  LEU  44           HB2      LEU  44  -4.101  -4.009  -6.766
  298    HB3  LEU  44           HB1      LEU  44  -3.521  -5.416  -5.900
  299    HG   LEU  44           HG       LEU  44  -5.656  -6.535  -6.278
  300   HD11  LEU  44          HD11      LEU  44  -6.430  -4.158  -7.946
  301   HD12  LEU  44          HD12      LEU  44  -7.076  -4.516  -6.347
  302   HD13  LEU  44          HD13      LEU  44  -7.377  -5.626  -7.687
  303   HD21  LEU  44          HD21      LEU  44  -3.884  -6.865  -7.875
  304   HD22  LEU  44          HD22      LEU  44  -4.381  -5.423  -8.761
  305   HD23  LEU  44          HD23      LEU  44  -5.439  -6.835  -8.710
  306    H    LEU  45           HN       LEU  45  -3.856  -1.957  -4.856
  307    HA   LEU  45           HA       LEU  45  -1.655  -2.663  -3.042
  308    HB2  LEU  45           HB2      LEU  45  -0.771  -2.680  -5.213
  309    HB3  LEU  45           HB1      LEU  45  -1.666  -1.252  -5.684
  310    HG   LEU  45           HG       LEU  45  -0.235   0.146  -4.319
  311   HD11  LEU  45          HD11      LEU  45   1.203  -2.406  -3.616
  312   HD12  LEU  45          HD12      LEU  45   0.183  -1.465  -2.527
  313   HD13  LEU  45          HD13      LEU  45   1.682  -0.774  -3.149
  314   HD21  LEU  45          HD21      LEU  45   1.357  -1.760  -6.021
  315   HD22  LEU  45          HD22      LEU  45   1.776  -0.090  -5.625
  316   HD23  LEU  45          HD23      LEU  45   0.366  -0.432  -6.631
  317    H    ARG  46           HN       ARG  46  -2.153  -1.544  -1.192
  318    HA   ARG  46           HA       ARG  46  -2.876   1.311  -1.492
  319    HB2  ARG  46           HB2      ARG  46  -4.214  -0.588   0.432
  320    HB3  ARG  46           HB1      ARG  46  -4.657   1.082   0.094
  321    HG2  ARG  46           HG2      ARG  46  -5.263   0.457  -2.193
  322    HG3  ARG  46           HG1      ARG  46  -4.823  -1.215  -1.843
  323    HD2  ARG  46           HD2      ARG  46  -6.977   0.356  -0.442
  324    HD3  ARG  46           HD1      ARG  46  -7.237  -0.868  -1.689
  325    HE   ARG  46           HE       ARG  46  -5.719  -2.064   0.299
  326   HH11  ARG  46          HH11      ARG  46  -8.876  -0.652  -0.068
  327   HH12  ARG  46          HH12      ARG  46  -9.622  -1.615   1.170
  328   HH21  ARG  46          HH21      ARG  46  -6.688  -3.392   1.934
  329   HH22  ARG  46          HH22      ARG  46  -8.365  -3.168   2.312
  330    H    LYS  47           HN       LYS  47  -2.093   2.666   0.075
  331    HA   LYS  47           HA       LYS  47  -0.239   1.461   2.033
  332    HB2  LYS  47           HB2      LYS  47   0.577   3.007   0.105
  333    HB3  LYS  47           HB1      LYS  47  -0.133   4.303   1.054
  334    HG2  LYS  47           HG2      LYS  47   1.317   3.303   2.977
  335    HG3  LYS  47           HG1      LYS  47   2.239   2.610   1.642
  336    HD2  LYS  47           HD2      LYS  47   3.289   4.646   2.097
  337    HD3  LYS  47           HD1      LYS  47   2.299   4.959   0.677
  338    HE2  LYS  47           HE2      LYS  47   0.781   6.244   1.820
  339    HE3  LYS  47           HE1      LYS  47   1.110   5.459   3.362
  340    HZ1  LYS  47           HZ1      LYS  47   1.913   7.778   3.222
  341    HZ2  LYS  47           HZ2      LYS  47   2.995   7.316   2.011
  342    HZ3  LYS  47           HZ3      LYS  47   3.145   6.671   3.577
  343    H    LYS  48           HN       LYS  48  -0.853   1.633   4.116
  344    HA   LYS  48           HA       LYS  48  -2.685   3.803   4.892
  345    HB2  LYS  48           HB2      LYS  48  -3.368   1.521   5.547
  346    HB3  LYS  48           HB1      LYS  48  -1.861   1.329   6.433
  347    HG2  LYS  48           HG2      LYS  48  -2.762   3.564   7.604
  348    HG3  LYS  48           HG1      LYS  48  -4.305   2.845   7.143
  349    HD2  LYS  48           HD2      LYS  48  -2.155   1.406   8.697
  350    HD3  LYS  48           HD1      LYS  48  -3.518   2.240   9.440
  351    HE2  LYS  48           HE2      LYS  48  -3.878   0.090   7.392
  352    HE3  LYS  48           HE1      LYS  48  -3.714  -0.276   9.106
  353    HZ1  LYS  48           HZ1      LYS  48  -6.057  -0.065   8.267
  354    HZ2  LYS  48           HZ2      LYS  48  -5.764   1.591   8.058
  355    HZ3  LYS  48           HZ3      LYS  48  -5.671   0.904   9.601
  356    H    THR  49           HN       THR  49  -1.772   5.555   5.739
  357    HA   THR  49           HA       THR  49   0.882   5.539   6.822
  358    HB   THR  49           HB       THR  49   0.088   7.928   7.542
  359    HG1  THR  49           HG1      THR  49  -1.786   8.578   6.691
  360   HG21  THR  49          HG21      THR  49   0.535   8.756   5.261
  361   HG22  THR  49          HG22      THR  49   0.375   7.110   4.647
  362   HG23  THR  49          HG23      THR  49   1.685   7.513   5.757
  363    H    LEU  50           HN       LEU  50   0.929   4.190   8.602
  364    HA   LEU  50           HA       LEU  50  -0.873   4.270  10.786
  365    HB2  LEU  50           HB2      LEU  50   2.093   3.757  11.039
  366    HB3  LEU  50           HB1      LEU  50   0.792   3.077  11.997
  367    HG   LEU  50           HG       LEU  50   1.117   2.448   9.077
  368   HD11  LEU  50          HD11      LEU  50   2.291   0.986  11.438
  369   HD12  LEU  50          HD12      LEU  50   3.184   1.841  10.178
  370   HD13  LEU  50          HD13      LEU  50   2.257   0.394   9.777
  371   HD21  LEU  50          HD21      LEU  50  -1.049   1.962  10.035
  372   HD22  LEU  50          HD22      LEU  50  -0.292   1.085  11.363
  373   HD23  LEU  50          HD23      LEU  50  -0.181   0.457   9.719
  374    H    VAL  51           HN       VAL  51   2.270   5.657  10.189
  375    HA   VAL  51           HA       VAL  51   1.529   8.201  11.458
  376    HB   VAL  51           HB       VAL  51   4.216   6.848  11.733
  377   HG11  VAL  51          HG11      VAL  51   4.403   9.257  11.550
  378   HG12  VAL  51          HG12      VAL  51   4.784   8.742  13.194
  379   HG13  VAL  51          HG13      VAL  51   3.216   9.470  12.839
  380   HG21  VAL  51          HG21      VAL  51   3.695   6.825  14.173
  381   HG22  VAL  51          HG22      VAL  51   2.671   5.763  13.205
  382   HG23  VAL  51          HG23      VAL  51   2.049   7.316  13.766
  383    HA   PRO  52           HA       PRO  52   3.582   9.105   7.579
  384    HB2  PRO  52           HB2      PRO  52   2.140  11.209   6.911
  385    HB3  PRO  52           HB1      PRO  52   1.412   9.599   7.048
  386    HG2  PRO  52           HG2      PRO  52   1.182  11.926   8.889
  387    HG3  PRO  52           HG1      PRO  52   0.007  10.647   8.547
  388    HD2  PRO  52           HD2      PRO  52   1.914  10.795  10.704
  389    HD3  PRO  52           HD1      PRO  52   0.722   9.516  10.380
  390    H    GLY  53           HN       GLY  53   5.338   9.616   9.420
  391    HA2  GLY  53           HA2      GLY  53   7.238  10.866   9.667
  392    HA3  GLY  53           HA1      GLY  53   6.640  11.903   8.386
  393    HA   PRO  54           HA       PRO  54   6.253  14.414  12.236
  394    HB2  PRO  54           HB2      PRO  54   8.557  15.783  12.214
  395    HB3  PRO  54           HB1      PRO  54   8.452  14.181  12.950
  396    HG2  PRO  54           HG2      PRO  54   9.678  15.002  10.381
  397    HG3  PRO  54           HG1      PRO  54  10.122  13.676  11.465
  398    HD2  PRO  54           HD2      PRO  54   8.583  13.504   9.091
  399    HD3  PRO  54           HD1      PRO  54   8.864  12.219  10.281
  400    HA   PRO  55           HA       PRO  55   4.937  17.917   9.819
  401    HB2  PRO  55           HB2      PRO  55   6.086  19.735  11.851
  402    HB3  PRO  55           HB1      PRO  55   4.418  19.592  11.286
  403    HG2  PRO  55           HG2      PRO  55   5.148  18.706  13.705
  404    HG3  PRO  55           HG1      PRO  55   3.944  17.843  12.729
  405    HD2  PRO  55           HD2      PRO  55   6.826  17.193  13.189
  406    HD3  PRO  55           HD1      PRO  55   5.429  16.103  13.080
  407    H    GLY  56           HN       GLY  56   6.188  18.052   8.020
  408    HA2  GLY  56           HA2      GLY  56   7.601  19.531   6.766
  409    HA3  GLY  56           HA1      GLY  56   8.579  19.769   8.207
  410    H    SER  57           HN       SER  57   7.409  16.730   6.824
  411    HA   SER  57           HA       SER  57  10.070  15.648   6.816
  412    HB2  SER  57           HB2      SER  57   8.662  13.688   5.779
  413    HB3  SER  57           HB1      SER  57   8.510  14.065   7.490
  414    HG   SER  57           HG       SER  57   6.672  14.315   5.439
  415    H    SER  58           HN       SER  58   9.976  13.987   4.600
  416    HA   SER  58           HA       SER  58   9.421  15.560   2.241
  417    HB2  SER  58           HB2      SER  58  11.758  16.205   3.003
  418    HB3  SER  58           HB1      SER  58  12.233  14.532   2.713
  419    HG   SER  58           HG       SER  58  12.295  16.422   0.988
  420    H    ARG  59           HN       ARG  59   8.880  14.240   0.577
  421    HA   ARG  59           HA       ARG  59   8.962  11.376   1.092
  422    HB2  ARG  59           HB2      ARG  59   7.581  12.915  -1.125
  423    HB3  ARG  59           HB1      ARG  59   7.358  11.205  -0.738
  424    HG2  ARG  59           HG2      ARG  59   6.507  11.854   1.481
  425    HG3  ARG  59           HG1      ARG  59   6.664  13.544   1.025
  426    HD2  ARG  59           HD2      ARG  59   4.989  13.298  -0.682
  427    HD3  ARG  59           HD1      ARG  59   4.927  11.550  -0.423
  428    HE   ARG  59           HE       ARG  59   4.343  12.443   2.021
  429   HH11  ARG  59          HH11      ARG  59   3.018  13.408  -1.087
  430   HH12  ARG  59          HH12      ARG  59   1.500  13.902  -0.419
  431   HH21  ARG  59          HH21      ARG  59   2.379  13.046   2.878
  432   HH22  ARG  59          HH22      ARG  59   1.116  13.688   1.866
  433    HA   PRO  60           HA       PRO  60  12.883  11.215  -1.014
  434    HB2  PRO  60           HB2      PRO  60  12.608   8.436  -1.406
  435    HB3  PRO  60           HB1      PRO  60  13.462   9.248  -0.093
  436    HG2  PRO  60           HG2      PRO  60  10.697   8.143  -0.153
  437    HG3  PRO  60           HG1      PRO  60  11.864   8.196   1.183
  438    HD2  PRO  60           HD2      PRO  60   9.800   9.869   1.148
  439    HD3  PRO  60           HD1      PRO  60  11.409  10.435   1.648
  440    H    VAL  61           HN       VAL  61  13.585  11.195  -3.062
  441    HA   VAL  61           HA       VAL  61  11.580  10.831  -5.153
  442    HB   VAL  61           HB       VAL  61  14.449  11.707  -5.514
  443   HG11  VAL  61          HG11      VAL  61  13.592  12.794  -7.536
  444   HG12  VAL  61          HG12      VAL  61  11.987  12.148  -7.198
  445   HG13  VAL  61          HG13      VAL  61  13.321  11.053  -7.559
  446   HG21  VAL  61          HG21      VAL  61  13.468  13.203  -3.900
  447   HG22  VAL  61          HG22      VAL  61  12.040  13.416  -4.911
  448   HG23  VAL  61          HG23      VAL  61  13.601  14.032  -5.451
  449    H    LYS  62           HN       LYS  62  11.987   9.494  -6.999
  450    HA   LYS  62           HA       LYS  62  13.082   6.978  -6.342
  451    HB2  LYS  62           HB2      LYS  62  11.937   8.098  -8.879
  452    HB3  LYS  62           HB1      LYS  62  12.620   6.476  -8.799
  453    HG2  LYS  62           HG2      LYS  62  11.056   6.015  -6.900
  454    HG3  LYS  62           HG1      LYS  62  10.278   7.558  -7.257
  455    HD2  LYS  62           HD2      LYS  62   9.455   6.813  -9.290
  456    HD3  LYS  62           HD1      LYS  62  10.656   5.523  -9.416
  457    HE2  LYS  62           HE2      LYS  62   9.556   4.421  -7.460
  458    HE3  LYS  62           HE1      LYS  62   8.287   5.641  -7.553
  459    HZ1  LYS  62           HZ1      LYS  62   7.527   4.821  -9.558
  460    HZ2  LYS  62           HZ2      LYS  62   7.937   3.405  -8.709
  461    HZ3  LYS  62           HZ3      LYS  62   8.975   4.006  -9.901
  462    H    GLY  63           HN       GLY  63  15.028   6.373  -6.356
  463    HA2  GLY  63           HA2      GLY  63  17.052   6.206  -7.889
  464    HA3  GLY  63           HA1      GLY  63  17.016   7.966  -7.815
  465    H    GLN  64           HN       GLN  64  16.049   7.920  -5.023
  466    HA   GLN  64           HA       GLN  64  18.627   7.737  -3.740
  467    HB2  GLN  64           HB2      GLN  64  16.148   7.870  -2.093
  468    HB3  GLN  64           HB1      GLN  64  17.684   8.704  -1.881
  469    HG2  GLN  64           HG2      GLN  64  15.532   9.405  -3.861
  470    HG3  GLN  64           HG1      GLN  64  15.865  10.234  -2.348
  471   HE21  GLN  64          HE21      GLN  64  18.285   9.115  -4.671
  472   HE22  GLN  64          HE22      GLN  64  18.881  10.700  -5.052
  473    H    VAL  65           HN       VAL  65  19.385   6.122  -2.416
  474    HA   VAL  65           HA       VAL  65  17.742   3.732  -2.235
  475    HB   VAL  65           HB       VAL  65  19.601   2.573  -1.312
  476   HG11  VAL  65          HG11      VAL  65  20.620   4.430  -3.451
  477   HG12  VAL  65          HG12      VAL  65  19.729   2.929  -3.704
  478   HG13  VAL  65          HG13      VAL  65  21.343   2.886  -2.993
  479   HG21  VAL  65          HG21      VAL  65  21.725   3.662  -0.725
  480   HG22  VAL  65          HG22      VAL  65  20.380   4.178   0.296
  481   HG23  VAL  65          HG23      VAL  65  20.971   5.235  -0.992
  482    H    VAL  66           HN       VAL  66  16.574   3.243  -0.504
  483    HA   VAL  66           HA       VAL  66  16.763   5.089   1.786
  484    HB   VAL  66           HB       VAL  66  14.330   4.981   2.010
  485   HG11  VAL  66          HG11      VAL  66  15.244   6.805   0.683
  486   HG12  VAL  66          HG12      VAL  66  13.698   6.288   0.022
  487   HG13  VAL  66          HG13      VAL  66  15.200   5.803  -0.763
  488   HG21  VAL  66          HG21      VAL  66  13.973   2.775   1.028
  489   HG22  VAL  66          HG22      VAL  66  14.380   3.419  -0.565
  490   HG23  VAL  66          HG23      VAL  66  12.940   3.991   0.275
  491    H    THR  67           HN       THR  67  16.393   4.271   3.800
  492    HA   THR  67           HA       THR  67  16.573   1.365   3.973
  493    HB   THR  67           HB       THR  67  17.033   1.825   6.399
  494    HG1  THR  67           HG1      THR  67  16.061   3.937   6.409
  495   HG21  THR  67          HG21      THR  67  18.883   3.175   4.440
  496   HG22  THR  67          HG22      THR  67  18.850   1.448   4.799
  497   HG23  THR  67          HG23      THR  67  19.309   2.604   6.051
  498    H    VAL  68           HN       VAL  68  14.696   0.381   4.035
  499    HA   VAL  68           HA       VAL  68  12.585   1.576   5.671
  500    HB   VAL  68           HB       VAL  68  11.056  -0.080   4.442
  501   HG11  VAL  68          HG11      VAL  68  11.042   2.347   4.040
  502   HG12  VAL  68          HG12      VAL  68  10.751   1.440   2.557
  503   HG13  VAL  68          HG13      VAL  68  12.335   2.153   2.857
  504   HG21  VAL  68          HG21      VAL  68  12.766  -1.497   3.484
  505   HG22  VAL  68          HG22      VAL  68  13.426  -0.132   2.583
  506   HG23  VAL  68          HG23      VAL  68  11.815  -0.742   2.204
  507    H    HIS  69           HN       HIS  69  11.665   0.378   7.319
  508    HA   HIS  69           HA       HIS  69  12.875  -2.261   7.776
  509    HB2  HIS  69           HB2      HIS  69  12.958  -0.809   9.750
  510    HB3  HIS  69           HB1      HIS  69  11.230  -0.501   9.632
  511    HD1  HIS  69           HD1      HIS  69  12.505  -1.797  12.237
  512    HD2  HIS  69           HD2      HIS  69  10.693  -3.869   9.121
  513    HE1  HIS  69           HE1      HIS  69  11.813  -4.050  13.168
  514    HE2  HIS  69           HE2      HIS  69  10.591  -5.175  11.332
  515    H    LEU  70           HN       LEU  70  11.748  -3.894   6.912
  516    HA   LEU  70           HA       LEU  70   8.848  -3.517   6.846
  517    HB2  LEU  70           HB2      LEU  70   8.622  -4.382   4.802
  518    HB3  LEU  70           HB1      LEU  70  10.267  -3.803   4.619
  519    HG   LEU  70           HG       LEU  70   9.610  -6.625   5.433
  520   HD11  LEU  70          HD11      LEU  70   8.576  -6.226   3.276
  521   HD12  LEU  70          HD12      LEU  70  10.011  -7.230   3.070
  522   HD13  LEU  70          HD13      LEU  70  10.070  -5.516   2.660
  523   HD21  LEU  70          HD21      LEU  70  11.871  -7.092   4.640
  524   HD22  LEU  70          HD22      LEU  70  11.892  -5.865   5.905
  525   HD23  LEU  70          HD23      LEU  70  12.087  -5.393   4.217
  526    H    GLN  71           HN       GLN  71   7.635  -4.862   7.829
  527    HA   GLN  71           HA       GLN  71   8.490  -7.657   8.134
  528    HB2  GLN  71           HB2      GLN  71   6.610  -6.600  10.140
  529    HB3  GLN  71           HB1      GLN  71   7.853  -7.824  10.326
  530    HG2  GLN  71           HG2      GLN  71   8.766  -6.235  11.631
  531    HG3  GLN  71           HG1      GLN  71   9.436  -5.735  10.084
  532   HE21  GLN  71          HE21      GLN  71   6.704  -4.844   9.269
  533   HE22  GLN  71          HE22      GLN  71   6.547  -3.294  10.016
  534    H    THR  72           HN       THR  72   7.215  -8.755   6.976
  535    HA   THR  72           HA       THR  72   4.765  -7.473   6.054
  536    HB   THR  72           HB       THR  72   6.489  -9.572   4.783
  537    HG1  THR  72           HG1      THR  72   7.548  -7.940   3.956
  538   HG21  THR  72          HG21      THR  72   4.132  -8.051   3.727
  539   HG22  THR  72          HG22      THR  72   4.179  -9.774   4.115
  540   HG23  THR  72          HG23      THR  72   5.152  -9.138   2.784
  541    H    SER  73           HN       SER  73   2.876  -8.403   6.281
  542    HA   SER  73           HA       SER  73   2.770 -11.059   7.530
  543    HB2  SER  73           HB2      SER  73   0.388  -9.287   7.626
  544    HB3  SER  73           HB1      SER  73   1.087 -10.296   8.892
  545    HG   SER  73           HG       SER  73   1.991  -7.747   8.020
  546    H    LEU  74           HN       LEU  74   1.077 -12.429   6.845
  547    HA   LEU  74           HA       LEU  74   0.363 -12.210   4.075
  548    HB2  LEU  74           HB2      LEU  74  -0.270 -14.203   6.232
  549    HB3  LEU  74           HB1      LEU  74  -0.862 -14.363   4.596
  550    HG   LEU  74           HG       LEU  74   1.923 -14.618   5.636
  551   HD11  LEU  74          HD11      LEU  74   1.892 -16.664   4.320
  552   HD12  LEU  74          HD12      LEU  74   0.272 -16.280   3.736
  553   HD13  LEU  74          HD13      LEU  74   0.538 -16.610   5.448
  554   HD21  LEU  74          HD21      LEU  74   1.180 -14.058   2.763
  555   HD22  LEU  74          HD22      LEU  74   2.776 -14.544   3.340
  556   HD23  LEU  74          HD23      LEU  74   2.094 -12.993   3.840
  557    H    GLU  75           HN       GLU  75  -1.917 -12.465   3.382
  558    HA   GLU  75           HA       GLU  75  -3.668 -10.568   4.326
  559    HB2  GLU  75           HB2      GLU  75  -5.442 -11.931   3.146
  560    HB3  GLU  75           HB1      GLU  75  -4.037 -11.496   2.185
  561    HG2  GLU  75           HG2      GLU  75  -3.102 -13.728   2.533
  562    HG3  GLU  75           HG1      GLU  75  -4.521 -14.165   3.482
  563    H    ASN  76           HN       ASN  76  -2.947 -13.650   5.641
  564    HA   ASN  76           HA       ASN  76  -5.379 -13.793   7.239
  565    HB2  ASN  76           HB2      ASN  76  -2.992 -15.655   7.283
  566    HB3  ASN  76           HB1      ASN  76  -4.592 -15.964   7.957
  567   HD21  ASN  76          HD21      ASN  76  -2.626 -15.997   5.168
  568   HD22  ASN  76          HD22      ASN  76  -3.797 -16.629   4.067
  569    H    GLY  77           HN       GLY  77  -2.392 -12.309   7.443
  570    HA2  GLY  77           HA2      GLY  77  -1.956 -10.855   9.310
  571    HA3  GLY  77           HA1      GLY  77  -2.677 -12.060  10.366
  572    H    THR  78           HN       THR  78  -0.962 -13.904   8.409
  573    HA   THR  78           HA       THR  78   1.017 -14.416  10.388
  574    HB   THR  78           HB       THR  78   1.013 -15.576   7.614
  575    HG1  THR  78           HG1      THR  78  -0.666 -16.264   9.823
  576   HG21  THR  78          HG21      THR  78   1.824 -17.579   8.768
  577   HG22  THR  78          HG22      THR  78   1.720 -16.733  10.313
  578   HG23  THR  78          HG23      THR  78   2.868 -16.194   9.087
  579    H    ARG  79           HN       ARG  79   2.731 -13.097  10.613
  580    HA   ARG  79           HA       ARG  79   3.866 -11.704   8.371
  581    HB2  ARG  79           HB2      ARG  79   4.702 -11.952  11.247
  582    HB3  ARG  79           HB1      ARG  79   5.611 -11.023  10.056
  583    HG2  ARG  79           HG2      ARG  79   3.154 -10.043   9.623
  584    HG3  ARG  79           HG1      ARG  79   3.024 -10.452  11.338
  585    HD2  ARG  79           HD2      ARG  79   4.910  -9.103  11.885
  586    HD3  ARG  79           HD1      ARG  79   5.297  -8.850  10.179
  587    HE   ARG  79           HE       ARG  79   2.769  -7.838  10.481
  588   HH11  ARG  79          HH11      ARG  79   5.846  -7.273  12.034
  589   HH12  ARG  79          HH12      ARG  79   5.555  -5.583  12.307
  590   HH21  ARG  79          HH21      ARG  79   2.384  -5.587  10.839
  591   HH22  ARG  79          HH22      ARG  79   3.608  -4.612  11.602
  592    H    VAL  80           HN       VAL  80   5.413 -12.290   7.097
  593    HA   VAL  80           HA       VAL  80   6.498 -14.991   7.508
  594    HB   VAL  80           HB       VAL  80   6.496 -15.208   5.067
  595   HG11  VAL  80          HG11      VAL  80   4.088 -15.380   4.768
  596   HG12  VAL  80          HG12      VAL  80   3.834 -14.377   6.195
  597   HG13  VAL  80          HG13      VAL  80   4.574 -15.971   6.355
  598   HG21  VAL  80          HG21      VAL  80   5.135 -12.522   5.087
  599   HG22  VAL  80          HG22      VAL  80   5.364 -13.557   3.677
  600   HG23  VAL  80          HG23      VAL  80   6.761 -12.848   4.489
  601    H    GLN  81           HN       GLN  81   7.431 -11.793   7.301
  602    HA   GLN  81           HA       GLN  81  10.206 -12.476   7.007
  603    HB2  GLN  81           HB2      GLN  81  10.591 -10.989   5.051
  604    HB3  GLN  81           HB1      GLN  81   9.614 -12.398   4.656
  605    HG2  GLN  81           HG2      GLN  81   7.588 -10.923   4.923
  606    HG3  GLN  81           HG1      GLN  81   8.695  -9.561   5.011
  607   HE21  GLN  81          HE21      GLN  81   7.266 -11.972   3.017
  608   HE22  GLN  81          HE22      GLN  81   7.822 -11.357   1.501
  609    H    GLU  82           HN       GLU  82  11.425 -11.065   8.137
  610    HA   GLU  82           HA       GLU  82  10.358  -8.406   8.697
  611    HB2  GLU  82           HB2      GLU  82   9.637  -9.908  10.541
  612    HB3  GLU  82           HB1      GLU  82  11.323 -10.282  10.851
  613    HG2  GLU  82           HG2      GLU  82  11.791  -8.082  11.554
  614    HG3  GLU  82           HG1      GLU  82  10.240  -7.500  10.955
  615    H    GLU  83           HN       GLU  83  11.852  -7.007   8.212
  616    HA   GLU  83           HA       GLU  83  14.627  -7.547   8.934
  617    HB2  GLU  83           HB2      GLU  83  14.942  -8.058   6.727
  618    HB3  GLU  83           HB1      GLU  83  13.533  -7.148   6.207
  619    HG2  GLU  83           HG2      GLU  83  14.705  -5.141   6.121
  620    HG3  GLU  83           HG1      GLU  83  16.033  -5.764   7.108
  621    HA   PRO  84           HA       PRO  84  13.931  -3.626  10.761
  622    HB2  PRO  84           HB2      PRO  84  16.761  -3.671  11.476
  623    HB3  PRO  84           HB1      PRO  84  15.346  -3.793  12.524
  624    HG2  PRO  84           HG2      PRO  84  17.014  -5.879  12.060
  625    HG3  PRO  84           HG1      PRO  84  15.283  -6.088  12.382
  626    HD2  PRO  84           HD2      PRO  84  16.749  -6.139   9.772
  627    HD3  PRO  84           HD1      PRO  84  15.432  -7.186  10.343
  628    H    GLU  85           HN       GLU  85  16.135  -4.196   8.201
  629    HA   GLU  85           HA       GLU  85  16.013  -1.453   7.429
  630    HB2  GLU  85           HB2      GLU  85  17.818  -1.368   9.127
  631    HB3  GLU  85           HB1      GLU  85  18.728  -2.541   8.190
  632    HG2  GLU  85           HG2      GLU  85  19.179  -1.028   6.490
  633    HG3  GLU  85           HG1      GLU  85  17.855   0.040   6.962
  634    H    LEU  86           HN       LEU  86  15.396  -1.809   5.547
  635    HA   LEU  86           HA       LEU  86  16.931  -3.513   3.724
  636    HB2  LEU  86           HB2      LEU  86  14.703  -4.320   3.879
  637    HB3  LEU  86           HB1      LEU  86  14.036  -2.699   3.857
  638    HG   LEU  86           HG       LEU  86  14.731  -2.482   1.503
  639   HD11  LEU  86          HD11      LEU  86  15.472  -5.378   1.817
  640   HD12  LEU  86          HD12      LEU  86  16.576  -4.039   1.505
  641   HD13  LEU  86          HD13      LEU  86  15.391  -4.510   0.285
  642   HD21  LEU  86          HD21      LEU  86  12.456  -3.169   2.028
  643   HD22  LEU  86          HD22      LEU  86  12.968  -4.852   2.117
  644   HD23  LEU  86          HD23      LEU  86  13.025  -3.996   0.577
  645    H    VAL  87           HN       VAL  87  18.302  -2.206   2.593
  646    HA   VAL  87           HA       VAL  87  17.294   0.446   1.819
  647    HB   VAL  87           HB       VAL  87  19.424   0.405   3.091
  648   HG11  VAL  87          HG11      VAL  87  20.542  -0.992   0.673
  649   HG12  VAL  87          HG12      VAL  87  20.344  -1.686   2.281
  650   HG13  VAL  87          HG13      VAL  87  21.480  -0.362   2.028
  651   HG21  VAL  87          HG21      VAL  87  20.680   1.895   1.583
  652   HG22  VAL  87          HG22      VAL  87  18.960   2.277   1.657
  653   HG23  VAL  87          HG23      VAL  87  19.614   1.419   0.260
  654    H    PHE  88           HN       PHE  88  16.961   0.919  -0.290
  655    HA   PHE  88           HA       PHE  88  17.994  -0.827  -2.386
  656    HB2  PHE  88           HB2      PHE  88  15.834  -1.440  -3.252
  657    HB3  PHE  88           HB1      PHE  88  15.941  -1.956  -1.572
  658    HD1  PHE  88           HD2      PHE  88  14.713  -0.743   0.172
  659    HD2  PHE  88           HD1      PHE  88  14.234   0.173  -3.956
  660    HE1  PHE  88           HE2      PHE  88  12.643   0.474   0.685
  661    HE2  PHE  88           HE1      PHE  88  12.163   1.390  -3.449
  662    HZ   PHE  88           HZ       PHE  88  11.327   1.492  -1.182
  663    H    THR  89           HN       THR  89  17.598  -0.043  -4.515
  664    HA   THR  89           HA       THR  89  17.626   2.828  -4.682
  665    HB   THR  89           HB       THR  89  17.447   0.891  -6.996
  666    HG1  THR  89           HG1      THR  89  19.244   0.146  -6.057
  667   HG21  THR  89          HG21      THR  89  18.671   3.638  -6.694
  668   HG22  THR  89          HG22      THR  89  17.184   3.252  -7.558
  669   HG23  THR  89          HG23      THR  89  18.730   2.648  -8.154
  670    H    LEU  90           HN       LEU  90  15.769   3.909  -4.447
  671    HA   LEU  90           HA       LEU  90  13.178   2.906  -4.920
  672    HB2  LEU  90           HB2      LEU  90  13.907   4.947  -3.556
  673    HB3  LEU  90           HB1      LEU  90  13.948   5.803  -5.055
  674    HG   LEU  90           HG       LEU  90  11.582   5.402  -5.417
  675   HD11  LEU  90          HD11      LEU  90  11.646   4.049  -2.727
  676   HD12  LEU  90          HD12      LEU  90  11.450   3.236  -4.281
  677   HD13  LEU  90          HD13      LEU  90  10.214   4.361  -3.713
  678   HD21  LEU  90          HD21      LEU  90  10.723   6.840  -3.684
  679   HD22  LEU  90          HD22      LEU  90  12.327   7.389  -4.162
  680   HD23  LEU  90          HD23      LEU  90  12.113   6.489  -2.659
  681    H    GLY  91           HN       GLY  91  11.964   2.751  -6.747
  682    HA2  GLY  91           HA2      GLY  91  11.136   3.401  -8.822
  683    HA3  GLY  91           HA1      GLY  91  12.452   4.558  -8.965
  684    H    ASP  92           HN       ASP  92  13.685   1.623  -8.037
  685    HA   ASP  92           HA       ASP  92  14.544   1.103 -10.800
  686    HB2  ASP  92           HB2      ASP  92  16.303   1.746  -9.129
  687    HB3  ASP  92           HB1      ASP  92  15.917   0.282  -8.235
  688    H    CYS  93           HN       CYS  93  12.383   0.054  -8.633
  689    HA   CYS  93           HA       CYS  93  11.345  -1.903  -8.117
  690    HB2  CYS  93           HB2      CYS  93  12.607  -2.987 -10.647
  691    HB3  CYS  93           HB1      CYS  93  11.169  -3.597  -9.829
  692    HG   CYS  93           HG       CYS  93   9.429  -1.955 -10.857
  693    H    ASP  94           HN       ASP  94  13.880  -1.346  -7.037
  694    HA   ASP  94           HA       ASP  94  15.577  -3.640  -7.145
  695    HB2  ASP  94           HB2      ASP  94  16.018  -1.096  -6.505
  696    HB3  ASP  94           HB1      ASP  94  15.635  -1.671  -4.888
  697    H    VAL  95           HN       VAL  95  12.640  -3.107  -5.964
  698    HA   VAL  95           HA       VAL  95  12.754  -5.229  -3.949
  699    HB   VAL  95           HB       VAL  95  11.043  -3.868  -2.633
  700   HG11  VAL  95          HG11      VAL  95  13.332  -4.179  -1.866
  701   HG12  VAL  95          HG12      VAL  95  12.747  -2.557  -1.476
  702   HG13  VAL  95          HG13      VAL  95  13.845  -2.798  -2.838
  703   HG21  VAL  95          HG21      VAL  95  11.173  -1.410  -2.943
  704   HG22  VAL  95          HG22      VAL  95  10.459  -2.242  -4.324
  705   HG23  VAL  95          HG23      VAL  95  12.131  -1.674  -4.403
  706    H    ILE  96           HN       ILE  96   9.964  -4.833  -3.284
  707    HA   ILE  96           HA       ILE  96   8.698  -5.890  -5.654
  708    HB   ILE  96           HB       ILE  96   6.697  -6.105  -4.235
  709   HG12  ILE  96          HG12      ILE  96   8.436  -4.947  -2.040
  710   HG13  ILE  96          HG11      ILE  96   7.074  -4.126  -2.796
  711   HG21  ILE  96          HG21      ILE  96   9.213  -7.185  -2.971
  712   HG22  ILE  96          HG22      ILE  96   8.300  -7.921  -4.289
  713   HG23  ILE  96          HG23      ILE  96   7.581  -7.789  -2.684
  714   HD11  ILE  96          HD11      ILE  96   5.565  -5.834  -1.924
  715   HD12  ILE  96          HD12      ILE  96   6.465  -5.038  -0.637
  716   HD13  ILE  96          HD13      ILE  96   6.931  -6.653  -1.166
  717    H    GLN  97           HN       GLN  97   7.210  -4.765  -6.844
  718    HA   GLN  97           HA       GLN  97   7.738  -2.048  -7.132
  719    HB2  GLN  97           HB2      GLN  97   6.752  -3.679  -8.846
  720    HB3  GLN  97           HB1      GLN  97   5.191  -3.292  -8.129
  721    HG2  GLN  97           HG2      GLN  97   5.407  -1.853  -9.961
  722    HG3  GLN  97           HG1      GLN  97   5.757  -0.866  -8.544
  723   HE21  GLN  97          HE21      GLN  97   7.987  -0.309  -8.110
  724   HE22  GLN  97          HE22      GLN  97   9.131  -0.290  -9.404
  725    H    ALA  98           HN       ALA  98   5.246  -3.692  -5.320
  726    HA   ALA  98           HA       ALA  98   3.530  -1.615  -4.668
  727    HB1  ALA  98           HB1      ALA  98   3.162  -2.840  -2.552
  728    HB2  ALA  98           HB2      ALA  98   4.550  -3.861  -2.937
  729    HB3  ALA  98           HB3      ALA  98   3.121  -3.888  -3.968
  730    H    LEU  99           HN       LEU  99   6.570  -2.552  -3.144
  731    HA   LEU  99           HA       LEU  99   6.463  -0.513  -1.147
  732    HB2  LEU  99           HB2      LEU  99   7.693  -2.595  -0.776
  733    HB3  LEU  99           HB1      LEU  99   8.790  -2.166  -2.084
  734    HG   LEU  99           HG       LEU  99   9.592  -0.242  -0.820
  735   HD11  LEU  99          HD11      LEU  99   8.883   0.149   1.476
  736   HD12  LEU  99          HD12      LEU  99   7.707  -1.159   1.346
  737   HD13  LEU  99          HD13      LEU  99   7.524   0.293   0.360
  738   HD21  LEU  99          HD21      LEU  99  10.724  -2.367  -0.486
  739   HD22  LEU  99          HD22      LEU  99   9.608  -2.770   0.820
  740   HD23  LEU  99          HD23      LEU  99  10.721  -1.412   0.998
  741    H    ASP 100           HN       ASP 100   7.934  -0.899  -4.254
  742    HA   ASP 100           HA       ASP 100   9.789   1.208  -4.177
  743    HB2  ASP 100           HB2      ASP 100   9.890  -0.617  -5.800
  744    HB3  ASP 100           HB1      ASP 100   8.370  -0.108  -6.509
  745    H    LEU 101           HN       LEU 101   6.391   1.028  -4.879
  746    HA   LEU 101           HA       LEU 101   6.239   3.802  -5.694
  747    HB2  LEU 101           HB2      LEU 101   4.080   1.739  -5.263
  748    HB3  LEU 101           HB1      LEU 101   3.857   3.306  -5.988
  749    HG   LEU 101           HG       LEU 101   5.511   1.065  -7.134
  750   HD11  LEU 101          HD11      LEU 101   3.765   0.996  -8.863
  751   HD12  LEU 101          HD12      LEU 101   2.835   2.188  -7.955
  752   HD13  LEU 101          HD13      LEU 101   3.142   0.596  -7.264
  753   HD21  LEU 101          HD21      LEU 101   6.426   3.251  -7.693
  754   HD22  LEU 101          HD22      LEU 101   4.847   3.772  -8.279
  755   HD23  LEU 101          HD23      LEU 101   5.713   2.477  -9.107
  756    H    SER 102           HN       SER 102   5.526   1.813  -2.893
  757    HA   SER 102           HA       SER 102   3.826   3.584  -1.547
  758    HB2  SER 102           HB2      SER 102   3.917   1.256  -0.923
  759    HB3  SER 102           HB1      SER 102   5.627   1.384  -0.513
  760    HG   SER 102           HG       SER 102   4.982   2.892   1.141
  761    H    VAL 103           HN       VAL 103   7.317   3.283  -1.653
  762    HA   VAL 103           HA       VAL 103   7.919   4.791   0.623
  763    HB   VAL 103           HB       VAL 103   9.475   4.175  -1.844
  764   HG11  VAL 103          HG11      VAL 103  10.522   5.515   0.664
  765   HG12  VAL 103          HG12      VAL 103  10.274   6.321  -0.884
  766   HG13  VAL 103          HG13      VAL 103  11.471   5.036  -0.744
  767   HG21  VAL 103          HG21      VAL 103  10.770   2.848  -0.052
  768   HG22  VAL 103          HG22      VAL 103   9.200   2.237  -0.576
  769   HG23  VAL 103          HG23      VAL 103   9.347   3.100   0.956
  770    HA   PRO 104           HA       PRO 104   8.416   8.699  -2.197
  771    HB2  PRO 104           HB2      PRO 104   7.150   8.560  -4.636
  772    HB3  PRO 104           HB1      PRO 104   8.873   8.274  -4.392
  773    HG2  PRO 104           HG2      PRO 104   6.651   6.294  -4.657
  774    HG3  PRO 104           HG1      PRO 104   8.286   6.245  -5.335
  775    HD2  PRO 104           HD2      PRO 104   7.632   4.809  -3.181
  776    HD3  PRO 104           HD1      PRO 104   9.231   5.542  -3.370
  777    H    LEU 105           HN       LEU 105   5.602   6.650  -2.169
  778    HA   LEU 105           HA       LEU 105   3.739   8.850  -2.038
  779    HB2  LEU 105           HB2      LEU 105   3.562   5.884  -1.704
  780    HB3  LEU 105           HB1      LEU 105   2.218   6.903  -1.201
  781    HG   LEU 105           HG       LEU 105   3.317   6.505  -3.968
  782   HD11  LEU 105          HD11      LEU 105   0.591   6.139  -2.745
  783   HD12  LEU 105          HD12      LEU 105   1.714   4.867  -3.230
  784   HD13  LEU 105          HD13      LEU 105   0.985   5.910  -4.451
  785   HD21  LEU 105          HD21      LEU 105   2.961   8.888  -3.716
  786   HD22  LEU 105          HD22      LEU 105   1.357   8.599  -3.041
  787   HD23  LEU 105          HD23      LEU 105   1.693   8.194  -4.724
  788    H    MET 106           HN       MET 106   5.849   7.359   0.121
  789    HA   MET 106           HA       MET 106   4.262   8.182   2.447
  790    HB2  MET 106           HB2      MET 106   5.015   6.339   3.494
  791    HB3  MET 106           HB1      MET 106   5.506   5.792   1.902
  792    HG2  MET 106           HG2      MET 106   7.718   7.002   2.412
  793    HG3  MET 106           HG1      MET 106   7.153   6.980   4.088
  794    HE1  MET 106           HE1      MET 106   5.552   4.248   4.204
  795    HE2  MET 106           HE2      MET 106   6.684   4.766   5.455
  796    HE3  MET 106           HE3      MET 106   6.804   3.144   4.769
  797    H    ASP 107           HN       ASP 107   5.332   9.307   4.187
  798    HA   ASP 107           HA       ASP 107   7.325  11.183   3.172
  799    HB2  ASP 107           HB2      ASP 107   5.542  11.121   5.595
  800    HB3  ASP 107           HB1      ASP 107   6.930  12.201   5.542
  801    H    VAL 108           HN       VAL 108   9.292  11.622   4.261
  802    HA   VAL 108           HA       VAL 108  10.646   9.337   5.192
  803    HB   VAL 108           HB       VAL 108  11.623  11.522   4.181
  804   HG11  VAL 108          HG11      VAL 108  12.003  12.258   7.064
  805   HG12  VAL 108          HG12      VAL 108  10.721  12.946   6.075
  806   HG13  VAL 108          HG13      VAL 108  12.407  13.198   5.627
  807   HG21  VAL 108          HG21      VAL 108  12.995  10.079   6.438
  808   HG22  VAL 108          HG22      VAL 108  13.799  11.053   5.210
  809   HG23  VAL 108          HG23      VAL 108  12.946   9.581   4.749
  810    H    GLY 109           HN       GLY 109  10.706   8.423   7.039
  811    HA2  GLY 109           HA2      GLY 109  10.971   8.331   9.385
  812    HA3  GLY 109           HA1      GLY 109  10.328   9.960   9.495
  813    H    GLU 110           HN       GLU 110   8.473   7.937   7.469
  814    HA   GLU 110           HA       GLU 110   6.473   7.776   9.592
  815    HB2  GLU 110           HB2      GLU 110   4.799   7.867   8.002
  816    HB3  GLU 110           HB1      GLU 110   6.021   8.928   7.316
  817    HG2  GLU 110           HG2      GLU 110   6.595   7.374   5.673
  818    HG3  GLU 110           HG1      GLU 110   5.805   6.046   6.525
  819    H    THR 111           HN       THR 111   4.971   5.861   9.425
  820    HA   THR 111           HA       THR 111   6.348   3.466   8.471
  821    HB   THR 111           HB       THR 111   4.718   3.504  11.015
  822    HG1  THR 111           HG1      THR 111   7.249   4.388  10.607
  823   HG21  THR 111          HG21      THR 111   6.701   1.499   9.910
  824   HG22  THR 111          HG22      THR 111   4.946   1.340   9.857
  825   HG23  THR 111          HG23      THR 111   5.779   1.339  11.409
  826    H    ALA 112           HN       ALA 112   5.116   2.523   6.990
  827    HA   ALA 112           HA       ALA 112   2.224   3.067   7.104
  828    HB1  ALA 112           HB1      ALA 112   3.953   2.792   4.650
  829    HB2  ALA 112           HB2      ALA 112   3.277   4.293   5.286
  830    HB3  ALA 112           HB3      ALA 112   2.206   3.037   4.666
  831    H    MET 113           HN       MET 113   0.872   1.409   6.909
  832    HA   MET 113           HA       MET 113   2.020  -1.256   6.450
  833    HB2  MET 113           HB2      MET 113   0.650  -1.357   8.365
  834    HB3  MET 113           HB1      MET 113  -0.554  -0.277   7.676
  835    HG2  MET 113           HG2      MET 113  -1.248  -2.027   6.118
  836    HG3  MET 113           HG1      MET 113  -0.026  -3.107   6.787
  837    HE1  MET 113           HE1      MET 113  -0.302  -4.533   8.813
  838    HE2  MET 113           HE2      MET 113  -1.376  -4.173  10.164
  839    HE3  MET 113           HE3      MET 113  -0.055  -3.071   9.767
  840    H    VAL 114           HN       VAL 114   1.933  -1.945   4.424
  841    HA   VAL 114           HA       VAL 114  -0.097  -0.747   2.659
  842    HB   VAL 114           HB       VAL 114   2.470  -2.001   1.749
  843   HG11  VAL 114          HG11      VAL 114   0.742  -1.674   0.053
  844   HG12  VAL 114          HG12      VAL 114   2.164  -0.676  -0.251
  845   HG13  VAL 114          HG13      VAL 114   0.709   0.051   0.434
  846   HG21  VAL 114          HG21      VAL 114   2.035   0.880   2.444
  847   HG22  VAL 114          HG22      VAL 114   3.476   0.216   1.674
  848   HG23  VAL 114          HG23      VAL 114   3.053  -0.263   3.318
  849    H    THR 115           HN       THR 115  -1.525  -2.073   1.804
  850    HA   THR 115           HA       THR 115  -0.872  -4.921   1.835
  851    HB   THR 115           HB       THR 115  -3.611  -3.680   1.486
  852    HG1  THR 115           HG1      THR 115  -2.138  -4.490   3.703
  853   HG21  THR 115          HG21      THR 115  -4.414  -5.936   1.690
  854   HG22  THR 115          HG22      THR 115  -2.777  -6.528   1.968
  855   HG23  THR 115          HG23      THR 115  -3.221  -5.875   0.390
  856    H    ALA 116           HN       ALA 116  -0.115  -5.598   0.101
  857    HA   ALA 116           HA       ALA 116  -0.994  -4.475  -2.486
  858    HB1  ALA 116           HB1      ALA 116   1.291  -3.808  -1.989
  859    HB2  ALA 116           HB2      ALA 116   1.247  -4.956  -3.327
  860    HB3  ALA 116           HB3      ALA 116   1.735  -5.492  -1.720
  861    H    ASP 117           HN       ASP 117  -1.546  -5.937  -4.009
  862    HA   ASP 117           HA       ASP 117  -2.150  -8.568  -3.328
  863    HB2  ASP 117           HB2      ASP 117  -2.824  -7.184  -5.463
  864    HB3  ASP 117           HB1      ASP 117  -1.356  -7.865  -6.117
  865    H    SER 118           HN       SER 118  -1.177 -10.502  -3.921
  866    HA   SER 118           HA       SER 118   1.414 -11.044  -3.368
  867    HB2  SER 118           HB2      SER 118   0.998 -13.092  -4.738
  868    HB3  SER 118           HB1      SER 118  -0.363 -12.703  -3.692
  869    HG   SER 118           HG       SER 118  -1.212 -11.546  -5.609
  870    H    LYS 119           HN       LYS 119  -0.007 -10.267  -6.470
  871    HA   LYS 119           HA       LYS 119   2.178 -10.716  -8.126
  872    HB2  LYS 119           HB2      LYS 119   0.893  -9.182  -9.666
  873    HB3  LYS 119           HB1      LYS 119  -0.005 -10.566  -9.022
  874    HG2  LYS 119           HG2      LYS 119  -0.986  -9.086  -7.337
  875    HG3  LYS 119           HG1      LYS 119  -0.099  -7.730  -8.029
  876    HD2  LYS 119           HD2      LYS 119  -2.218  -7.549  -8.985
  877    HD3  LYS 119           HD1      LYS 119  -1.267  -8.360 -10.230
  878    HE2  LYS 119           HE2      LYS 119  -2.120 -10.543  -9.323
  879    HE3  LYS 119           HE1      LYS 119  -3.209  -9.606  -8.297
  880    HZ1  LYS 119           HZ1      LYS 119  -3.165  -9.687 -11.260
  881    HZ2  LYS 119           HZ2      LYS 119  -4.053  -8.548 -10.378
  882    HZ3  LYS 119           HZ3      LYS 119  -4.414 -10.199 -10.231
  883    H    TYR 120           HN       TYR 120   1.400  -7.922  -6.103
  884    HA   TYR 120           HA       TYR 120   3.604  -6.414  -7.305
  885    HB2  TYR 120           HB2      TYR 120   1.634  -5.621  -5.146
  886    HB3  TYR 120           HB1      TYR 120   2.872  -4.567  -5.826
  887    HD1  TYR 120           HD2      TYR 120  -0.306  -6.226  -6.405
  888    HD2  TYR 120           HD1      TYR 120   2.636  -3.640  -8.028
  889    HE1  TYR 120           HE2      TYR 120  -1.885  -5.599  -8.174
  890    HE2  TYR 120           HE1      TYR 120   1.075  -2.986  -9.824
  891    HH   TYR 120           HH       TYR 120  -0.886  -3.856 -10.949
  892    H    CYS 121           HN       CYS 121   3.320  -8.790  -5.254
  893    HA   CYS 121           HA       CYS 121   5.467  -7.841  -3.492
  894    HB2  CYS 121           HB2      CYS 121   3.128  -9.634  -2.867
  895    HB3  CYS 121           HB1      CYS 121   4.502  -9.437  -1.791
  896    HG   CYS 121           HG       CYS 121   4.076  -6.713  -1.362
  897    H    TYR 122           HN       TYR 122   4.223 -11.156  -3.520
  898    HA   TYR 122           HA       TYR 122   6.384 -12.005  -5.280
  899    HB2  TYR 122           HB2      TYR 122   6.110 -13.427  -2.644
  900    HB3  TYR 122           HB1      TYR 122   7.439 -13.443  -3.786
  901    HD1  TYR 122           HD2      TYR 122   9.130 -11.716  -3.785
  902    HD2  TYR 122           HD1      TYR 122   5.896 -11.598  -1.020
  903    HE1  TYR 122           HE2      TYR 122  10.339 -10.053  -2.447
  904    HE2  TYR 122           HE1      TYR 122   7.092  -9.932   0.317
  905    HH   TYR 122           HH       TYR 122   9.388  -9.164   0.706
  906    H    GLY 123           HN       GLY 123   3.449 -12.086  -5.607
  907    HA2  GLY 123           HA2      GLY 123   2.299 -14.536  -5.056
  908    HA3  GLY 123           HA1      GLY 123   1.969 -13.600  -6.506
  909    HA   PRO 124           HA       PRO 124   3.966 -16.879  -8.759
  910    HB2  PRO 124           HB2      PRO 124   4.730 -15.134 -10.917
  911    HB3  PRO 124           HB1      PRO 124   3.376 -16.264 -10.853
  912    HG2  PRO 124           HG2      PRO 124   3.100 -13.530 -10.923
  913    HG3  PRO 124           HG1      PRO 124   1.887 -14.638 -10.259
  914    HD2  PRO 124           HD2      PRO 124   3.926 -12.979  -8.836
  915    HD3  PRO 124           HD1      PRO 124   2.244 -13.332  -8.385
  916    H    GLN 125           HN       GLN 125   5.596 -14.613  -7.193
  917    HA   GLN 125           HA       GLN 125   8.173 -14.969  -8.555
  918    HB2  GLN 125           HB2      GLN 125   7.430 -12.956  -6.427
  919    HB3  GLN 125           HB1      GLN 125   8.883 -12.961  -7.424
  920    HG2  GLN 125           HG2      GLN 125   7.602 -12.474  -9.386
  921    HG3  GLN 125           HG1      GLN 125   6.092 -12.651  -8.500
  922   HE21  GLN 125          HE21      GLN 125   5.407 -11.034  -7.161
  923   HE22  GLN 125          HE22      GLN 125   6.132  -9.472  -7.110
  924    H    GLY 126           HN       GLY 126   6.595 -15.012  -5.409
  925    HA2  GLY 126           HA2      GLY 126   7.076 -16.182  -3.511
  926    HA3  GLY 126           HA1      GLY 126   8.417 -16.955  -4.344
  927    H    SER 127           HN       SER 127   8.108 -15.689  -1.696
  928    HA   SER 127           HA       SER 127   9.741 -13.344  -1.865
  929    HB2  SER 127           HB2      SER 127   7.901 -13.050  -0.429
  930    HB3  SER 127           HB1      SER 127   8.124 -14.617   0.317
  931    HG   SER 127           HG       SER 127   9.437 -13.732   1.701
  932    H    ARG 128           HN       ARG 128  11.482 -12.959  -0.396
  933    HA   ARG 128           HA       ARG 128  13.643 -14.570  -0.856
  934    HB2  ARG 128           HB2      ARG 128  14.736 -13.288   1.015
  935    HB3  ARG 128           HB1      ARG 128  13.959 -12.301  -0.212
  936    HG2  ARG 128           HG2      ARG 128  12.073 -11.902   1.230
  937    HG3  ARG 128           HG1      ARG 128  12.718 -13.012   2.439
  938    HD2  ARG 128           HD2      ARG 128  13.181 -10.773   3.141
  939    HD3  ARG 128           HD1      ARG 128  14.698 -11.531   2.659
  940    HE   ARG 128           HE       ARG 128  13.803 -10.226   0.420
  941   HH11  ARG 128          HH11      ARG 128  14.652  -9.366   3.694
  942   HH12  ARG 128          HH12      ARG 128  15.096  -7.724   3.297
  943   HH21  ARG 128          HH21      ARG 128  14.423  -8.087  -0.135
  944   HH22  ARG 128          HH22      ARG 128  15.002  -7.024   1.106
  945    H    SER 129           HN       SER 129  11.870 -14.387   2.243
  946    HA   SER 129           HA       SER 129  13.268 -16.705   3.200
  947    HB2  SER 129           HB2      SER 129  10.914 -15.373   4.540
  948    HB3  SER 129           HB1      SER 129  12.205 -16.314   5.289
  949    HG   SER 129           HG       SER 129  13.629 -14.656   4.930
  950    HA   PRO 130           HA       PRO 130   9.278 -18.937   2.190
  951    HB2  PRO 130           HB2      PRO 130   6.871 -17.597   2.460
  952    HB3  PRO 130           HB1      PRO 130   7.706 -18.396   3.783
  953    HG2  PRO 130           HG2      PRO 130   7.225 -15.620   3.505
  954    HG3  PRO 130           HG1      PRO 130   8.242 -16.404   4.726
  955    HD2  PRO 130           HD2      PRO 130   9.028 -15.154   2.124
  956    HD3  PRO 130           HD1      PRO 130   9.888 -15.164   3.673
  957    H    TYR 131           HN       TYR 131   9.189 -19.322  -0.046
  958    HA   TYR 131           HA       TYR 131   8.332 -17.602  -2.018
  959    HB2  TYR 131           HB2      TYR 131   9.095 -19.687  -2.779
  960    HB3  TYR 131           HB1      TYR 131   8.054 -20.579  -1.675
  961    HD1  TYR 131           HD2      TYR 131   7.980 -18.416  -4.696
  962    HD2  TYR 131           HD1      TYR 131   5.982 -21.416  -2.436
  963    HE1  TYR 131           HE2      TYR 131   6.335 -18.676  -6.506
  964    HE2  TYR 131           HE1      TYR 131   4.335 -21.687  -4.244
  965    HH   TYR 131           HH       TYR 131   3.417 -20.182  -6.110
  966    H    ILE 132           HN       ILE 132   6.722 -16.230  -1.454
  967    HA   ILE 132           HA       ILE 132   4.375 -16.979  -0.093
  968    HB   ILE 132           HB       ILE 132   4.713 -14.607  -1.931
  969   HG12  ILE 132          HG12      ILE 132   6.518 -14.481  -0.384
  970   HG13  ILE 132          HG11      ILE 132   5.292 -13.325   0.120
  971   HG21  ILE 132          HG21      ILE 132   2.418 -15.070  -1.243
  972   HG22  ILE 132          HG22      ILE 132   3.012 -13.582  -0.507
  973   HG23  ILE 132          HG23      ILE 132   2.923 -15.064   0.447
  974   HD11  ILE 132          HD11      ILE 132   5.698 -16.036   1.343
  975   HD12  ILE 132          HD12      ILE 132   4.585 -14.777   1.890
  976   HD13  ILE 132          HD13      ILE 132   6.331 -14.515   1.972
  977    HA   PRO 133           HA       PRO 133   2.418 -19.202  -3.433
  978    HB2  PRO 133           HB2      PRO 133  -0.021 -18.588  -1.849
  979    HB3  PRO 133           HB1      PRO 133   0.570 -20.142  -2.443
  980    HG2  PRO 133           HG2      PRO 133   0.772 -19.498   0.136
  981    HG3  PRO 133           HG1      PRO 133   2.064 -20.398  -0.685
  982    HD2  PRO 133           HD2      PRO 133   1.957 -17.514   0.094
  983    HD3  PRO 133           HD1      PRO 133   3.331 -18.638   0.103
  984    HA   PRO 134           HA       PRO 134   1.160 -15.818  -5.996
  985    HB2  PRO 134           HB2      PRO 134  -0.369 -17.875  -7.481
  986    HB3  PRO 134           HB1      PRO 134   0.835 -16.709  -8.065
  987    HG2  PRO 134           HG2      PRO 134   1.438 -19.309  -7.777
  988    HG3  PRO 134           HG1      PRO 134   2.619 -18.041  -7.387
  989    HD2  PRO 134           HD2      PRO 134   0.934 -19.699  -5.548
  990    HD3  PRO 134           HD1      PRO 134   2.614 -19.159  -5.354
  991    H    HIS 135           HN       HIS 135  -0.306 -14.443  -5.783
  992    HA   HIS 135           HA       HIS 135  -2.187 -13.347  -5.466
  993    HB2  HIS 135           HB2      HIS 135  -3.387 -16.010  -6.096
  994    HB3  HIS 135           HB1      HIS 135  -4.416 -14.748  -5.429
  995    HD1  HIS 135           HD1      HIS 135  -3.237 -16.016  -8.576
  996    HD2  HIS 135           HD2      HIS 135  -4.246 -12.272  -7.083
  997    HE1  HIS 135           HE1      HIS 135  -3.682 -14.589 -10.589
  998    HE2  HIS 135           HE2      HIS 135  -4.558 -12.421  -9.650
  999    H    ALA 136           HN       ALA 136  -0.695 -14.797  -3.264
 1000    HA   ALA 136           HA       ALA 136  -2.719 -14.550  -1.181
 1001    HB1  ALA 136           HB1      ALA 136  -0.918 -15.038   0.374
 1002    HB2  ALA 136           HB2      ALA 136   0.269 -14.904  -0.926
 1003    HB3  ALA 136           HB3      ALA 136  -0.909 -16.218  -0.940
 1004    H    ALA 137           HN       ALA 137  -3.281 -12.578  -0.476
 1005    HA   ALA 137           HA       ALA 137  -1.886 -10.295  -1.475
 1006    HB1  ALA 137           HB1      ALA 137  -4.137 -10.394   0.529
 1007    HB2  ALA 137           HB2      ALA 137  -4.332 -10.327  -1.219
 1008    HB3  ALA 137           HB3      ALA 137  -3.591  -8.976  -0.363
 1009    H    LEU 138           HN       LEU 138  -0.494  -8.959  -0.470
 1010    HA   LEU 138           HA       LEU 138   0.536  -9.999   2.058
 1011    HB2  LEU 138           HB2      LEU 138   1.784  -9.359  -0.367
 1012    HB3  LEU 138           HB1      LEU 138   2.296  -8.133   0.777
 1013    HG   LEU 138           HG       LEU 138   3.095  -9.859   2.304
 1014   HD11  LEU 138          HD11      LEU 138   2.205 -11.774   0.167
 1015   HD12  LEU 138          HD12      LEU 138   1.539 -11.616   1.792
 1016   HD13  LEU 138          HD13      LEU 138   3.190 -12.193   1.569
 1017   HD21  LEU 138          HD21      LEU 138   4.654  -8.966   0.696
 1018   HD22  LEU 138          HD22      LEU 138   4.124 -10.142  -0.506
 1019   HD23  LEU 138          HD23      LEU 138   4.967 -10.684   0.946
 1020    H    CYS 139           HN       CYS 139   0.583  -8.796   3.842
 1021    HA   CYS 139           HA       CYS 139  -0.020  -5.921   3.596
 1022    HB2  CYS 139           HB2      CYS 139  -1.708  -7.496   4.777
 1023    HB3  CYS 139           HB1      CYS 139  -0.509  -7.558   6.061
 1024    HG   CYS 139           HG       CYS 139  -2.866  -5.418   5.730
 1025    H    LEU 140           HN       LEU 140   1.905  -4.972   3.705
 1026    HA   LEU 140           HA       LEU 140   3.892  -6.043   5.592
 1027    HB2  LEU 140           HB2      LEU 140   5.571  -5.068   4.060
 1028    HB3  LEU 140           HB1      LEU 140   4.612  -6.351   3.341
 1029    HG   LEU 140           HG       LEU 140   3.217  -4.066   2.690
 1030   HD11  LEU 140          HD11      LEU 140   5.078  -2.689   3.493
 1031   HD12  LEU 140          HD12      LEU 140   4.885  -2.547   1.743
 1032   HD13  LEU 140          HD13      LEU 140   6.179  -3.545   2.414
 1033   HD21  LEU 140          HD21      LEU 140   4.054  -4.483   0.428
 1034   HD22  LEU 140          HD22      LEU 140   3.608  -5.982   1.243
 1035   HD23  LEU 140          HD23      LEU 140   5.308  -5.536   1.085
 1036    H    GLU 141           HN       GLU 141   4.919  -4.685   7.001
 1037    HA   GLU 141           HA       GLU 141   3.903  -1.923   7.066
 1038    HB2  GLU 141           HB2      GLU 141   3.284  -3.279   8.988
 1039    HB3  GLU 141           HB1      GLU 141   4.959  -3.729   9.248
 1040    HG2  GLU 141           HG2      GLU 141   5.514  -1.464   9.868
 1041    HG3  GLU 141           HG1      GLU 141   3.868  -0.938   9.482
 1042    H    VAL 142           HN       VAL 142   5.334  -0.446   6.398
 1043    HA   VAL 142           HA       VAL 142   8.184  -1.134   6.618
 1044    HB   VAL 142           HB       VAL 142   8.486   0.418   4.613
 1045   HG11  VAL 142          HG11      VAL 142   7.021  -2.198   4.291
 1046   HG12  VAL 142          HG12      VAL 142   8.763  -1.988   4.483
 1047   HG13  VAL 142          HG13      VAL 142   7.955  -1.387   3.035
 1048   HG21  VAL 142          HG21      VAL 142   6.569   0.649   3.121
 1049   HG22  VAL 142          HG22      VAL 142   6.251   1.438   4.668
 1050   HG23  VAL 142          HG23      VAL 142   5.529  -0.134   4.315
 1051    H    THR 143           HN       THR 143   9.229   0.031   8.002
 1052    HA   THR 143           HA       THR 143   8.551   2.787   8.627
 1053    HB   THR 143           HB       THR 143  11.112   1.429   9.447
 1054    HG1  THR 143           HG1      THR 143   9.044   1.050  11.218
 1055   HG21  THR 143          HG21      THR 143   9.235   3.388  10.796
 1056   HG22  THR 143          HG22      THR 143  10.833   3.732  10.130
 1057   HG23  THR 143          HG23      THR 143  10.673   2.697  11.547
 1058    H    LEU 144           HN       LEU 144   9.081   4.243   7.025
 1059    HA   LEU 144           HA       LEU 144  11.607   3.986   5.630
 1060    HB2  LEU 144           HB2      LEU 144   9.664   4.974   4.476
 1061    HB3  LEU 144           HB1      LEU 144   9.626   6.270   5.657
 1062    HG   LEU 144           HG       LEU 144  11.833   7.034   4.888
 1063   HD11  LEU 144          HD11      LEU 144  11.558   4.856   2.823
 1064   HD12  LEU 144          HD12      LEU 144  12.729   4.905   4.141
 1065   HD13  LEU 144          HD13      LEU 144  12.805   6.104   2.849
 1066   HD21  LEU 144          HD21      LEU 144   9.791   6.720   2.691
 1067   HD22  LEU 144          HD22      LEU 144  11.106   7.897   2.718
 1068   HD23  LEU 144          HD23      LEU 144   9.816   7.986   3.916
 1069    H    LYS 145           HN       LYS 145  13.230   4.129   6.993
 1070    HA   LYS 145           HA       LYS 145  13.106   6.018   9.194
 1071    HB2  LYS 145           HB2      LYS 145  15.355   4.094   8.633
 1072    HB3  LYS 145           HB1      LYS 145  14.879   4.808  10.168
 1073    HG2  LYS 145           HG2      LYS 145  12.879   3.473  10.237
 1074    HG3  LYS 145           HG1      LYS 145  13.218   2.828   8.632
 1075    HD2  LYS 145           HD2      LYS 145  14.916   2.422  11.094
 1076    HD3  LYS 145           HD1      LYS 145  13.826   1.223  10.375
 1077    HE2  LYS 145           HE2      LYS 145  15.143   1.008   8.470
 1078    HE3  LYS 145           HE1      LYS 145  16.035   2.497   8.785
 1079    HZ1  LYS 145           HZ1      LYS 145  17.509   0.797   9.368
 1080    HZ2  LYS 145           HZ2      LYS 145  16.313  -0.123  10.140
 1081    HZ3  LYS 145           HZ3      LYS 145  16.880   1.302  10.860
 1082    H    THR 146           HN       THR 146  14.631   5.682   6.118
 1083    HA   THR 146           HA       THR 146  15.905   8.245   6.379
 1084    HB   THR 146           HB       THR 146  17.675   5.842   5.888
 1085    HG1  THR 146           HG1      THR 146  16.825   6.944   8.249
 1086   HG21  THR 146          HG21      THR 146  18.366   8.742   6.412
 1087   HG22  THR 146          HG22      THR 146  18.435   7.935   4.847
 1088   HG23  THR 146          HG23      THR 146  19.517   7.433   6.144
 1089    H    ALA 147           HN       ALA 147  16.392   9.146   4.384
 1090    HA   ALA 147           HA       ALA 147  16.336   7.355   2.057
 1091    HB1  ALA 147           HB1      ALA 147  15.451   9.207   0.721
 1092    HB2  ALA 147           HB2      ALA 147  15.417  10.230   2.157
 1093    HB3  ALA 147           HB3      ALA 147  14.361   8.820   2.053
 1094    H    VAL 148           HN       VAL 148  18.189   7.360   0.891
 1095    HA   VAL 148           HA       VAL 148  20.118   9.510   1.427
 1096    HB   VAL 148           HB       VAL 148  20.775   6.666   0.694
 1097   HG11  VAL 148          HG11      VAL 148  22.431   8.318   0.087
 1098   HG12  VAL 148          HG12      VAL 148  23.026   7.263   1.367
 1099   HG13  VAL 148          HG13      VAL 148  22.477   8.894   1.751
 1100   HG21  VAL 148          HG21      VAL 148  19.721   6.660   2.894
 1101   HG22  VAL 148          HG22      VAL 148  20.817   7.932   3.434
 1102   HG23  VAL 148          HG23      VAL 148  21.449   6.334   3.036
 1103    H    ASP 149           HN       ASP 149  20.617  10.645  -0.321
 1104    HA   ASP 149           HA       ASP 149  19.542   9.880  -2.861
 1105    HB2  ASP 149           HB2      ASP 149  19.455  12.184  -2.426
 1106    HB3  ASP 149           HB1      ASP 149  21.133  12.229  -1.884
 1107    H    LEU 150           HN       LEU 150  20.528   8.604  -4.233
 1108    HA   LEU 150           HA       LEU 150  23.409   8.427  -4.343
 1109    HB2  LEU 150           HB2      LEU 150  22.481   7.045  -2.385
 1110    HB3  LEU 150           HB1      LEU 150  21.809   5.991  -3.608
 1111    HG   LEU 150           HG       LEU 150  23.921   5.221  -4.272
 1112   HD11  LEU 150          HD11      LEU 150  25.086   7.566  -2.771
 1113   HD12  LEU 150          HD12      LEU 150  25.114   7.307  -4.518
 1114   HD13  LEU 150          HD13      LEU 150  26.033   6.245  -3.454
 1115   HD21  LEU 150          HD21      LEU 150  23.870   5.720  -1.309
 1116   HD22  LEU 150          HD22      LEU 150  25.007   4.622  -2.098
 1117   HD23  LEU 150          HD23      LEU 150  23.273   4.298  -2.169
 1118    H    GLU 151           HN       GLU 151  20.976   8.979  -5.982
 1119    HA   GLU 151           HA       GLU 151  20.746   6.890  -7.921
 1120    HB2  GLU 151           HB2      GLU 151  19.082   8.831  -7.341
 1121    HB3  GLU 151           HB1      GLU 151  20.086   9.795  -8.410
 1122    HG2  GLU 151           HG2      GLU 151  18.568   7.303  -9.173
 1123    HG3  GLU 151           HG1      GLU 151  18.115   8.966  -9.542
 1124    H    HIS 152           HN       HIS 152  21.363  10.056  -9.108
 1125    HA   HIS 152           HA       HIS 152  22.869  10.832 -10.643
 1126    HB2  HIS 152           HB2      HIS 152  24.809   9.920  -8.509
 1127    HB3  HIS 152           HB1      HIS 152  25.068  11.201  -9.685
 1128    HD1  HIS 152           HD1      HIS 152  23.624  13.413  -9.342
 1129    HD2  HIS 152           HD2      HIS 152  23.503  10.668  -6.216
 1130    HE1  HIS 152           HE1      HIS 152  22.689  14.665  -7.367
 1131    HE2  HIS 152           HE2      HIS 152  22.435  12.934  -5.553
 1132    H    HIS 153           HN       HIS 153  22.283   8.869 -12.015
 1133    HA   HIS 153           HA       HIS 153  24.100   6.710 -12.186
 1134    HB2  HIS 153           HB2      HIS 153  23.047   6.352 -14.490
 1135    HB3  HIS 153           HB1      HIS 153  21.989   6.266 -13.091
 1136    HD1  HIS 153           HD1      HIS 153  22.952   8.757 -15.804
 1137    HD2  HIS 153           HD2      HIS 153  19.787   7.838 -13.265
 1138    HE1  HIS 153           HE1      HIS 153  21.067  10.271 -16.499
 1139    HE2  HIS 153           HE2      HIS 153  19.250   9.855 -14.802
 1140    H    HIS 154           HN       HIS 154  24.923   9.730 -12.669
 1141    HA   HIS 154           HA       HIS 154  26.531   9.434 -15.055
 1142    HB2  HIS 154           HB2      HIS 154  25.599  11.637 -14.454
 1143    HB3  HIS 154           HB1      HIS 154  26.493  11.609 -12.940
 1144    HD1  HIS 154           HD1      HIS 154  28.961  12.261 -13.004
 1145    HD2  HIS 154           HD2      HIS 154  27.175  12.134 -16.763
 1146    HE1  HIS 154           HE1      HIS 154  30.602  13.333 -14.579
 1147    HE2  HIS 154           HE2      HIS 154  29.432  13.391 -16.812
 1148    H    HIS 155           HN       HIS 155  27.924   7.725 -14.641
 1149    HA   HIS 155           HA       HIS 155  30.110   8.433 -12.843
 1150    HB2  HIS 155           HB2      HIS 155  30.292   6.117 -11.997
 1151    HB3  HIS 155           HB1      HIS 155  28.800   6.901 -11.506
 1152    HD1  HIS 155           HD1      HIS 155  26.755   5.520 -11.785
 1153    HD2  HIS 155           HD2      HIS 155  29.833   4.292 -14.307
 1154    HE1  HIS 155           HE1      HIS 155  25.912   3.446 -12.941
 1155    HE2  HIS 155           HE2      HIS 155  27.851   2.633 -14.336
 1156    H    HIS 156           HN       HIS 156  32.113   7.921 -13.567
 1157    HA   HIS 156           HA       HIS 156  32.606   6.048 -15.669
 1158    HB2  HIS 156           HB2      HIS 156  31.651   7.871 -17.018
 1159    HB3  HIS 156           HB1      HIS 156  32.804   9.004 -16.323
 1160    HD1  HIS 156           HD1      HIS 156  35.186   9.001 -17.283
 1161    HD2  HIS 156           HD2      HIS 156  32.712   6.110 -18.950
 1162    HE1  HIS 156           HE1      HIS 156  36.415   8.149 -19.301
 1163    HE2  HIS 156           HE2      HIS 156  34.811   6.539 -20.401
 1164    H    HIS 157           HN       HIS 157  34.552   5.248 -15.140
 1165    HA   HIS 157           HA       HIS 157  36.490   7.047 -13.854
 1166    HB2  HIS 157           HB2      HIS 157  36.475   4.022 -13.997
 1167    HB3  HIS 157           HB1      HIS 157  37.687   4.995 -13.175
 1168    HD1  HIS 157           HD1      HIS 157  35.808   2.823 -11.840
 1169    HD2  HIS 157           HD2      HIS 157  35.293   6.948 -11.699
 1170    HE1  HIS 157           HE1      HIS 157  34.414   3.263  -9.793
 1171    HE2  HIS 157           HE2      HIS 157  33.976   5.742  -9.824
  Start of MODEL    3
    1    H1   MET   1           HT1      MET   1 -36.846 -11.741 -26.740
    2    H2   MET   1           HT2      MET   1 -36.899 -10.175 -26.105
    3    H3   MET   1           HT3      MET   1 -38.231 -10.788 -26.959
    4    HA   MET   1           HA       MET   1 -38.647 -10.805 -24.581
    5    HB2  MET   1           HB2      MET   1 -38.241 -13.551 -25.797
    6    HB3  MET   1           HB1      MET   1 -39.218 -13.213 -24.372
    7    HG2  MET   1           HG2      MET   1 -40.713 -11.839 -25.699
    8    HG3  MET   1           HG1      MET   1 -39.718 -12.106 -27.127
    9    HE1  MET   1           HE1      MET   1 -43.006 -14.118 -27.890
   10    HE2  MET   1           HE2      MET   1 -41.901 -12.870 -28.464
   11    HE3  MET   1           HE3      MET   1 -42.867 -12.593 -27.016
   12    H    GLY   2           HN       GLY   2 -38.161 -12.088 -22.525
   13    HA2  GLY   2           HA2      GLY   2 -35.221 -12.209 -22.260
   14    HA3  GLY   2           HA1      GLY   2 -36.293 -11.618 -21.003
   15    H    GLN   3           HN       GLN   3 -38.189 -13.514 -20.782
   16    HA   GLN   3           HA       GLN   3 -36.630 -15.828 -19.870
   17    HB2  GLN   3           HB2      GLN   3 -39.347 -14.837 -18.983
   18    HB3  GLN   3           HB1      GLN   3 -38.538 -16.256 -18.342
   19    HG2  GLN   3           HG2      GLN   3 -36.706 -14.815 -17.538
   20    HG3  GLN   3           HG1      GLN   3 -37.601 -13.406 -18.110
   21   HE21  GLN   3          HE21      GLN   3 -39.483 -12.784 -17.040
   22   HE22  GLN   3          HE22      GLN   3 -39.856 -13.355 -15.451
   23    HA   PRO   4           HA       PRO   4 -38.620 -18.746 -22.585
   24    HB2  PRO   4           HB2      PRO   4 -39.258 -20.258 -20.093
   25    HB3  PRO   4           HB1      PRO   4 -38.497 -20.813 -21.588
   26    HG2  PRO   4           HG2      PRO   4 -37.044 -20.366 -19.411
   27    HG3  PRO   4           HG1      PRO   4 -36.431 -19.944 -21.020
   28    HD2  PRO   4           HD2      PRO   4 -37.497 -18.173 -18.871
   29    HD3  PRO   4           HD1      PRO   4 -36.209 -17.867 -20.052
   30    HA   PRO   5           HA       PRO   5 -43.093 -18.726 -20.788
   31    HB2  PRO   5           HB2      PRO   5 -43.025 -17.108 -18.348
   32    HB3  PRO   5           HB1      PRO   5 -43.714 -18.716 -18.603
   33    HG2  PRO   5           HG2      PRO   5 -41.500 -18.324 -17.115
   34    HG3  PRO   5           HG1      PRO   5 -41.746 -19.789 -18.083
   35    HD2  PRO   5           HD2      PRO   5 -40.085 -17.370 -18.694
   36    HD3  PRO   5           HD1      PRO   5 -39.703 -19.090 -18.934
   37    H    ALA   6           HN       ALA   6 -44.080 -17.381 -22.108
   38    HA   ALA   6           HA       ALA   6 -43.480 -14.498 -21.986
   39    HB1  ALA   6           HB1      ALA   6 -44.678 -16.151 -24.217
   40    HB2  ALA   6           HB2      ALA   6 -43.035 -15.514 -24.155
   41    HB3  ALA   6           HB3      ALA   6 -44.404 -14.409 -24.277
   42    H    GLU   7           HN       GLU   7 -45.417 -16.381 -20.491
   43    HA   GLU   7           HA       GLU   7 -47.997 -15.204 -21.121
   44    HB2  GLU   7           HB2      GLU   7 -47.682 -17.642 -20.552
   45    HB3  GLU   7           HB1      GLU   7 -47.280 -17.150 -18.916
   46    HG2  GLU   7           HG2      GLU   7 -49.492 -16.206 -18.624
   47    HG3  GLU   7           HG1      GLU   7 -49.901 -16.620 -20.290
   48    H    GLU   8           HN       GLU   8 -45.346 -14.627 -19.079
   49    HA   GLU   8           HA       GLU   8 -46.886 -13.249 -17.033
   50    HB2  GLU   8           HB2      GLU   8 -43.893 -13.559 -17.292
   51    HB3  GLU   8           HB1      GLU   8 -44.766 -12.979 -15.879
   52    HG2  GLU   8           HG2      GLU   8 -44.883 -15.754 -17.044
   53    HG3  GLU   8           HG1      GLU   8 -44.048 -15.268 -15.569
   54    H    ALA   9           HN       ALA   9 -47.440 -11.213 -17.271
   55    HA   ALA   9           HA       ALA   9 -45.990  -9.526 -19.169
   56    HB1  ALA   9           HB1      ALA   9 -47.885  -7.997 -18.967
   57    HB2  ALA   9           HB2      ALA   9 -48.586  -9.015 -17.707
   58    HB3  ALA   9           HB3      ALA   9 -48.427  -9.628 -19.354
   59    H    GLU  10           HN       GLU  10 -44.614  -8.000 -18.568
   60    HA   GLU  10           HA       GLU  10 -44.779  -6.839 -15.894
   61    HB2  GLU  10           HB2      GLU  10 -42.326  -7.056 -15.613
   62    HB3  GLU  10           HB1      GLU  10 -43.127  -8.620 -15.678
   63    HG2  GLU  10           HG2      GLU  10 -42.399  -8.973 -17.922
   64    HG3  GLU  10           HG1      GLU  10 -41.766  -7.331 -18.029
   65    H    GLN  11           HN       GLN  11 -45.464  -5.916 -18.582
   66    HA   GLN  11           HA       GLN  11 -43.243  -4.122 -19.243
   67    HB2  GLN  11           HB2      GLN  11 -44.273  -3.863 -21.435
   68    HB3  GLN  11           HB1      GLN  11 -44.014  -5.560 -21.063
   69    HG2  GLN  11           HG2      GLN  11 -46.385  -5.773 -20.474
   70    HG3  GLN  11           HG1      GLN  11 -46.630  -4.080 -20.905
   71   HE21  GLN  11          HE21      GLN  11 -46.195  -7.290 -22.065
   72   HE22  GLN  11          HE22      GLN  11 -46.455  -6.950 -23.739
   73    HA   PRO  12           HA       PRO  12 -45.464  -0.790 -17.322
   74    HB2  PRO  12           HB2      PRO  12 -43.418   0.791 -18.766
   75    HB3  PRO  12           HB1      PRO  12 -43.798   0.745 -17.040
   76    HG2  PRO  12           HG2      PRO  12 -41.579  -0.406 -17.976
   77    HG3  PRO  12           HG1      PRO  12 -42.521  -1.161 -16.675
   78    HD2  PRO  12           HD2      PRO  12 -42.452  -1.828 -19.594
   79    HD3  PRO  12           HD1      PRO  12 -42.467  -2.923 -18.191
   80    H    GLY  13           HN       GLY  13 -44.104   0.004 -20.522
   81    HA2  GLY  13           HA2      GLY  13 -46.273   0.036 -22.123
   82    HA3  GLY  13           HA1      GLY  13 -46.463   1.531 -21.213
   83    H    ALA  14           HN       ALA  14 -45.081   0.099 -23.914
   84    HA   ALA  14           HA       ALA  14 -43.544   0.702 -25.473
   85    HB1  ALA  14           HB1      ALA  14 -43.185   3.081 -25.897
   86    HB2  ALA  14           HB2      ALA  14 -43.903   3.484 -24.338
   87    HB3  ALA  14           HB3      ALA  14 -44.893   2.759 -25.604
   88    H    LEU  15           HN       LEU  15 -42.169  -0.610 -24.045
   89    HA   LEU  15           HA       LEU  15 -40.182  -1.077 -23.059
   90    HB2  LEU  15           HB2      LEU  15 -39.551   1.823 -23.625
   91    HB3  LEU  15           HB1      LEU  15 -38.397   0.643 -23.033
   92    HG   LEU  15           HG       LEU  15 -39.818   0.470 -25.693
   93   HD11  LEU  15          HD11      LEU  15 -36.981   1.280 -25.049
   94   HD12  LEU  15          HD12      LEU  15 -38.259   2.346 -25.636
   95   HD13  LEU  15          HD13      LEU  15 -37.649   1.050 -26.666
   96   HD21  LEU  15          HD21      LEU  15 -37.573  -1.163 -24.515
   97   HD22  LEU  15          HD22      LEU  15 -38.218  -1.327 -26.149
   98   HD23  LEU  15          HD23      LEU  15 -39.233  -1.705 -24.757
   99    H    ALA  16           HN       ALA  16 -38.622   0.304 -21.262
  100    HA   ALA  16           HA       ALA  16 -40.518   1.178 -19.184
  101    HB1  ALA  16           HB1      ALA  16 -39.468  -0.960 -18.584
  102    HB2  ALA  16           HB2      ALA  16 -38.923   0.334 -17.514
  103    HB3  ALA  16           HB3      ALA  16 -37.872  -0.243 -18.809
  104    H    ARG  17           HN       ARG  17 -40.330   3.281 -18.772
  105    HA   ARG  17           HA       ARG  17 -37.703   4.542 -18.964
  106    HB2  ARG  17           HB2      ARG  17 -40.015   5.100 -20.773
  107    HB3  ARG  17           HB1      ARG  17 -38.952   6.425 -20.312
  108    HG2  ARG  17           HG2      ARG  17 -38.013   3.851 -21.558
  109    HG3  ARG  17           HG1      ARG  17 -38.311   5.343 -22.451
  110    HD2  ARG  17           HD2      ARG  17 -36.588   6.488 -21.277
  111    HD3  ARG  17           HD1      ARG  17 -36.432   5.180 -20.109
  112    HE   ARG  17           HE       ARG  17 -35.876   4.318 -22.769
  113   HH11  ARG  17          HH11      ARG  17 -34.524   6.091 -20.081
  114   HH12  ARG  17          HH12      ARG  17 -32.883   5.601 -20.405
  115   HH21  ARG  17          HH21      ARG  17 -33.708   3.679 -23.229
  116   HH22  ARG  17          HH22      ARG  17 -32.421   4.226 -22.198
  117    H    GLU  18           HN       GLU  18 -39.568   3.934 -16.823
  118    HA   GLU  18           HA       GLU  18 -40.719   6.350 -15.903
  119    HB2  GLU  18           HB2      GLU  18 -39.820   3.892 -14.379
  120    HB3  GLU  18           HB1      GLU  18 -40.702   5.228 -13.657
  121    HG2  GLU  18           HG2      GLU  18 -42.313   3.598 -14.077
  122    HG3  GLU  18           HG1      GLU  18 -42.510   4.773 -15.375
  123    H    PHE  19           HN       PHE  19 -39.240   7.987 -16.130
  124    HA   PHE  19           HA       PHE  19 -36.600   7.937 -15.143
  125    HB2  PHE  19           HB2      PHE  19 -36.644  10.381 -15.436
  126    HB3  PHE  19           HB1      PHE  19 -37.302   9.547 -16.835
  127    HD1  PHE  19           HD2      PHE  19 -39.816   9.430 -17.091
  128    HD2  PHE  19           HD1      PHE  19 -37.896  11.997 -14.296
  129    HE1  PHE  19           HE2      PHE  19 -41.858  10.798 -16.946
  130    HE2  PHE  19           HE1      PHE  19 -39.932  13.364 -14.143
  131    HZ   PHE  19           HZ       PHE  19 -41.913  12.772 -15.465
  132    H    LEU  20           HN       LEU  20 -39.602   8.256 -13.578
  133    HA   LEU  20           HA       LEU  20 -38.531   9.485 -11.188
  134    HB2  LEU  20           HB2      LEU  20 -41.211   8.203 -11.741
  135    HB3  LEU  20           HB1      LEU  20 -40.793   9.053 -10.266
  136    HG   LEU  20           HG       LEU  20 -40.878  10.306 -13.010
  137   HD11  LEU  20          HD11      LEU  20 -42.932  11.374 -12.269
  138   HD12  LEU  20          HD12      LEU  20 -42.852  10.500 -10.737
  139   HD13  LEU  20          HD13      LEU  20 -43.096   9.617 -12.244
  140   HD21  LEU  20          HD21      LEU  20 -39.317  11.422 -11.541
  141   HD22  LEU  20          HD22      LEU  20 -40.528  11.498 -10.261
  142   HD23  LEU  20          HD23      LEU  20 -40.758  12.417 -11.750
  143    H    ALA  21           HN       ALA  21 -36.840   7.864 -10.988
  144    HA   ALA  21           HA       ALA  21 -37.771   5.594  -9.399
  145    HB1  ALA  21           HB1      ALA  21 -37.401   4.719 -11.664
  146    HB2  ALA  21           HB2      ALA  21 -36.216   4.071 -10.527
  147    HB3  ALA  21           HB3      ALA  21 -35.756   5.358 -11.640
  148    H    ALA  22           HN       ALA  22 -36.703   5.470  -7.561
  149    HA   ALA  22           HA       ALA  22 -34.601   7.241  -6.907
  150    HB1  ALA  22           HB1      ALA  22 -36.203   6.351  -5.246
  151    HB2  ALA  22           HB2      ALA  22 -34.524   6.105  -4.769
  152    HB3  ALA  22           HB3      ALA  22 -35.461   4.759  -5.418
  153    H    MET  23           HN       MET  23 -32.680   7.086  -7.856
  154    HA   MET  23           HA       MET  23 -31.562   4.498  -8.528
  155    HB2  MET  23           HB2      MET  23 -30.548   7.311  -8.954
  156    HB3  MET  23           HB1      MET  23 -29.665   5.872  -9.453
  157    HG2  MET  23           HG2      MET  23 -31.555   5.243 -10.893
  158    HG3  MET  23           HG1      MET  23 -32.393   6.714 -10.409
  159    HE1  MET  23           HE1      MET  23 -31.772   5.758 -13.410
  160    HE2  MET  23           HE2      MET  23 -31.354   7.303 -14.152
  161    HE3  MET  23           HE3      MET  23 -32.699   7.207 -13.015
  162    H    GLU  24           HN       GLU  24 -31.694   4.025  -6.179
  163    HA   GLU  24           HA       GLU  24 -29.053   4.506  -5.002
  164    HB2  GLU  24           HB2      GLU  24 -30.839   5.861  -3.842
  165    HB3  GLU  24           HB1      GLU  24 -31.625   4.349  -3.407
  166    HG2  GLU  24           HG2      GLU  24 -30.320   5.188  -1.556
  167    HG3  GLU  24           HG1      GLU  24 -29.629   3.680  -2.154
  168    HA   PRO  25           HA       PRO  25 -29.715   0.053  -5.701
  169    HB2  PRO  25           HB2      PRO  25 -27.057  -0.587  -5.540
  170    HB3  PRO  25           HB1      PRO  25 -27.842  -0.012  -7.014
  171    HG2  PRO  25           HG2      PRO  25 -26.199   1.500  -5.026
  172    HG3  PRO  25           HG1      PRO  25 -26.186   1.598  -6.798
  173    HD2  PRO  25           HD2      PRO  25 -27.448   3.429  -5.273
  174    HD3  PRO  25           HD1      PRO  25 -28.065   2.942  -6.863
  175    H    GLU  26           HN       GLU  26 -30.055  -1.487  -4.253
  176    HA   GLU  26           HA       GLU  26 -29.796  -1.125  -1.507
  177    HB2  GLU  26           HB2      GLU  26 -30.256  -3.581  -1.358
  178    HB3  GLU  26           HB1      GLU  26 -31.386  -2.711  -2.384
  179    HG2  GLU  26           HG2      GLU  26 -30.039  -3.467  -4.353
  180    HG3  GLU  26           HG1      GLU  26 -29.110  -4.476  -3.246
  181    HA   PRO  27           HA       PRO  27 -25.496  -1.535  -0.750
  182    HB2  PRO  27           HB2      PRO  27 -26.376  -2.719   1.831
  183    HB3  PRO  27           HB1      PRO  27 -25.291  -1.356   1.527
  184    HG2  PRO  27           HG2      PRO  27 -27.778  -0.951   2.387
  185    HG3  PRO  27           HG1      PRO  27 -27.043   0.130   1.186
  186    HD2  PRO  27           HD2      PRO  27 -29.058  -2.043   0.807
  187    HD3  PRO  27           HD1      PRO  27 -28.936  -0.466   0.001
  188    H    ALA  28           HN       ALA  28 -24.118  -3.029  -1.366
  189    HA   ALA  28           HA       ALA  28 -24.975  -5.806  -1.459
  190    HB1  ALA  28           HB1      ALA  28 -22.501  -4.494  -2.582
  191    HB2  ALA  28           HB2      ALA  28 -23.998  -4.801  -3.466
  192    HB3  ALA  28           HB3      ALA  28 -23.021  -6.152  -2.882
  193    HA   PRO  29           HA       PRO  29 -22.495  -7.167   2.005
  194    HB2  PRO  29           HB2      PRO  29 -21.826  -9.654   1.049
  195    HB3  PRO  29           HB1      PRO  29 -23.356  -9.272   1.844
  196    HG2  PRO  29           HG2      PRO  29 -22.735  -9.519  -1.064
  197    HG3  PRO  29           HG1      PRO  29 -24.178 -10.039  -0.176
  198    HD2  PRO  29           HD2      PRO  29 -24.155  -7.797  -1.677
  199    HD3  PRO  29           HD1      PRO  29 -25.101  -7.921  -0.179
  200    H    ALA  30           HN       ALA  30 -20.466  -6.687   2.453
  201    HA   ALA  30           HA       ALA  30 -18.306  -7.472   0.739
  202    HB1  ALA  30           HB1      ALA  30 -19.069  -5.455  -0.433
  203    HB2  ALA  30           HB2      ALA  30 -17.446  -5.260   0.226
  204    HB3  ALA  30           HB3      ALA  30 -18.823  -4.514   1.036
  205    HA   PRO  31           HA       PRO  31 -17.148  -7.224   5.303
  206    HB2  PRO  31           HB2      PRO  31 -15.853  -9.691   4.231
  207    HB3  PRO  31           HB1      PRO  31 -16.597  -9.403   5.807
  208    HG2  PRO  31           HG2      PRO  31 -17.839 -10.828   3.912
  209    HG3  PRO  31           HG1      PRO  31 -18.727  -9.774   5.024
  210    HD2  PRO  31           HD2      PRO  31 -18.119  -9.391   2.147
  211    HD3  PRO  31           HD1      PRO  31 -19.477  -8.792   3.108
  212    H    ALA  32           HN       ALA  32 -15.760  -5.515   5.039
  213    HA   ALA  32           HA       ALA  32 -13.337  -5.965   3.435
  214    HB1  ALA  32           HB1      ALA  32 -14.631  -3.356   4.227
  215    HB2  ALA  32           HB2      ALA  32 -14.729  -4.115   2.639
  216    HB3  ALA  32           HB3      ALA  32 -13.178  -3.531   3.243
  217    HA   PRO  33           HA       PRO  33 -10.959  -5.929   7.204
  218    HB2  PRO  33           HB2      PRO  33  -8.598  -5.026   6.121
  219    HB3  PRO  33           HB1      PRO  33  -9.149  -6.703   6.037
  220    HG2  PRO  33           HG2      PRO  33  -9.363  -4.531   3.988
  221    HG3  PRO  33           HG1      PRO  33  -8.919  -6.235   3.769
  222    HD2  PRO  33           HD2      PRO  33 -11.374  -5.343   3.175
  223    HD3  PRO  33           HD1      PRO  33 -11.129  -6.949   3.895
  224    H    GLU  34           HN       GLU  34 -10.643  -3.173   4.993
  225    HA   GLU  34           HA       GLU  34 -11.348  -1.173   6.789
  226    HB2  GLU  34           HB2      GLU  34  -9.200  -1.923   7.894
  227    HB3  GLU  34           HB1      GLU  34  -8.348  -1.389   6.452
  228    HG2  GLU  34           HG2      GLU  34  -8.931   0.873   6.843
  229    HG3  GLU  34           HG1      GLU  34 -10.069   0.427   8.114
  230    H    GLU  35           HN       GLU  35  -8.798  -1.736   4.387
  231    HA   GLU  35           HA       GLU  35  -8.521  -1.120   2.236
  232    HB2  GLU  35           HB2      GLU  35 -11.367  -0.127   2.356
  233    HB3  GLU  35           HB1      GLU  35 -10.426  -0.410   0.897
  234    HG2  GLU  35           HG2      GLU  35 -10.203  -2.822   1.779
  235    HG3  GLU  35           HG1      GLU  35 -11.557  -2.396   2.823
  236    H    TRP  36           HN       TRP  36  -7.099   0.399   1.937
  237    HA   TRP  36           HA       TRP  36  -7.682   3.125   2.874
  238    HB2  TRP  36           HB2      TRP  36  -4.916   2.159   2.247
  239    HB3  TRP  36           HB1      TRP  36  -5.433   3.362   3.425
  240    HD1  TRP  36           HD1      TRP  36  -7.169   2.015   5.413
  241    HE1  TRP  36           HE1      TRP  36  -6.485  -0.057   6.781
  242    HE3  TRP  36           HE3      TRP  36  -3.402   0.275   2.403
  243    HZ2  TRP  36           HZ2      TRP  36  -4.593  -2.154   6.594
  244    HZ3  TRP  36           HZ3      TRP  36  -2.230  -1.750   3.071
  245    HH2  TRP  36           HH2      TRP  36  -2.797  -2.954   5.098
  246    H    LEU  37           HN       LEU  37  -5.459   4.271   1.531
  247    HA   LEU  37           HA       LEU  37  -6.568   4.896  -1.013
  248    HB2  LEU  37           HB2      LEU  37  -5.260   6.498   0.285
  249    HB3  LEU  37           HB1      LEU  37  -3.855   5.463   0.192
  250    HG   LEU  37           HG       LEU  37  -3.878   5.790  -2.297
  251   HD11  LEU  37          HD11      LEU  37  -6.211   6.458  -2.532
  252   HD12  LEU  37          HD12      LEU  37  -5.125   7.688  -3.180
  253   HD13  LEU  37          HD13      LEU  37  -5.886   7.923  -1.608
  254   HD21  LEU  37          HD21      LEU  37  -2.811   7.947  -2.198
  255   HD22  LEU  37          HD22      LEU  37  -2.396   7.029  -0.749
  256   HD23  LEU  37          HD23      LEU  37  -3.606   8.310  -0.665
  257    H    ASP  38           HN       ASP  38  -6.430   3.626  -2.793
  258    HA   ASP  38           HA       ASP  38  -4.388   1.597  -2.944
  259    HB2  ASP  38           HB2      ASP  38  -6.774   1.317  -3.820
  260    HB3  ASP  38           HB1      ASP  38  -6.248   2.293  -5.193
  261    H    ILE  39           HN       ILE  39  -2.582   1.645  -3.966
  262    HA   ILE  39           HA       ILE  39  -1.444   4.107  -4.732
  263    HB   ILE  39           HB       ILE  39  -0.431   1.299  -5.199
  264   HG12  ILE  39          HG12      ILE  39  -0.350   3.141  -2.830
  265   HG13  ILE  39          HG11      ILE  39  -0.769   1.441  -2.898
  266   HG21  ILE  39          HG21      ILE  39   0.760   2.923  -6.555
  267   HG22  ILE  39          HG22      ILE  39   1.790   2.317  -5.261
  268   HG23  ILE  39          HG23      ILE  39   1.062   3.918  -5.129
  269   HD11  ILE  39          HD11      ILE  39   1.370   1.802  -1.780
  270   HD12  ILE  39          HD12      ILE  39   2.004   2.549  -3.247
  271   HD13  ILE  39          HD13      ILE  39   1.551   0.845  -3.251
  272    H    LEU  40           HN       LEU  40  -3.099   1.621  -6.483
  273    HA   LEU  40           HA       LEU  40  -2.524   3.063  -8.994
  274    HB2  LEU  40           HB2      LEU  40  -3.168   0.132  -8.677
  275    HB3  LEU  40           HB1      LEU  40  -2.879   0.961 -10.196
  276    HG   LEU  40           HG       LEU  40  -0.845   0.519  -8.003
  277   HD11  LEU  40          HD11      LEU  40   0.222  -0.951  -9.633
  278   HD12  LEU  40          HD12      LEU  40  -1.102  -0.667 -10.759
  279   HD13  LEU  40          HD13      LEU  40  -1.407  -1.505  -9.240
  280   HD21  LEU  40          HD21      LEU  40  -0.527   1.782 -10.727
  281   HD22  LEU  40          HD22      LEU  40   0.763   1.471  -9.563
  282   HD23  LEU  40          HD23      LEU  40  -0.501   2.643  -9.186
  283    H    GLY  41           HN       GLY  41  -4.743   2.694  -6.720
  284    HA2  GLY  41           HA2      GLY  41  -7.008   2.915  -6.559
  285    HA3  GLY  41           HA1      GLY  41  -6.972   3.533  -8.195
  286    H    ASN  42           HN       ASN  42  -5.707   0.374  -7.557
  287    HA   ASN  42           HA       ASN  42  -7.862  -0.700  -9.208
  288    HB2  ASN  42           HB2      ASN  42  -6.484  -2.497  -9.801
  289    HB3  ASN  42           HB1      ASN  42  -5.449  -1.087  -9.817
  290   HD21  ASN  42          HD21      ASN  42  -5.000  -1.037  -6.923
  291   HD22  ASN  42          HD22      ASN  42  -3.974  -2.383  -6.604
  292    H    GLY  43           HN       GLY  43  -6.606  -1.019  -5.960
  293    HA2  GLY  43           HA2      GLY  43  -8.271  -1.510  -4.263
  294    HA3  GLY  43           HA1      GLY  43  -8.992  -2.662  -5.378
  295    H    LEU  44           HN       LEU  44  -5.767  -2.948  -5.724
  296    HA   LEU  44           HA       LEU  44  -5.725  -5.313  -3.980
  297    HB2  LEU  44           HB2      LEU  44  -4.296  -4.631  -6.539
  298    HB3  LEU  44           HB1      LEU  44  -3.768  -5.952  -5.517
  299    HG   LEU  44           HG       LEU  44  -6.044  -6.947  -5.785
  300   HD11  LEU  44          HD11      LEU  44  -6.337  -4.845  -7.910
  301   HD12  LEU  44          HD12      LEU  44  -7.296  -4.983  -6.435
  302   HD13  LEU  44          HD13      LEU  44  -7.411  -6.228  -7.682
  303   HD21  LEU  44          HD21      LEU  44  -4.171  -7.790  -7.033
  304   HD22  LEU  44          HD22      LEU  44  -4.398  -6.542  -8.258
  305   HD23  LEU  44          HD23      LEU  44  -5.618  -7.799  -8.044
  306    H    LEU  45           HN       LEU  45  -4.138  -2.340  -4.711
  307    HA   LEU  45           HA       LEU  45  -1.917  -2.981  -2.888
  308    HB2  LEU  45           HB2      LEU  45  -1.004  -3.070  -5.029
  309    HB3  LEU  45           HB1      LEU  45  -1.965  -1.731  -5.601
  310    HG   LEU  45           HG       LEU  45  -0.568  -0.169  -4.344
  311   HD11  LEU  45          HD11      LEU  45   0.025  -1.658  -2.487
  312   HD12  LEU  45          HD12      LEU  45   1.443  -0.917  -3.228
  313   HD13  LEU  45          HD13      LEU  45   1.043  -2.598  -3.579
  314   HD21  LEU  45          HD21      LEU  45   1.463  -0.463  -5.671
  315   HD22  LEU  45          HD22      LEU  45   0.011  -0.755  -6.628
  316   HD23  LEU  45          HD23      LEU  45   0.974  -2.114  -6.047
  317    H    ARG  46           HN       ARG  46  -2.429  -1.821  -1.064
  318    HA   ARG  46           HA       ARG  46  -3.077   1.041  -1.423
  319    HB2  ARG  46           HB2      ARG  46  -4.543  -0.966   0.285
  320    HB3  ARG  46           HB1      ARG  46  -4.725   0.777   0.462
  321    HG2  ARG  46           HG2      ARG  46  -5.642   1.007  -1.666
  322    HG3  ARG  46           HG1      ARG  46  -5.141  -0.601  -2.160
  323    HD2  ARG  46           HD2      ARG  46  -7.206   0.029  -0.056
  324    HD3  ARG  46           HD1      ARG  46  -7.551  -0.458  -1.716
  325    HE   ARG  46           HE       ARG  46  -5.871  -2.308  -0.290
  326   HH11  ARG  46          HH11      ARG  46  -9.149  -1.415  -1.068
  327   HH12  ARG  46          HH12      ARG  46  -9.824  -2.956  -0.645
  328   HH21  ARG  46          HH21      ARG  46  -6.727  -4.340   0.304
  329   HH22  ARG  46          HH22      ARG  46  -8.434  -4.630   0.134
  330    H    LYS  47           HN       LYS  47  -2.315   2.431   0.105
  331    HA   LYS  47           HA       LYS  47  -0.440   1.288   2.087
  332    HB2  LYS  47           HB2      LYS  47   0.435   2.667   0.086
  333    HB3  LYS  47           HB1      LYS  47  -0.296   4.051   0.883
  334    HG2  LYS  47           HG2      LYS  47   1.111   3.207   2.932
  335    HG3  LYS  47           HG1      LYS  47   2.071   2.441   1.666
  336    HD2  LYS  47           HD2      LYS  47   3.100   4.490   1.947
  337    HD3  LYS  47           HD1      LYS  47   2.058   4.759   0.556
  338    HE2  LYS  47           HE2      LYS  47   0.629   6.127   1.692
  339    HE3  LYS  47           HE1      LYS  47   0.915   5.324   3.236
  340    HZ1  LYS  47           HZ1      LYS  47   2.876   7.127   1.902
  341    HZ2  LYS  47           HZ2      LYS  47   3.001   6.468   3.460
  342    HZ3  LYS  47           HZ3      LYS  47   1.805   7.617   3.114
  343    H    LYS  48           HN       LYS  48  -0.960   1.663   4.194
  344    HA   LYS  48           HA       LYS  48  -2.647   4.010   4.777
  345    HB2  LYS  48           HB2      LYS  48  -3.694   1.894   5.456
  346    HB3  LYS  48           HB1      LYS  48  -2.287   1.509   6.444
  347    HG2  LYS  48           HG2      LYS  48  -2.718   3.376   7.886
  348    HG3  LYS  48           HG1      LYS  48  -4.027   3.933   6.851
  349    HD2  LYS  48           HD2      LYS  48  -5.017   2.853   8.718
  350    HD3  LYS  48           HD1      LYS  48  -5.202   1.773   7.336
  351    HE2  LYS  48           HE2      LYS  48  -3.469   0.333   8.111
  352    HE3  LYS  48           HE1      LYS  48  -2.956   1.518   9.327
  353    HZ1  LYS  48           HZ1      LYS  48  -4.291  -0.331  10.255
  354    HZ2  LYS  48           HZ2      LYS  48  -5.620   0.195   9.334
  355    HZ3  LYS  48           HZ3      LYS  48  -4.968   1.194  10.539
  356    H    THR  49           HN       THR  49  -1.819   5.616   5.913
  357    HA   THR  49           HA       THR  49   0.873   5.406   6.965
  358    HB   THR  49           HB       THR  49   0.451   7.832   7.614
  359    HG1  THR  49           HG1      THR  49  -1.861   7.676   7.604
  360   HG21  THR  49          HG21      THR  49   1.654   7.234   5.582
  361   HG22  THR  49          HG22      THR  49   0.635   8.645   5.306
  362   HG23  THR  49          HG23      THR  49   0.131   7.066   4.710
  363    H    LEU  50           HN       LEU  50   0.921   4.216   8.819
  364    HA   LEU  50           HA       LEU  50  -0.881   4.495  11.001
  365    HB2  LEU  50           HB2      LEU  50   2.054   3.907  11.315
  366    HB3  LEU  50           HB1      LEU  50   0.709   3.272  12.242
  367    HG   LEU  50           HG       LEU  50   1.135   2.553   9.354
  368   HD11  LEU  50          HD11      LEU  50   2.226   0.514  10.129
  369   HD12  LEU  50          HD12      LEU  50   2.162   1.109  11.789
  370   HD13  LEU  50          HD13      LEU  50   3.142   1.952  10.587
  371   HD21  LEU  50          HD21      LEU  50  -1.086   2.150  10.295
  372   HD22  LEU  50          HD22      LEU  50  -0.359   1.196  11.588
  373   HD23  LEU  50          HD23      LEU  50  -0.248   0.647   9.915
  374    H    VAL  51           HN       VAL  51   2.359   5.684  10.409
  375    HA   VAL  51           HA       VAL  51   1.591   8.351  11.394
  376    HB   VAL  51           HB       VAL  51   4.287   7.022  11.678
  377   HG11  VAL  51          HG11      VAL  51   3.381   9.765  12.537
  378   HG12  VAL  51          HG12      VAL  51   4.524   9.390  11.245
  379   HG13  VAL  51          HG13      VAL  51   4.942   9.039  12.923
  380   HG21  VAL  51          HG21      VAL  51   2.732   6.145  13.304
  381   HG22  VAL  51          HG22      VAL  51   2.258   7.780  13.767
  382   HG23  VAL  51          HG23      VAL  51   3.889   7.201  14.109
  383    HA   PRO  52           HA       PRO  52   3.423   9.002   7.353
  384    HB2  PRO  52           HB2      PRO  52   2.069  11.168   6.722
  385    HB3  PRO  52           HB1      PRO  52   1.253   9.621   7.001
  386    HG2  PRO  52           HG2      PRO  52   1.324  12.041   8.720
  387    HG3  PRO  52           HG1      PRO  52   0.061  10.807   8.564
  388    HD2  PRO  52           HD2      PRO  52   2.209  10.954  10.505
  389    HD3  PRO  52           HD1      PRO  52   0.890   9.766  10.407
  390    H    GLY  53           HN       GLY  53   5.200   9.544   9.304
  391    HA2  GLY  53           HA2      GLY  53   7.183  10.678   9.498
  392    HA3  GLY  53           HA1      GLY  53   6.659  11.731   8.194
  393    HA   PRO  54           HA       PRO  54   6.337  14.114  12.232
  394    HB2  PRO  54           HB2      PRO  54   8.784  15.496  11.449
  395    HB3  PRO  54           HB1      PRO  54   8.418  14.678  12.968
  396    HG2  PRO  54           HG2      PRO  54  10.242  13.747  11.178
  397    HG3  PRO  54           HG1      PRO  54   9.322  12.692  12.267
  398    HD2  PRO  54           HD2      PRO  54   8.875  13.275   9.365
  399    HD3  PRO  54           HD1      PRO  54   8.721  11.740  10.245
  400    HA   PRO  55           HA       PRO  55   4.382  17.293   9.804
  401    HB2  PRO  55           HB2      PRO  55   5.434  19.144  11.900
  402    HB3  PRO  55           HB1      PRO  55   3.793  18.989  11.259
  403    HG2  PRO  55           HG2      PRO  55   4.409  17.991  13.647
  404    HG3  PRO  55           HG1      PRO  55   3.329  17.109  12.552
  405    HD2  PRO  55           HD2      PRO  55   6.187  16.591  13.227
  406    HD3  PRO  55           HD1      PRO  55   4.884  15.440  12.868
  407    H    GLY  56           HN       GLY  56   5.337  17.878   7.956
  408    HA2  GLY  56           HA2      GLY  56   6.706  19.268   6.633
  409    HA3  GLY  56           HA1      GLY  56   7.687  19.611   8.053
  410    H    SER  57           HN       SER  57   6.700  16.579   6.487
  411    HA   SER  57           HA       SER  57   9.314  15.470   6.864
  412    HB2  SER  57           HB2      SER  57   8.012  13.628   5.402
  413    HB3  SER  57           HB1      SER  57   7.775  13.808   7.149
  414    HG   SER  57           HG       SER  57   6.046  14.306   5.074
  415    H    SER  58           HN       SER  58  10.282  14.214   5.030
  416    HA   SER  58           HA       SER  58  10.128  15.715   2.501
  417    HB2  SER  58           HB2      SER  58  12.467  14.177   3.659
  418    HB3  SER  58           HB1      SER  58  12.462  15.042   2.124
  419    HG   SER  58           HG       SER  58  12.772  16.002   4.682
  420    H    ARG  59           HN       ARG  59   9.584  14.520   0.723
  421    HA   ARG  59           HA       ARG  59   9.305  11.635   1.127
  422    HB2  ARG  59           HB2      ARG  59   8.093  13.554  -0.838
  423    HB3  ARG  59           HB1      ARG  59   7.990  11.805  -1.067
  424    HG2  ARG  59           HG2      ARG  59   6.858  11.587   1.068
  425    HG3  ARG  59           HG1      ARG  59   7.008  13.322   1.344
  426    HD2  ARG  59           HD2      ARG  59   5.641  13.717  -0.683
  427    HD3  ARG  59           HD1      ARG  59   5.437  11.969  -0.845
  428    HE   ARG  59           HE       ARG  59   4.533  12.274   1.603
  429   HH11  ARG  59          HH11      ARG  59   3.971  14.385  -1.144
  430   HH12  ARG  59          HH12      ARG  59   2.405  14.892  -0.573
  431   HH21  ARG  59          HH21      ARG  59   2.556  12.979   2.370
  432   HH22  ARG  59          HH22      ARG  59   1.591  14.079   1.427
  433    HA   PRO  60           HA       PRO  60  13.210  11.108  -0.944
  434    HB2  PRO  60           HB2      PRO  60  12.793   8.374  -1.287
  435    HB3  PRO  60           HB1      PRO  60  13.560   9.137   0.107
  436    HG2  PRO  60           HG2      PRO  60  10.733   8.236  -0.244
  437    HG3  PRO  60           HG1      PRO  60  11.786   8.111   1.179
  438    HD2  PRO  60           HD2      PRO  60   9.898   9.976   1.083
  439    HD3  PRO  60           HD1      PRO  60  11.504  10.357   1.740
  440    H    VAL  61           HN       VAL  61  13.899  10.867  -3.028
  441    HA   VAL  61           HA       VAL  61  11.813  10.614  -5.063
  442    HB   VAL  61           HB       VAL  61  14.683  11.458  -5.479
  443   HG11  VAL  61          HG11      VAL  61  12.200  11.838  -7.143
  444   HG12  VAL  61          HG12      VAL  61  13.553  10.767  -7.501
  445   HG13  VAL  61          HG13      VAL  61  13.785  12.515  -7.513
  446   HG21  VAL  61          HG21      VAL  61  13.679  12.977  -3.878
  447   HG22  VAL  61          HG22      VAL  61  12.283  13.199  -4.934
  448   HG23  VAL  61          HG23      VAL  61  13.872  13.779  -5.438
  449    H    LYS  62           HN       LYS  62  12.147   9.222  -6.860
  450    HA   LYS  62           HA       LYS  62  13.362   6.726  -6.188
  451    HB2  LYS  62           HB2      LYS  62  12.051   7.776  -8.709
  452    HB3  LYS  62           HB1      LYS  62  12.721   6.153  -8.588
  453    HG2  LYS  62           HG2      LYS  62  11.187   5.668  -6.736
  454    HG3  LYS  62           HG1      LYS  62  10.506   7.289  -6.880
  455    HD2  LYS  62           HD2      LYS  62   9.622   6.814  -9.033
  456    HD3  LYS  62           HD1      LYS  62  10.534   5.307  -9.145
  457    HE2  LYS  62           HE2      LYS  62   9.241   4.472  -7.175
  458    HE3  LYS  62           HE1      LYS  62   8.245   5.923  -7.287
  459    HZ1  LYS  62           HZ1      LYS  62   7.238   4.025  -8.407
  460    HZ2  LYS  62           HZ2      LYS  62   8.567   3.896  -9.440
  461    HZ3  LYS  62           HZ3      LYS  62   7.573   5.272  -9.499
  462    H    GLY  63           HN       GLY  63  15.327   6.136  -6.481
  463    HA2  GLY  63           HA2      GLY  63  17.289   6.150  -8.055
  464    HA3  GLY  63           HA1      GLY  63  17.115   7.904  -8.010
  465    H    GLN  64           HN       GLN  64  16.281   7.826  -5.196
  466    HA   GLN  64           HA       GLN  64  18.927   7.707  -3.978
  467    HB2  GLN  64           HB2      GLN  64  16.496   8.228  -2.342
  468    HB3  GLN  64           HB1      GLN  64  18.093   8.979  -2.266
  469    HG2  GLN  64           HG2      GLN  64  15.905   9.571  -4.251
  470    HG3  GLN  64           HG1      GLN  64  16.410  10.575  -2.904
  471   HE21  GLN  64          HE21      GLN  64  18.650   8.953  -5.099
  472   HE22  GLN  64          HE22      GLN  64  19.252  10.411  -5.808
  473    H    VAL  65           HN       VAL  65  19.571   6.191  -2.505
  474    HA   VAL  65           HA       VAL  65  17.832   3.880  -2.276
  475    HB   VAL  65           HB       VAL  65  19.638   2.658  -1.339
  476   HG11  VAL  65          HG11      VAL  65  20.686   4.423  -3.540
  477   HG12  VAL  65          HG12      VAL  65  19.767   2.931  -3.726
  478   HG13  VAL  65          HG13      VAL  65  21.391   2.884  -3.041
  479   HG21  VAL  65          HG21      VAL  65  20.535   4.176   0.241
  480   HG22  VAL  65          HG22      VAL  65  21.066   5.284  -1.027
  481   HG23  VAL  65          HG23      VAL  65  21.839   3.708  -0.850
  482    H    VAL  66           HN       VAL  66  16.719   3.381  -0.551
  483    HA   VAL  66           HA       VAL  66  16.838   5.231   1.735
  484    HB   VAL  66           HB       VAL  66  14.379   5.162   1.834
  485   HG11  VAL  66          HG11      VAL  66  15.567   6.105  -0.773
  486   HG12  VAL  66          HG12      VAL  66  15.329   7.042   0.699
  487   HG13  VAL  66          HG13      VAL  66  13.938   6.507  -0.233
  488   HG21  VAL  66          HG21      VAL  66  14.249   2.952   0.568
  489   HG22  VAL  66          HG22      VAL  66  14.414   3.919  -0.905
  490   HG23  VAL  66          HG23      VAL  66  13.041   4.174   0.171
  491    H    THR  67           HN       THR  67  16.302   4.412   3.731
  492    HA   THR  67           HA       THR  67  16.504   1.508   3.918
  493    HB   THR  67           HB       THR  67  16.823   1.948   6.360
  494    HG1  THR  67           HG1      THR  67  17.451   4.262   6.748
  495   HG21  THR  67          HG21      THR  67  18.731   3.282   4.451
  496   HG22  THR  67          HG22      THR  67  18.772   1.611   5.014
  497   HG23  THR  67          HG23      THR  67  19.093   2.927   6.140
  498    H    VAL  68           HN       VAL  68  14.602   0.485   3.891
  499    HA   VAL  68           HA       VAL  68  12.488   1.641   5.561
  500    HB   VAL  68           HB       VAL  68  10.896   0.117   4.416
  501   HG11  VAL  68          HG11      VAL  68  11.105   2.414   3.669
  502   HG12  VAL  68          HG12      VAL  68  10.817   1.350   2.291
  503   HG13  VAL  68          HG13      VAL  68  12.438   1.972   2.603
  504   HG21  VAL  68          HG21      VAL  68  11.587  -0.954   2.311
  505   HG22  VAL  68          HG22      VAL  68  12.423  -1.617   3.716
  506   HG23  VAL  68          HG23      VAL  68  13.256  -0.491   2.644
  507    H    HIS  69           HN       HIS  69  11.655   0.457   7.247
  508    HA   HIS  69           HA       HIS  69  12.857  -2.192   7.683
  509    HB2  HIS  69           HB2      HIS  69  12.968  -0.747   9.664
  510    HB3  HIS  69           HB1      HIS  69  11.243  -0.413   9.555
  511    HD1  HIS  69           HD1      HIS  69  12.719  -1.822  12.071
  512    HD2  HIS  69           HD2      HIS  69  10.487  -3.676   9.102
  513    HE1  HIS  69           HE1      HIS  69  11.926  -4.037  13.028
  514    HE2  HIS  69           HE2      HIS  69  10.488  -5.032  11.281
  515    H    LEU  70           HN       LEU  70  11.689  -3.826   6.870
  516    HA   LEU  70           HA       LEU  70   8.795  -3.432   6.916
  517    HB2  LEU  70           HB2      LEU  70   8.469  -4.275   4.862
  518    HB3  LEU  70           HB1      LEU  70  10.079  -3.640   4.611
  519    HG   LEU  70           HG       LEU  70   9.535  -6.504   5.347
  520   HD11  LEU  70          HD11      LEU  70   9.960  -5.302   2.610
  521   HD12  LEU  70          HD12      LEU  70   8.450  -5.981   3.220
  522   HD13  LEU  70          HD13      LEU  70   9.852  -7.025   2.980
  523   HD21  LEU  70          HD21      LEU  70  11.797  -5.696   5.811
  524   HD22  LEU  70          HD22      LEU  70  11.944  -5.145   4.141
  525   HD23  LEU  70          HD23      LEU  70  11.787  -6.868   4.493
  526    H    GLN  71           HN       GLN  71   7.605  -4.859   7.853
  527    HA   GLN  71           HA       GLN  71   8.581  -7.617   8.081
  528    HB2  GLN  71           HB2      GLN  71   6.667  -6.725  10.134
  529    HB3  GLN  71           HB1      GLN  71   7.972  -7.892  10.263
  530    HG2  GLN  71           HG2      GLN  71   8.819  -6.311  11.606
  531    HG3  GLN  71           HG1      GLN  71   9.445  -5.725  10.070
  532   HE21  GLN  71          HE21      GLN  71   6.698  -4.901   9.270
  533   HE22  GLN  71          HE22      GLN  71   6.464  -3.402  10.096
  534    H    THR  72           HN       THR  72   7.322  -8.793   6.966
  535    HA   THR  72           HA       THR  72   4.915  -7.522   5.935
  536    HB   THR  72           HB       THR  72   6.622  -9.707   4.785
  537    HG1  THR  72           HG1      THR  72   7.206  -7.953   3.326
  538   HG21  THR  72          HG21      THR  72   4.302  -9.812   4.045
  539   HG22  THR  72          HG22      THR  72   5.367  -9.294   2.736
  540   HG23  THR  72          HG23      THR  72   4.374  -8.109   3.590
  541    H    SER  73           HN       SER  73   3.012  -8.337   6.330
  542    HA   SER  73           HA       SER  73   2.857 -11.003   7.547
  543    HB2  SER  73           HB2      SER  73   1.957  -8.968   8.801
  544    HB3  SER  73           HB1      SER  73   0.754  -8.819   7.528
  545    HG   SER  73           HG       SER  73  -0.283 -10.517   8.266
  546    H    LEU  74           HN       LEU  74   1.312 -12.422   6.823
  547    HA   LEU  74           HA       LEU  74   0.504 -12.173   4.076
  548    HB2  LEU  74           HB2      LEU  74   0.044 -14.272   6.182
  549    HB3  LEU  74           HB1      LEU  74  -0.555 -14.406   4.544
  550    HG   LEU  74           HG       LEU  74   2.245 -14.575   5.554
  551   HD11  LEU  74          HD11      LEU  74   0.990 -16.627   5.239
  552   HD12  LEU  74          HD12      LEU  74   2.311 -16.518   4.075
  553   HD13  LEU  74          HD13      LEU  74   0.657 -16.184   3.565
  554   HD21  LEU  74          HD21      LEU  74   2.348 -12.828   3.869
  555   HD22  LEU  74          HD22      LEU  74   1.488 -13.859   2.724
  556   HD23  LEU  74          HD23      LEU  74   3.101 -14.309   3.273
  557    H    GLU  75           HN       GLU  75  -1.765 -12.545   3.441
  558    HA   GLU  75           HA       GLU  75  -3.609 -10.810   4.559
  559    HB2  GLU  75           HB2      GLU  75  -5.311 -12.111   3.274
  560    HB3  GLU  75           HB1      GLU  75  -3.900 -11.659   2.328
  561    HG2  GLU  75           HG2      GLU  75  -2.994 -13.914   2.619
  562    HG3  GLU  75           HG1      GLU  75  -4.433 -14.358   3.534
  563    H    ASN  76           HN       ASN  76  -2.698 -13.991   5.492
  564    HA   ASN  76           HA       ASN  76  -5.014 -14.577   7.092
  565    HB2  ASN  76           HB2      ASN  76  -2.314 -15.938   7.015
  566    HB3  ASN  76           HB1      ASN  76  -3.758 -16.569   7.795
  567   HD21  ASN  76          HD21      ASN  76  -2.115 -16.053   4.797
  568   HD22  ASN  76          HD22      ASN  76  -3.211 -16.933   3.796
  569    H    GLY  77           HN       GLY  77  -2.274 -12.656   7.528
  570    HA2  GLY  77           HA2      GLY  77  -1.918 -11.341   9.473
  571    HA3  GLY  77           HA1      GLY  77  -2.765 -12.562  10.418
  572    H    THR  78           HN       THR  78  -0.478 -13.727   8.179
  573    HA   THR  78           HA       THR  78   1.287 -14.464  10.386
  574    HB   THR  78           HB       THR  78   1.238 -15.650   7.616
  575    HG1  THR  78           HG1      THR  78  -0.362 -16.939   8.249
  576   HG21  THR  78          HG21      THR  78   2.280 -16.674  10.260
  577   HG22  THR  78          HG22      THR  78   3.253 -16.115   8.901
  578   HG23  THR  78          HG23      THR  78   2.279 -17.575   8.745
  579    H    ARG  79           HN       ARG  79   2.959 -13.106  10.640
  580    HA   ARG  79           HA       ARG  79   4.053 -11.658   8.421
  581    HB2  ARG  79           HB2      ARG  79   4.935 -11.923  11.290
  582    HB3  ARG  79           HB1      ARG  79   5.787 -10.940  10.102
  583    HG2  ARG  79           HG2      ARG  79   3.261 -10.067   9.751
  584    HG3  ARG  79           HG1      ARG  79   3.239 -10.466  11.471
  585    HD2  ARG  79           HD2      ARG  79   5.121  -9.039  11.888
  586    HD3  ARG  79           HD1      ARG  79   5.330  -8.735  10.158
  587    HE   ARG  79           HE       ARG  79   2.761  -7.916  10.745
  588   HH11  ARG  79          HH11      ARG  79   5.914  -7.084  12.047
  589   HH12  ARG  79          HH12      ARG  79   5.514  -5.398  12.245
  590   HH21  ARG  79          HH21      ARG  79   2.246  -5.692  11.086
  591   HH22  ARG  79          HH22      ARG  79   3.461  -4.623  11.727
  592    H    VAL  80           HN       VAL  80   5.408 -12.374   7.012
  593    HA   VAL  80           HA       VAL  80   6.547 -15.032   7.456
  594    HB   VAL  80           HB       VAL  80   6.680 -15.133   5.003
  595   HG11  VAL  80          HG11      VAL  80   3.996 -14.372   6.103
  596   HG12  VAL  80          HG12      VAL  80   4.727 -15.976   6.146
  597   HG13  VAL  80          HG13      VAL  80   4.270 -15.253   4.602
  598   HG21  VAL  80          HG21      VAL  80   5.358 -12.426   5.106
  599   HG22  VAL  80          HG22      VAL  80   5.571 -13.403   3.652
  600   HG23  VAL  80          HG23      VAL  80   6.980 -12.774   4.505
  601    H    GLN  81           HN       GLN  81   7.491 -11.826   7.331
  602    HA   GLN  81           HA       GLN  81  10.262 -12.536   7.284
  603    HB2  GLN  81           HB2      GLN  81  10.883 -11.176   5.356
  604    HB3  GLN  81           HB1      GLN  81   9.769 -12.443   4.868
  605    HG2  GLN  81           HG2      GLN  81   7.937 -10.850   4.827
  606    HG3  GLN  81           HG1      GLN  81   9.030  -9.566   5.351
  607   HE21  GLN  81          HE21      GLN  81   7.909 -11.509   2.778
  608   HE22  GLN  81          HE22      GLN  81   8.782 -10.726   1.504
  609    H    GLU  82           HN       GLU  82  11.390 -11.127   8.489
  610    HA   GLU  82           HA       GLU  82  10.356  -8.400   8.754
  611    HB2  GLU  82           HB2      GLU  82   9.734  -9.539  10.825
  612    HB3  GLU  82           HB1      GLU  82  11.394 -10.092  11.036
  613    HG2  GLU  82           HG2      GLU  82  12.147  -7.792  11.263
  614    HG3  GLU  82           HG1      GLU  82  10.498  -7.217  11.016
  615    H    GLU  83           HN       GLU  83  11.796  -6.981   8.212
  616    HA   GLU  83           HA       GLU  83  14.615  -7.519   8.701
  617    HB2  GLU  83           HB2      GLU  83  14.656  -8.094   6.484
  618    HB3  GLU  83           HB1      GLU  83  13.267  -7.102   6.085
  619    HG2  GLU  83           HG2      GLU  83  14.551  -5.191   5.830
  620    HG3  GLU  83           HG1      GLU  83  15.907  -5.867   6.741
  621    HA   PRO  84           HA       PRO  84  13.892  -3.692  10.641
  622    HB2  PRO  84           HB2      PRO  84  16.360  -3.355  11.684
  623    HB3  PRO  84           HB1      PRO  84  15.223  -4.559  12.301
  624    HG2  PRO  84           HG2      PRO  84  17.532  -4.918  10.430
  625    HG3  PRO  84           HG1      PRO  84  17.039  -5.926  11.804
  626    HD2  PRO  84           HD2      PRO  84  16.452  -6.552   9.225
  627    HD3  PRO  84           HD1      PRO  84  15.413  -7.004  10.589
  628    H    GLU  85           HN       GLU  85  16.087  -4.134   8.055
  629    HA   GLU  85           HA       GLU  85  15.842  -1.424   7.277
  630    HB2  GLU  85           HB2      GLU  85  17.595  -1.216   9.048
  631    HB3  GLU  85           HB1      GLU  85  18.620  -2.285   8.100
  632    HG2  GLU  85           HG2      GLU  85  18.899  -0.714   6.403
  633    HG3  GLU  85           HG1      GLU  85  17.525   0.250   6.942
  634    H    LEU  86           HN       LEU  86  15.416  -1.706   5.369
  635    HA   LEU  86           HA       LEU  86  17.115  -3.359   3.648
  636    HB2  LEU  86           HB2      LEU  86  14.918  -4.324   3.823
  637    HB3  LEU  86           HB1      LEU  86  14.163  -2.773   3.569
  638    HG   LEU  86           HG       LEU  86  14.934  -2.736   1.281
  639   HD11  LEU  86          HD11      LEU  86  15.992  -4.698   0.265
  640   HD12  LEU  86          HD12      LEU  86  16.068  -5.475   1.847
  641   HD13  LEU  86          HD13      LEU  86  17.003  -4.012   1.536
  642   HD21  LEU  86          HD21      LEU  86  12.769  -3.705   1.733
  643   HD22  LEU  86          HD22      LEU  86  13.509  -5.271   2.072
  644   HD23  LEU  86          HD23      LEU  86  13.553  -4.609   0.436
  645    H    VAL  87           HN       VAL  87  18.443  -1.877   2.764
  646    HA   VAL  87           HA       VAL  87  17.325   0.679   1.883
  647    HB   VAL  87           HB       VAL  87  19.351   0.807   3.236
  648   HG11  VAL  87          HG11      VAL  87  20.702  -0.743   1.047
  649   HG12  VAL  87          HG12      VAL  87  20.351  -1.337   2.669
  650   HG13  VAL  87          HG13      VAL  87  21.495  -0.014   2.442
  651   HG21  VAL  87          HG21      VAL  87  18.993   2.533   1.579
  652   HG22  VAL  87          HG22      VAL  87  19.829   1.565   0.363
  653   HG23  VAL  87          HG23      VAL  87  20.716   2.196   1.753
  654    H    PHE  88           HN       PHE  88  16.946   1.080  -0.194
  655    HA   PHE  88           HA       PHE  88  18.100  -0.591  -2.293
  656    HB2  PHE  88           HB2      PHE  88  15.975  -1.318  -3.132
  657    HB3  PHE  88           HB1      PHE  88  16.100  -1.799  -1.448
  658    HD1  PHE  88           HD2      PHE  88  14.819  -0.575   0.286
  659    HD2  PHE  88           HD1      PHE  88  14.284   0.170  -3.873
  660    HE1  PHE  88           HE2      PHE  88  12.695   0.559   0.769
  661    HE2  PHE  88           HE1      PHE  88  12.156   1.303  -3.401
  662    HZ   PHE  88           HZ       PHE  88  11.317   1.424  -1.085
  663    H    THR  89           HN       THR  89  17.605   0.171  -4.430
  664    HA   THR  89           HA       THR  89  17.548   3.048  -4.531
  665    HB   THR  89           HB       THR  89  17.508   1.229  -6.926
  666    HG1  THR  89           HG1      THR  89  19.155   0.371  -5.717
  667   HG21  THR  89          HG21      THR  89  17.352   3.621  -7.347
  668   HG22  THR  89          HG22      THR  89  18.930   3.027  -7.868
  669   HG23  THR  89          HG23      THR  89  18.777   3.916  -6.351
  670    H    LEU  90           HN       LEU  90  15.649   4.034  -4.354
  671    HA   LEU  90           HA       LEU  90  13.121   2.958  -4.830
  672    HB2  LEU  90           HB2      LEU  90  13.803   5.124  -3.600
  673    HB3  LEU  90           HB1      LEU  90  13.749   5.871  -5.167
  674    HG   LEU  90           HG       LEU  90  11.400   5.368  -5.402
  675   HD11  LEU  90          HD11      LEU  90  11.419   3.199  -4.252
  676   HD12  LEU  90          HD12      LEU  90  10.150   4.257  -3.641
  677   HD13  LEU  90          HD13      LEU  90  11.631   4.026  -2.709
  678   HD21  LEU  90          HD21      LEU  90  12.005   7.414  -4.199
  679   HD22  LEU  90          HD22      LEU  90  12.012   6.522  -2.677
  680   HD23  LEU  90          HD23      LEU  90  10.508   6.726  -3.573
  681    H    GLY  91           HN       GLY  91  11.906   2.666  -6.630
  682    HA2  GLY  91           HA2      GLY  91  11.072   3.021  -8.754
  683    HA3  GLY  91           HA1      GLY  91  12.154   4.395  -8.915
  684    H    ASP  92           HN       ASP  92  13.741   1.595  -7.929
  685    HA   ASP  92           HA       ASP  92  14.662   1.156 -10.686
  686    HB2  ASP  92           HB2      ASP  92  16.324   2.128  -9.023
  687    HB3  ASP  92           HB1      ASP  92  16.237   0.581  -8.179
  688    H    CYS  93           HN       CYS  93  12.560  -0.001  -8.699
  689    HA   CYS  93           HA       CYS  93  11.611  -2.005  -8.215
  690    HB2  CYS  93           HB2      CYS  93  13.151  -2.980 -10.627
  691    HB3  CYS  93           HB1      CYS  93  11.708  -3.718  -9.927
  692    HG   CYS  93           HG       CYS  93  11.892  -1.490 -12.290
  693    H    ASP  94           HN       ASP  94  14.083  -1.335  -6.967
  694    HA   ASP  94           HA       ASP  94  15.844  -3.537  -6.883
  695    HB2  ASP  94           HB2      ASP  94  15.963  -0.986  -6.020
  696    HB3  ASP  94           HB1      ASP  94  15.554  -1.786  -4.512
  697    H    VAL  95           HN       VAL  95  12.784  -2.976  -5.780
  698    HA   VAL  95           HA       VAL  95  12.805  -5.214  -3.874
  699    HB   VAL  95           HB       VAL  95  11.107  -3.898  -2.538
  700   HG11  VAL  95          HG11      VAL  95  13.397  -4.145  -1.787
  701   HG12  VAL  95          HG12      VAL  95  12.799  -2.530  -1.406
  702   HG13  VAL  95          HG13      VAL  95  13.887  -2.769  -2.775
  703   HG21  VAL  95          HG21      VAL  95  10.465  -2.274  -4.208
  704   HG22  VAL  95          HG22      VAL  95  12.118  -1.664  -4.307
  705   HG23  VAL  95          HG23      VAL  95  11.172  -1.427  -2.831
  706    H    ILE  96           HN       ILE  96  10.019  -4.885  -3.262
  707    HA   ILE  96           HA       ILE  96   8.835  -5.949  -5.667
  708    HB   ILE  96           HB       ILE  96   6.846  -6.327  -4.284
  709   HG12  ILE  96          HG12      ILE  96   8.447  -5.069  -2.038
  710   HG13  ILE  96          HG11      ILE  96   7.057  -4.326  -2.833
  711   HG21  ILE  96          HG21      ILE  96   7.824  -7.964  -2.735
  712   HG22  ILE  96          HG22      ILE  96   9.407  -7.228  -2.968
  713   HG23  ILE  96          HG23      ILE  96   8.594  -8.014  -4.319
  714   HD11  ILE  96          HD11      ILE  96   6.426  -5.296  -0.706
  715   HD12  ILE  96          HD12      ILE  96   7.037  -6.872  -1.217
  716   HD13  ILE  96          HD13      ILE  96   5.644  -6.155  -2.031
  717    H    GLN  97           HN       GLN  97   7.248  -4.892  -6.823
  718    HA   GLN  97           HA       GLN  97   7.650  -2.146  -7.083
  719    HB2  GLN  97           HB2      GLN  97   6.632  -3.931  -8.735
  720    HB3  GLN  97           HB1      GLN  97   5.107  -3.340  -8.083
  721    HG2  GLN  97           HG2      GLN  97   5.448  -2.045  -9.975
  722    HG3  GLN  97           HG1      GLN  97   5.970  -1.008  -8.650
  723   HE21  GLN  97          HE21      GLN  97   8.229  -0.612  -8.371
  724   HE22  GLN  97          HE22      GLN  97   9.337  -0.886  -9.668
  725    H    ALA  98           HN       ALA  98   5.246  -3.932  -5.245
  726    HA   ALA  98           HA       ALA  98   3.454  -1.911  -4.567
  727    HB1  ALA  98           HB1      ALA  98   3.118  -4.213  -3.877
  728    HB2  ALA  98           HB2      ALA  98   3.101  -3.164  -2.463
  729    HB3  ALA  98           HB3      ALA  98   4.530  -4.134  -2.826
  730    H    LEU  99           HN       LEU  99   6.570  -2.726  -3.169
  731    HA   LEU  99           HA       LEU  99   6.397  -0.673  -1.152
  732    HB2  LEU  99           HB2      LEU  99   7.641  -2.713  -0.676
  733    HB3  LEU  99           HB1      LEU  99   8.746  -2.353  -1.995
  734    HG   LEU  99           HG       LEU  99   9.503  -0.326  -0.817
  735   HD11  LEU  99          HD11      LEU  99   7.422   0.121   0.415
  736   HD12  LEU  99          HD12      LEU  99   8.833   0.106   1.474
  737   HD13  LEU  99          HD13      LEU  99   7.740  -1.279   1.440
  738   HD21  LEU  99          HD21      LEU  99  10.722  -2.403  -0.489
  739   HD22  LEU  99          HD22      LEU  99   9.649  -2.838   0.842
  740   HD23  LEU  99          HD23      LEU  99  10.715  -1.440   0.990
  741    H    ASP 100           HN       ASP 100   7.925  -1.114  -4.239
  742    HA   ASP 100           HA       ASP 100   9.746   1.022  -4.143
  743    HB2  ASP 100           HB2      ASP 100   9.876  -0.844  -5.747
  744    HB3  ASP 100           HB1      ASP 100   8.405  -0.287  -6.521
  745    H    LEU 101           HN       LEU 101   6.375   0.785  -4.872
  746    HA   LEU 101           HA       LEU 101   6.199   3.540  -5.730
  747    HB2  LEU 101           HB2      LEU 101   4.045   1.477  -5.269
  748    HB3  LEU 101           HB1      LEU 101   3.833   3.026  -6.038
  749    HG   LEU 101           HG       LEU 101   5.477   0.742  -7.106
  750   HD11  LEU 101          HD11      LEU 101   3.769   0.564  -8.814
  751   HD12  LEU 101          HD12      LEU 101   2.864   1.885  -8.075
  752   HD13  LEU 101          HD13      LEU 101   3.062   0.361  -7.211
  753   HD21  LEU 101          HD21      LEU 101   5.689   2.116  -9.131
  754   HD22  LEU 101          HD22      LEU 101   6.463   2.858  -7.733
  755   HD23  LEU 101          HD23      LEU 101   4.899   3.452  -8.290
  756    H    SER 102           HN       SER 102   5.502   1.602  -2.891
  757    HA   SER 102           HA       SER 102   3.733   3.377  -1.625
  758    HB2  SER 102           HB2      SER 102   3.838   1.062  -0.945
  759    HB3  SER 102           HB1      SER 102   5.536   1.223  -0.499
  760    HG   SER 102           HG       SER 102   4.903   2.649   1.154
  761    H    VAL 103           HN       VAL 103   7.222   3.139  -1.669
  762    HA   VAL 103           HA       VAL 103   7.774   4.695   0.592
  763    HB   VAL 103           HB       VAL 103   9.389   4.102  -1.850
  764   HG11  VAL 103          HG11      VAL 103  10.354   5.396   0.716
  765   HG12  VAL 103          HG12      VAL 103  10.148   6.230  -0.825
  766   HG13  VAL 103          HG13      VAL 103  11.348   4.947  -0.670
  767   HG21  VAL 103          HG21      VAL 103  10.640   2.753  -0.031
  768   HG22  VAL 103          HG22      VAL 103   9.110   2.134  -0.650
  769   HG23  VAL 103          HG23      VAL 103   9.164   2.956   0.909
  770    HA   PRO 104           HA       PRO 104   8.288   8.518  -2.362
  771    HB2  PRO 104           HB2      PRO 104   6.978   8.291  -4.769
  772    HB3  PRO 104           HB1      PRO 104   8.708   8.021  -4.543
  773    HG2  PRO 104           HG2      PRO 104   6.487   6.030  -4.702
  774    HG3  PRO 104           HG1      PRO 104   8.108   5.962  -5.406
  775    HD2  PRO 104           HD2      PRO 104   7.504   4.595  -3.194
  776    HD3  PRO 104           HD1      PRO 104   9.098   5.334  -3.426
  777    H    LEU 105           HN       LEU 105   5.464   6.477  -2.294
  778    HA   LEU 105           HA       LEU 105   3.588   8.666  -2.179
  779    HB2  LEU 105           HB2      LEU 105   3.430   5.704  -1.749
  780    HB3  LEU 105           HB1      LEU 105   2.071   6.746  -1.347
  781    HG   LEU 105           HG       LEU 105   3.225   6.109  -4.034
  782   HD11  LEU 105          HD11      LEU 105   0.843   5.710  -4.544
  783   HD12  LEU 105          HD12      LEU 105   0.448   6.096  -2.868
  784   HD13  LEU 105          HD13      LEU 105   1.453   4.694  -3.238
  785   HD21  LEU 105          HD21      LEU 105   1.789   7.884  -4.987
  786   HD22  LEU 105          HD22      LEU 105   3.106   8.526  -4.010
  787   HD23  LEU 105          HD23      LEU 105   1.471   8.469  -3.356
  788    H    MET 106           HN       MET 106   5.711   7.206  -0.007
  789    HA   MET 106           HA       MET 106   4.154   8.082   2.317
  790    HB2  MET 106           HB2      MET 106   4.904   6.255   3.368
  791    HB3  MET 106           HB1      MET 106   5.478   5.704   1.805
  792    HG2  MET 106           HG2      MET 106   7.619   7.027   2.404
  793    HG3  MET 106           HG1      MET 106   6.983   6.953   4.054
  794    HE1  MET 106           HE1      MET 106   6.806   3.101   4.699
  795    HE2  MET 106           HE2      MET 106   5.508   4.111   4.054
  796    HE3  MET 106           HE3      MET 106   6.530   4.709   5.360
  797    H    ASP 107           HN       ASP 107   5.302   9.196   4.060
  798    HA   ASP 107           HA       ASP 107   7.267  11.098   2.965
  799    HB2  ASP 107           HB2      ASP 107   5.420  11.132   5.355
  800    HB3  ASP 107           HB1      ASP 107   6.743  12.280   5.208
  801    H    VAL 108           HN       VAL 108   9.177  11.631   4.173
  802    HA   VAL 108           HA       VAL 108  10.503   9.338   5.117
  803    HB   VAL 108           HB       VAL 108  11.376  11.731   4.207
  804   HG11  VAL 108          HG11      VAL 108  12.071  11.761   7.136
  805   HG12  VAL 108          HG12      VAL 108  10.944  12.862   6.350
  806   HG13  VAL 108          HG13      VAL 108  12.648  12.878   5.899
  807   HG21  VAL 108          HG21      VAL 108  13.626  10.911   4.702
  808   HG22  VAL 108          HG22      VAL 108  12.571   9.612   4.140
  809   HG23  VAL 108          HG23      VAL 108  12.951   9.762   5.855
  810    H    GLY 109           HN       GLY 109  10.657   8.454   6.970
  811    HA2  GLY 109           HA2      GLY 109  10.954   8.400   9.314
  812    HA3  GLY 109           HA1      GLY 109  10.223   9.993   9.417
  813    H    GLU 110           HN       GLU 110   8.416   8.002   7.370
  814    HA   GLU 110           HA       GLU 110   6.440   7.764   9.505
  815    HB2  GLU 110           HB2      GLU 110   4.762   7.804   7.932
  816    HB3  GLU 110           HB1      GLU 110   5.957   8.867   7.208
  817    HG2  GLU 110           HG2      GLU 110   6.550   7.252   5.610
  818    HG3  GLU 110           HG1      GLU 110   5.713   5.968   6.481
  819    H    THR 111           HN       THR 111   5.000   5.878   9.453
  820    HA   THR 111           HA       THR 111   6.308   3.459   8.466
  821    HB   THR 111           HB       THR 111   4.721   3.558  11.038
  822    HG1  THR 111           HG1      THR 111   7.146   4.513  10.639
  823   HG21  THR 111          HG21      THR 111   5.785   1.366  11.420
  824   HG22  THR 111          HG22      THR 111   6.578   1.487   9.848
  825   HG23  THR 111          HG23      THR 111   4.821   1.375   9.942
  826    H    ALA 112           HN       ALA 112   5.049   2.553   6.975
  827    HA   ALA 112           HA       ALA 112   2.164   3.113   7.119
  828    HB1  ALA 112           HB1      ALA 112   3.307   4.338   5.300
  829    HB2  ALA 112           HB2      ALA 112   2.104   3.191   4.709
  830    HB3  ALA 112           HB3      ALA 112   3.819   2.792   4.621
  831    H    MET 113           HN       MET 113   0.822   1.448   6.896
  832    HA   MET 113           HA       MET 113   2.032  -1.194   6.463
  833    HB2  MET 113           HB2      MET 113   0.792  -1.107   8.518
  834    HB3  MET 113           HB1      MET 113  -0.583  -0.339   7.731
  835    HG2  MET 113           HG2      MET 113  -1.195  -2.298   6.633
  836    HG3  MET 113           HG1      MET 113   0.359  -3.076   6.953
  837    HE1  MET 113           HE1      MET 113  -3.036  -2.425   9.987
  838    HE2  MET 113           HE2      MET 113  -3.193  -2.230   8.242
  839    HE3  MET 113           HE3      MET 113  -2.213  -1.096   9.171
  840    H    VAL 114           HN       VAL 114   1.815  -1.978   4.484
  841    HA   VAL 114           HA       VAL 114  -0.271  -0.830   2.739
  842    HB   VAL 114           HB       VAL 114   2.252  -2.178   1.845
  843   HG11  VAL 114          HG11      VAL 114   0.502  -1.965   0.153
  844   HG12  VAL 114          HG12      VAL 114   1.917  -0.989  -0.240
  845   HG13  VAL 114          HG13      VAL 114   0.472  -0.221   0.418
  846   HG21  VAL 114          HG21      VAL 114   2.895  -0.352   3.262
  847   HG22  VAL 114          HG22      VAL 114   1.829   0.736   2.372
  848   HG23  VAL 114          HG23      VAL 114   3.244   0.040   1.579
  849    H    THR 115           HN       THR 115  -1.722  -2.235   1.797
  850    HA   THR 115           HA       THR 115  -0.938  -5.059   1.934
  851    HB   THR 115           HB       THR 115  -3.771  -4.002   1.837
  852    HG1  THR 115           HG1      THR 115  -2.019  -4.536   3.897
  853   HG21  THR 115          HG21      THR 115  -4.390  -6.307   2.192
  854   HG22  THR 115          HG22      THR 115  -2.690  -6.773   2.294
  855   HG23  THR 115          HG23      THR 115  -3.359  -6.196   0.763
  856    H    ALA 116           HN       ALA 116  -0.279  -5.719   0.183
  857    HA   ALA 116           HA       ALA 116  -1.346  -4.718  -2.386
  858    HB1  ALA 116           HB1      ALA 116   0.853  -3.779  -1.954
  859    HB2  ALA 116           HB2      ALA 116   0.901  -4.919  -3.299
  860    HB3  ALA 116           HB3      ALA 116   1.503  -5.400  -1.713
  861    H    ASP 117           HN       ASP 117  -1.930  -6.267  -3.799
  862    HA   ASP 117           HA       ASP 117  -2.124  -8.953  -3.194
  863    HB2  ASP 117           HB2      ASP 117  -3.147  -7.695  -5.192
  864    HB3  ASP 117           HB1      ASP 117  -1.600  -7.956  -5.968
  865    H    SER 118           HN       SER 118  -0.851 -10.760  -3.728
  866    HA   SER 118           HA       SER 118   1.875 -10.539  -3.301
  867    HB2  SER 118           HB2      SER 118   0.267 -12.589  -3.183
  868    HB3  SER 118           HB1      SER 118   0.719 -12.818  -4.873
  869    HG   SER 118           HG       SER 118   2.014 -13.941  -3.220
  870    H    LYS 119           HN       LYS 119   0.037 -10.377  -6.265
  871    HA   LYS 119           HA       LYS 119   2.042 -10.691  -8.159
  872    HB2  LYS 119           HB2      LYS 119   0.662  -9.117  -9.551
  873    HB3  LYS 119           HB1      LYS 119  -0.211 -10.500  -8.891
  874    HG2  LYS 119           HG2      LYS 119  -1.148  -9.081  -7.175
  875    HG3  LYS 119           HG1      LYS 119  -0.185  -7.720  -7.759
  876    HD2  LYS 119           HD2      LYS 119  -2.417  -7.504  -8.609
  877    HD3  LYS 119           HD1      LYS 119  -1.337  -7.896  -9.950
  878    HE2  LYS 119           HE2      LYS 119  -2.016 -10.298  -9.654
  879    HE3  LYS 119           HE1      LYS 119  -3.233  -9.742  -8.506
  880    HZ1  LYS 119           HZ1      LYS 119  -4.337  -9.920 -10.552
  881    HZ2  LYS 119           HZ2      LYS 119  -3.080  -9.179 -11.413
  882    HZ3  LYS 119           HZ3      LYS 119  -4.047  -8.254 -10.373
  883    H    TYR 120           HN       TYR 120   1.405  -7.954  -6.021
  884    HA   TYR 120           HA       TYR 120   3.512  -6.395  -7.325
  885    HB2  TYR 120           HB2      TYR 120   1.780  -5.698  -4.948
  886    HB3  TYR 120           HB1      TYR 120   2.862  -4.600  -5.798
  887    HD1  TYR 120           HD1      TYR 120   2.285  -3.718  -7.947
  888    HD2  TYR 120           HD2      TYR 120  -0.327  -6.345  -5.880
  889    HE1  TYR 120           HE1      TYR 120   0.453  -3.121  -9.498
  890    HE2  TYR 120           HE2      TYR 120  -2.167  -5.768  -7.397
  891    HH   TYR 120           HH       TYR 120  -2.814  -3.937  -8.914
  892    H    CYS 121           HN       CYS 121   3.409  -8.848  -5.298
  893    HA   CYS 121           HA       CYS 121   5.583  -7.869  -3.586
  894    HB2  CYS 121           HB2      CYS 121   3.404  -9.819  -2.842
  895    HB3  CYS 121           HB1      CYS 121   4.716  -9.290  -1.793
  896    HG   CYS 121           HG       CYS 121   1.816  -7.800  -2.492
  897    H    TYR 122           HN       TYR 122   4.331 -11.187  -3.637
  898    HA   TYR 122           HA       TYR 122   6.549 -12.002  -5.356
  899    HB2  TYR 122           HB2      TYR 122   6.118 -13.475  -2.759
  900    HB3  TYR 122           HB1      TYR 122   7.457 -13.590  -3.879
  901    HD1  TYR 122           HD2      TYR 122   9.247 -11.945  -3.885
  902    HD2  TYR 122           HD1      TYR 122   6.029 -11.669  -1.103
  903    HE1  TYR 122           HE2      TYR 122  10.551 -10.364  -2.533
  904    HE2  TYR 122           HE1      TYR 122   7.321 -10.088   0.239
  905    HH   TYR 122           HH       TYR 122  10.322  -8.721  -0.878
  906    H    GLY 123           HN       GLY 123   3.735 -11.997  -5.947
  907    HA2  GLY 123           HA2      GLY 123   2.347 -14.332  -5.521
  908    HA3  GLY 123           HA1      GLY 123   2.245 -13.391  -6.997
  909    HA   PRO 124           HA       PRO 124   4.243 -16.864  -8.976
  910    HB2  PRO 124           HB2      PRO 124   5.176 -15.300 -11.177
  911    HB3  PRO 124           HB1      PRO 124   3.719 -16.288 -11.107
  912    HG2  PRO 124           HG2      PRO 124   3.780 -13.518 -11.296
  913    HG3  PRO 124           HG1      PRO 124   2.391 -14.482 -10.775
  914    HD2  PRO 124           HD2      PRO 124   4.365 -12.959  -9.139
  915    HD3  PRO 124           HD1      PRO 124   2.632 -13.232  -8.857
  916    H    GLN 125           HN       GLN 125   5.770 -14.702  -7.285
  917    HA   GLN 125           HA       GLN 125   8.444 -15.030  -8.489
  918    HB2  GLN 125           HB2      GLN 125   7.819 -13.130  -6.252
  919    HB3  GLN 125           HB1      GLN 125   9.091 -13.038  -7.460
  920    HG2  GLN 125           HG2      GLN 125   7.563 -12.370  -9.146
  921    HG3  GLN 125           HG1      GLN 125   6.176 -12.715  -8.110
  922   HE21  GLN 125          HE21      GLN 125   5.318 -10.694  -8.077
  923   HE22  GLN 125          HE22      GLN 125   6.087  -9.354  -7.307
  924    H    GLY 126           HN       GLY 126   6.700 -15.022  -5.434
  925    HA2  GLY 126           HA2      GLY 126   6.963 -16.265  -3.545
  926    HA3  GLY 126           HA1      GLY 126   8.273 -17.145  -4.319
  927    H    SER 127           HN       SER 127   7.925 -15.866  -1.660
  928    HA   SER 127           HA       SER 127   9.854 -13.745  -1.707
  929    HB2  SER 127           HB2      SER 127   7.957 -13.277  -0.364
  930    HB3  SER 127           HB1      SER 127   8.034 -14.838   0.420
  931    HG   SER 127           HG       SER 127   9.891 -12.700   0.693
  932    H    ARG 128           HN       ARG 128  11.686 -13.649  -0.432
  933    HA   ARG 128           HA       ARG 128  13.508 -15.634  -0.654
  934    HB2  ARG 128           HB2      ARG 128  14.686 -14.398   1.310
  935    HB3  ARG 128           HB1      ARG 128  14.393 -13.554  -0.202
  936    HG2  ARG 128           HG2      ARG 128  12.358 -12.561   0.804
  937    HG3  ARG 128           HG1      ARG 128  12.789 -13.319   2.336
  938    HD2  ARG 128           HD2      ARG 128  14.812 -12.044   2.470
  939    HD3  ARG 128           HD1      ARG 128  14.578 -11.408   0.842
  940    HE   ARG 128           HE       ARG 128  12.340 -10.722   2.371
  941   HH11  ARG 128          HH11      ARG 128  15.765  -9.952   2.231
  942   HH12  ARG 128          HH12      ARG 128  15.546  -8.352   2.880
  943   HH21  ARG 128          HH21      ARG 128  12.081  -8.608   3.205
  944   HH22  ARG 128          HH22      ARG 128  13.486  -7.596   3.423
  945    H    SER 129           HN       SER 129  11.630 -15.026   2.345
  946    HA   SER 129           HA       SER 129  12.738 -17.426   3.492
  947    HB2  SER 129           HB2      SER 129  10.532 -15.637   4.543
  948    HB3  SER 129           HB1      SER 129  11.303 -16.952   5.431
  949    HG   SER 129           HG       SER 129  13.242 -15.822   5.356
  950    HA   PRO 130           HA       PRO 130   8.715 -19.330   2.173
  951    HB2  PRO 130           HB2      PRO 130   6.373 -17.871   2.380
  952    HB3  PRO 130           HB1      PRO 130   7.105 -18.762   3.710
  953    HG2  PRO 130           HG2      PRO 130   6.789 -15.957   3.517
  954    HG3  PRO 130           HG1      PRO 130   7.711 -16.837   4.744
  955    HD2  PRO 130           HD2      PRO 130   8.669 -15.554   2.213
  956    HD3  PRO 130           HD1      PRO 130   9.465 -15.654   3.798
  957    H    TYR 131           HN       TYR 131   8.679 -19.639  -0.076
  958    HA   TYR 131           HA       TYR 131   8.068 -17.762  -2.008
  959    HB2  TYR 131           HB2      TYR 131   8.749 -20.035  -2.615
  960    HB3  TYR 131           HB1      TYR 131   7.256 -20.684  -1.946
  961    HD1  TYR 131           HD1      TYR 131   5.078 -20.204  -3.101
  962    HD2  TYR 131           HD2      TYR 131   8.820 -19.130  -4.817
  963    HE1  TYR 131           HE1      TYR 131   4.005 -19.989  -5.307
  964    HE2  TYR 131           HE2      TYR 131   7.760 -18.909  -7.018
  965    HH   TYR 131           HH       TYR 131   5.763 -19.791  -8.181
  966    H    ILE 132           HN       ILE 132   6.533 -16.300  -1.504
  967    HA   ILE 132           HA       ILE 132   4.140 -16.888  -0.155
  968    HB   ILE 132           HB       ILE 132   4.683 -14.519  -1.947
  969   HG12  ILE 132          HG12      ILE 132   6.436 -14.521  -0.350
  970   HG13  ILE 132          HG11      ILE 132   5.259 -13.310   0.159
  971   HG21  ILE 132          HG21      ILE 132   3.020 -13.400  -0.512
  972   HG22  ILE 132          HG22      ILE 132   2.747 -14.934   0.319
  973   HG23  ILE 132          HG23      ILE 132   2.354 -14.770  -1.395
  974   HD11  ILE 132          HD11      ILE 132   4.444 -14.754   1.870
  975   HD12  ILE 132          HD12      ILE 132   6.202 -14.639   1.985
  976   HD13  ILE 132          HD13      ILE 132   5.458 -16.079   1.288
  977    HA   PRO 133           HA       PRO 133   1.836 -18.834  -3.473
  978    HB2  PRO 133           HB2      PRO 133  -0.423 -17.683  -1.892
  979    HB3  PRO 133           HB1      PRO 133  -0.204 -19.325  -2.512
  980    HG2  PRO 133           HG2      PRO 133   0.177 -18.796   0.063
  981    HG3  PRO 133           HG1      PRO 133   1.244 -19.921  -0.800
  982    HD2  PRO 133           HD2      PRO 133   1.751 -17.103   0.054
  983    HD3  PRO 133           HD1      PRO 133   2.869 -18.478  -0.020
  984    HA   PRO 134           HA       PRO 134   1.111 -15.394  -6.138
  985    HB2  PRO 134           HB2      PRO 134  -0.582 -16.539  -7.946
  986    HB3  PRO 134           HB1      PRO 134   1.164 -16.816  -7.930
  987    HG2  PRO 134           HG2      PRO 134  -1.022 -18.528  -6.807
  988    HG3  PRO 134           HG1      PRO 134   0.419 -19.014  -7.724
  989    HD2  PRO 134           HD2      PRO 134   0.291 -19.244  -5.042
  990    HD3  PRO 134           HD1      PRO 134   1.806 -18.836  -5.872
  991    H    HIS 135           HN       HIS 135  -0.158 -13.733  -6.008
  992    HA   HIS 135           HA       HIS 135  -1.946 -12.375  -5.773
  993    HB2  HIS 135           HB2      HIS 135  -3.593 -14.898  -6.012
  994    HB3  HIS 135           HB1      HIS 135  -4.258 -13.267  -5.976
  995    HD1  HIS 135           HD1      HIS 135  -4.118 -15.593  -8.335
  996    HD2  HIS 135           HD2      HIS 135  -2.272 -11.871  -8.174
  997    HE1  HIS 135           HE1      HIS 135  -3.607 -14.987 -10.719
  998    HE2  HIS 135           HE2      HIS 135  -2.694 -12.642 -10.613
  999    H    ALA 136           HN       ALA 136  -0.837 -14.349  -3.499
 1000    HA   ALA 136           HA       ALA 136  -2.840 -14.125  -1.478
 1001    HB1  ALA 136           HB1      ALA 136  -1.044 -14.672   0.097
 1002    HB2  ALA 136           HB2      ALA 136   0.150 -14.455  -1.183
 1003    HB3  ALA 136           HB3      ALA 136  -1.027 -15.765  -1.286
 1004    H    ALA 137           HN       ALA 137  -3.404 -12.335  -0.356
 1005    HA   ALA 137           HA       ALA 137  -2.209  -9.861  -1.206
 1006    HB1  ALA 137           HB1      ALA 137  -3.902  -8.769   0.129
 1007    HB2  ALA 137           HB2      ALA 137  -4.300 -10.286   0.931
 1008    HB3  ALA 137           HB3      ALA 137  -4.636 -10.085  -0.788
 1009    H    LEU 138           HN       LEU 138  -0.416  -9.134  -0.415
 1010    HA   LEU 138           HA       LEU 138   0.536  -9.995   2.176
 1011    HB2  LEU 138           HB2      LEU 138   1.710  -9.236  -0.302
 1012    HB3  LEU 138           HB1      LEU 138   2.305  -8.149   0.941
 1013    HG   LEU 138           HG       LEU 138   3.089 -10.034   2.252
 1014   HD11  LEU 138          HD11      LEU 138   2.002 -11.711   0.015
 1015   HD12  LEU 138          HD12      LEU 138   1.375 -11.617   1.661
 1016   HD13  LEU 138          HD13      LEU 138   2.974 -12.298   1.365
 1017   HD21  LEU 138          HD21      LEU 138   4.858 -10.817   0.780
 1018   HD22  LEU 138          HD22      LEU 138   4.589  -9.083   0.588
 1019   HD23  LEU 138          HD23      LEU 138   3.966 -10.213  -0.617
 1020    H    CYS 139           HN       CYS 139   0.562  -8.746   3.935
 1021    HA   CYS 139           HA       CYS 139   0.036  -5.881   3.577
 1022    HB2  CYS 139           HB2      CYS 139  -1.940  -6.824   4.504
 1023    HB3  CYS 139           HB1      CYS 139  -1.037  -7.758   5.680
 1024    HG   CYS 139           HG       CYS 139  -2.552  -5.107   6.298
 1025    H    LEU 140           HN       LEU 140   1.901  -4.988   3.818
 1026    HA   LEU 140           HA       LEU 140   3.771  -6.012   5.841
 1027    HB2  LEU 140           HB2      LEU 140   5.538  -5.055   4.365
 1028    HB3  LEU 140           HB1      LEU 140   4.668  -6.420   3.689
 1029    HG   LEU 140           HG       LEU 140   3.244  -4.272   2.739
 1030   HD11  LEU 140          HD11      LEU 140   4.901  -2.702   3.572
 1031   HD12  LEU 140          HD12      LEU 140   4.907  -2.731   1.809
 1032   HD13  LEU 140          HD13      LEU 140   6.174  -3.562   2.711
 1033   HD21  LEU 140          HD21      LEU 140   3.847  -6.239   1.471
 1034   HD22  LEU 140          HD22      LEU 140   5.542  -5.755   1.466
 1035   HD23  LEU 140          HD23      LEU 140   4.347  -4.794   0.596
 1036    H    GLU 141           HN       GLU 141   4.705  -4.680   7.238
 1037    HA   GLU 141           HA       GLU 141   3.774  -1.898   7.266
 1038    HB2  GLU 141           HB2      GLU 141   3.209  -3.193   9.220
 1039    HB3  GLU 141           HB1      GLU 141   4.861  -3.755   9.388
 1040    HG2  GLU 141           HG2      GLU 141   5.578  -1.500   9.977
 1041    HG3  GLU 141           HG1      GLU 141   3.916  -0.926   9.787
 1042    H    VAL 142           HN       VAL 142   5.217  -0.426   6.505
 1043    HA   VAL 142           HA       VAL 142   8.071  -1.103   6.696
 1044    HB   VAL 142           HB       VAL 142   8.320   0.436   4.662
 1045   HG11  VAL 142          HG11      VAL 142   7.825  -1.399   3.123
 1046   HG12  VAL 142          HG12      VAL 142   6.894  -2.207   4.384
 1047   HG13  VAL 142          HG13      VAL 142   8.633  -1.976   4.581
 1048   HG21  VAL 142          HG21      VAL 142   5.364  -0.158   4.466
 1049   HG22  VAL 142          HG22      VAL 142   6.351   0.544   3.186
 1050   HG23  VAL 142          HG23      VAL 142   6.095   1.431   4.688
 1051    H    THR 143           HN       THR 143   9.165   0.106   8.010
 1052    HA   THR 143           HA       THR 143   8.420   2.865   8.582
 1053    HB   THR 143           HB       THR 143  10.903   1.464   9.583
 1054    HG1  THR 143           HG1      THR 143   8.562   1.408  11.137
 1055   HG21  THR 143          HG21      THR 143  10.676   3.869  10.021
 1056   HG22  THR 143          HG22      THR 143  10.579   2.934  11.514
 1057   HG23  THR 143          HG23      THR 143   9.111   3.585  10.785
 1058    H    LEU 144           HN       LEU 144   9.016   4.264   6.970
 1059    HA   LEU 144           HA       LEU 144  11.578   3.978   5.633
 1060    HB2  LEU 144           HB2      LEU 144   9.657   4.917   4.422
 1061    HB3  LEU 144           HB1      LEU 144   9.562   6.229   5.580
 1062    HG   LEU 144           HG       LEU 144  11.807   6.987   4.862
 1063   HD11  LEU 144          HD11      LEU 144  12.751   6.083   2.789
 1064   HD12  LEU 144          HD12      LEU 144  11.494   4.845   2.766
 1065   HD13  LEU 144          HD13      LEU 144  12.686   4.870   4.067
 1066   HD21  LEU 144          HD21      LEU 144  11.091   7.959   2.776
 1067   HD22  LEU 144          HD22      LEU 144   9.732   7.917   3.901
 1068   HD23  LEU 144          HD23      LEU 144   9.838   6.732   2.600
 1069    H    LYS 145           HN       LYS 145  13.228   4.239   6.938
 1070    HA   LYS 145           HA       LYS 145  13.021   6.150   9.134
 1071    HB2  LYS 145           HB2      LYS 145  15.258   4.189   8.691
 1072    HB3  LYS 145           HB1      LYS 145  14.730   4.926  10.200
 1073    HG2  LYS 145           HG2      LYS 145  12.711   3.622  10.191
 1074    HG3  LYS 145           HG1      LYS 145  13.106   2.966   8.602
 1075    HD2  LYS 145           HD2      LYS 145  14.747   2.556  11.099
 1076    HD3  LYS 145           HD1      LYS 145  13.596   1.389  10.431
 1077    HE2  LYS 145           HE2      LYS 145  14.874   1.058   8.508
 1078    HE3  LYS 145           HE1      LYS 145  15.868   2.488   8.795
 1079    HZ1  LYS 145           HZ1      LYS 145  16.578   1.259  10.913
 1080    HZ2  LYS 145           HZ2      LYS 145  17.230   0.743   9.435
 1081    HZ3  LYS 145           HZ3      LYS 145  15.965  -0.134  10.155
 1082    H    THR 146           HN       THR 146  14.725   5.603   6.157
 1083    HA   THR 146           HA       THR 146  15.994   8.190   6.395
 1084    HB   THR 146           HB       THR 146  17.723   5.787   5.827
 1085    HG1  THR 146           HG1      THR 146  16.902   6.881   8.242
 1086   HG21  THR 146          HG21      THR 146  18.558   7.917   4.950
 1087   HG22  THR 146          HG22      THR 146  19.574   7.358   6.278
 1088   HG23  THR 146          HG23      THR 146  18.404   8.648   6.550
 1089    H    ALA 147           HN       ALA 147  16.663   9.057   4.443
 1090    HA   ALA 147           HA       ALA 147  16.515   7.368   2.061
 1091    HB1  ALA 147           HB1      ALA 147  15.270  10.112   2.319
 1092    HB2  ALA 147           HB2      ALA 147  14.406   8.590   2.105
 1093    HB3  ALA 147           HB3      ALA 147  15.435   9.209   0.815
 1094    H    VAL 148           HN       VAL 148  18.323   7.612   0.792
 1095    HA   VAL 148           HA       VAL 148  19.837  10.104   1.148
 1096    HB   VAL 148           HB       VAL 148  21.984   8.915   1.254
 1097   HG11  VAL 148          HG11      VAL 148  21.797   8.126   3.576
 1098   HG12  VAL 148          HG12      VAL 148  20.038   8.117   3.424
 1099   HG13  VAL 148          HG13      VAL 148  20.928   9.639   3.326
 1100   HG21  VAL 148          HG21      VAL 148  21.301   6.825   0.167
 1101   HG22  VAL 148          HG22      VAL 148  20.345   6.405   1.590
 1102   HG23  VAL 148          HG23      VAL 148  22.100   6.536   1.713
 1103    H    ASP 149           HN       ASP 149  20.606  10.922  -0.668
 1104    HA   ASP 149           HA       ASP 149  19.742   9.715  -3.104
 1105    HB2  ASP 149           HB2      ASP 149  20.203  11.745  -4.113
 1106    HB3  ASP 149           HB1      ASP 149  19.907  12.244  -2.455
 1107    H    LEU 150           HN       LEU 150  20.902   8.608  -4.557
 1108    HA   LEU 150           HA       LEU 150  23.762   8.537  -4.531
 1109    HB2  LEU 150           HB2      LEU 150  22.840   7.011  -2.619
 1110    HB3  LEU 150           HB1      LEU 150  22.433   5.919  -3.931
 1111    HG   LEU 150           HG       LEU 150  24.840   5.942  -4.610
 1112   HD11  LEU 150          HD11      LEU 150  26.475   6.765  -2.985
 1113   HD12  LEU 150          HD12      LEU 150  25.165   7.397  -1.987
 1114   HD13  LEU 150          HD13      LEU 150  25.458   8.072  -3.590
 1115   HD21  LEU 150          HD21      LEU 150  24.280   5.049  -1.788
 1116   HD22  LEU 150          HD22      LEU 150  25.571   4.459  -2.835
 1117   HD23  LEU 150          HD23      LEU 150  23.885   4.143  -3.248
 1118    H    GLU 151           HN       GLU 151  21.507   9.045  -6.333
 1119    HA   GLU 151           HA       GLU 151  21.090   6.751  -7.999
 1120    HB2  GLU 151           HB2      GLU 151  19.421   8.579  -7.640
 1121    HB3  GLU 151           HB1      GLU 151  20.450   9.655  -8.574
 1122    HG2  GLU 151           HG2      GLU 151  20.012   7.325 -10.116
 1123    HG3  GLU 151           HG1      GLU 151  18.443   7.860  -9.483
 1124    H    HIS 152           HN       HIS 152  22.253   9.935  -9.059
 1125    HA   HIS 152           HA       HIS 152  24.145  10.632 -10.095
 1126    HB2  HIS 152           HB2      HIS 152  25.163   7.900  -9.331
 1127    HB3  HIS 152           HB1      HIS 152  26.151   9.106 -10.146
 1128    HD1  HIS 152           HD1      HIS 152  27.744   9.106  -8.069
 1129    HD2  HIS 152           HD2      HIS 152  23.881  10.438  -7.292
 1130    HE1  HIS 152           HE1      HIS 152  27.838  10.188  -5.804
 1131    HE2  HIS 152           HE2      HIS 152  25.471  10.881  -5.294
 1132    H    HIS 153           HN       HIS 153  22.243   8.175 -11.333
 1133    HA   HIS 153           HA       HIS 153  23.888   7.747 -13.690
 1134    HB2  HIS 153           HB2      HIS 153  22.570   5.871 -12.644
 1135    HB3  HIS 153           HB1      HIS 153  21.105   6.681 -13.182
 1136    HD1  HIS 153           HD1      HIS 153  21.284   4.004 -14.306
 1137    HD2  HIS 153           HD2      HIS 153  23.304   7.177 -16.089
 1138    HE1  HIS 153           HE1      HIS 153  21.716   3.289 -16.680
 1139    HE2  HIS 153           HE2      HIS 153  23.035   5.183 -17.718
 1140    H    HIS 154           HN       HIS 154  23.774  10.088 -14.125
 1141    HA   HIS 154           HA       HIS 154  21.421  10.660 -15.807
 1142    HB2  HIS 154           HB2      HIS 154  23.315  12.619 -14.484
 1143    HB3  HIS 154           HB1      HIS 154  21.990  13.059 -15.561
 1144    HD1  HIS 154           HD1      HIS 154  22.595  13.351 -12.225
 1145    HD2  HIS 154           HD2      HIS 154  19.547  11.418 -14.293
 1146    HE1  HIS 154           HE1      HIS 154  20.701  13.110 -10.585
 1147    HE2  HIS 154           HE2      HIS 154  19.024  11.657 -11.774
 1148    H    HIS 155           HN       HIS 155  24.833  10.325 -15.592
 1149    HA   HIS 155           HA       HIS 155  24.943  10.105 -18.474
 1150    HB2  HIS 155           HB2      HIS 155  26.624  12.066 -16.921
 1151    HB3  HIS 155           HB1      HIS 155  27.212  11.359 -18.421
 1152    HD1  HIS 155           HD1      HIS 155  25.569  11.774 -20.558
 1153    HD2  HIS 155           HD2      HIS 155  25.085  14.279 -17.271
 1154    HE1  HIS 155           HE1      HIS 155  24.299  13.772 -21.408
 1155    HE2  HIS 155           HE2      HIS 155  23.826  15.156 -19.360
 1156    H    HIS 156           HN       HIS 156  26.994   9.044 -19.159
 1157    HA   HIS 156           HA       HIS 156  28.325   7.211 -19.091
 1158    HB2  HIS 156           HB2      HIS 156  28.285   7.674 -16.101
 1159    HB3  HIS 156           HB1      HIS 156  29.129   6.318 -16.845
 1160    HD1  HIS 156           HD1      HIS 156  31.411   6.760 -17.794
 1161    HD2  HIS 156           HD2      HIS 156  29.362  10.244 -16.816
 1162    HE1  HIS 156           HE1      HIS 156  33.081   8.625 -18.046
 1163    HE2  HIS 156           HE2      HIS 156  31.770  10.735 -17.623
 1164    H    HIS 157           HN       HIS 157  27.825   5.137 -19.390
 1165    HA   HIS 157           HA       HIS 157  26.466   3.346 -19.700
 1166    HB2  HIS 157           HB2      HIS 157  25.132   4.194 -17.109
 1167    HB3  HIS 157           HB1      HIS 157  24.816   2.694 -17.966
 1168    HD1  HIS 157           HD1      HIS 157  27.116   1.168 -18.278
 1169    HD2  HIS 157           HD2      HIS 157  26.947   3.900 -15.146
 1170    HE1  HIS 157           HE1      HIS 157  28.862   0.421 -16.625
 1171    HE2  HIS 157           HE2      HIS 157  28.559   1.943 -14.642
  Start of MODEL    4
    1    H1   MET   1           HT1      MET   1 -27.878  43.817 -34.116
    2    H2   MET   1           HT2      MET   1 -28.040  44.080 -32.454
    3    H3   MET   1           HT3      MET   1 -29.247  43.238 -33.304
    4    HA   MET   1           HA       MET   1 -27.714  41.454 -33.783
    5    HB2  MET   1           HB2      MET   1 -25.812  43.062 -32.061
    6    HB3  MET   1           HB1      MET   1 -25.539  41.405 -32.572
    7    HG2  MET   1           HG2      MET   1 -24.272  42.789 -34.005
    8    HG3  MET   1           HG1      MET   1 -25.648  42.214 -34.944
    9    HE1  MET   1           HE1      MET   1 -25.365  45.028 -32.226
   10    HE2  MET   1           HE2      MET   1 -25.261  46.477 -33.218
   11    HE3  MET   1           HE3      MET   1 -23.933  45.310 -33.218
   12    H    GLY   2           HN       GLY   2 -28.266  43.292 -30.833
   13    HA2  GLY   2           HA2      GLY   2 -29.319  42.637 -28.888
   14    HA3  GLY   2           HA1      GLY   2 -29.596  41.060 -29.614
   15    H    GLN   3           HN       GLN   3 -27.897  39.495 -29.549
   16    HA   GLN   3           HA       GLN   3 -25.703  40.065 -27.698
   17    HB2  GLN   3           HB2      GLN   3 -27.855  38.946 -26.645
   18    HB3  GLN   3           HB1      GLN   3 -27.178  37.491 -27.357
   19    HG2  GLN   3           HG2      GLN   3 -25.238  37.620 -26.034
   20    HG3  GLN   3           HG1      GLN   3 -25.592  39.277 -25.542
   21   HE21  GLN   3          HE21      GLN   3 -25.097  36.992 -23.854
   22   HE22  GLN   3          HE22      GLN   3 -26.518  36.775 -22.886
   23    HA   PRO   4           HA       PRO   4 -24.274  37.755 -31.351
   24    HB2  PRO   4           HB2      PRO   4 -22.030  39.169 -31.749
   25    HB3  PRO   4           HB1      PRO   4 -23.614  39.792 -32.232
   26    HG2  PRO   4           HG2      PRO   4 -21.964  40.451 -29.823
   27    HG3  PRO   4           HG1      PRO   4 -22.910  41.531 -30.862
   28    HD2  PRO   4           HD2      PRO   4 -23.764  40.559 -28.431
   29    HD3  PRO   4           HD1      PRO   4 -24.843  41.115 -29.727
   30    HA   PRO   5           HA       PRO   5 -21.347  34.926 -29.608
   31    HB2  PRO   5           HB2      PRO   5 -19.497  35.525 -31.860
   32    HB3  PRO   5           HB1      PRO   5 -20.131  33.971 -31.310
   33    HG2  PRO   5           HG2      PRO   5 -21.063  35.108 -33.522
   34    HG3  PRO   5           HG1      PRO   5 -22.150  34.257 -32.406
   35    HD2  PRO   5           HD2      PRO   5 -21.742  37.194 -32.789
   36    HD3  PRO   5           HD1      PRO   5 -23.238  36.297 -32.456
   37    H    ALA   6           HN       ALA   6 -20.125  35.341 -27.911
   38    HA   ALA   6           HA       ALA   6 -18.247  37.588 -27.961
   39    HB1  ALA   6           HB1      ALA   6 -18.137  37.335 -25.545
   40    HB2  ALA   6           HB2      ALA   6 -19.097  35.859 -25.629
   41    HB3  ALA   6           HB3      ALA   6 -19.828  37.408 -26.053
   42    H    GLU   7           HN       GLU   7 -16.108  37.258 -28.109
   43    HA   GLU   7           HA       GLU   7 -15.177  34.573 -28.542
   44    HB2  GLU   7           HB2      GLU   7 -14.409  36.568 -29.869
   45    HB3  GLU   7           HB1      GLU   7 -13.539  37.108 -28.438
   46    HG2  GLU   7           HG2      GLU   7 -11.924  35.535 -28.651
   47    HG3  GLU   7           HG1      GLU   7 -13.016  34.352 -29.374
   48    H    GLU   8           HN       GLU   8 -14.796  37.064 -26.086
   49    HA   GLU   8           HA       GLU   8 -14.345  35.009 -24.123
   50    HB2  GLU   8           HB2      GLU   8 -12.047  35.616 -25.105
   51    HB3  GLU   8           HB1      GLU   8 -12.237  37.153 -24.272
   52    HG2  GLU   8           HG2      GLU   8 -12.345  36.060 -22.146
   53    HG3  GLU   8           HG1      GLU   8 -12.383  34.477 -22.916
   54    H    ALA   9           HN       ALA   9 -14.880  38.300 -25.051
   55    HA   ALA   9           HA       ALA   9 -16.042  39.999 -24.123
   56    HB1  ALA   9           HB1      ALA   9 -16.978  37.945 -22.111
   57    HB2  ALA   9           HB2      ALA   9 -17.767  38.327 -23.641
   58    HB3  ALA   9           HB3      ALA   9 -17.683  39.542 -22.365
   59    H    GLU  10           HN       GLU  10 -15.606  38.482 -20.976
   60    HA   GLU  10           HA       GLU  10 -13.231  39.931 -20.344
   61    HB2  GLU  10           HB2      GLU  10 -15.001  41.727 -20.235
   62    HB3  GLU  10           HB1      GLU  10 -15.726  40.834 -18.902
   63    HG2  GLU  10           HG2      GLU  10 -13.460  41.009 -17.763
   64    HG3  GLU  10           HG1      GLU  10 -13.057  42.196 -19.001
   65    H    GLN  11           HN       GLN  11 -16.164  38.604 -18.762
   66    HA   GLN  11           HA       GLN  11 -14.359  37.129 -16.945
   67    HB2  GLN  11           HB2      GLN  11 -17.199  37.985 -16.363
   68    HB3  GLN  11           HB1      GLN  11 -16.060  37.264 -15.237
   69    HG2  GLN  11           HG2      GLN  11 -15.743  39.966 -16.527
   70    HG3  GLN  11           HG1      GLN  11 -16.366  39.681 -14.904
   71   HE21  GLN  11          HE21      GLN  11 -14.066  41.217 -15.744
   72   HE22  GLN  11          HE22      GLN  11 -12.695  40.512 -14.946
   73    HA   PRO  12           HA       PRO  12 -16.839  33.790 -18.861
   74    HB2  PRO  12           HB2      PRO  12 -14.908  32.502 -20.205
   75    HB3  PRO  12           HB1      PRO  12 -15.693  33.942 -20.864
   76    HG2  PRO  12           HG2      PRO  12 -12.976  33.623 -19.750
   77    HG3  PRO  12           HG1      PRO  12 -13.584  34.812 -20.911
   78    HD2  PRO  12           HD2      PRO  12 -13.182  35.139 -18.088
   79    HD3  PRO  12           HD1      PRO  12 -13.800  36.329 -19.250
   80    H    GLY  13           HN       GLY  13 -14.523  34.129 -16.566
   81    HA2  GLY  13           HA2      GLY  13 -15.064  31.707 -15.236
   82    HA3  GLY  13           HA1      GLY  13 -13.518  31.575 -16.065
   83    H    ALA  14           HN       ALA  14 -12.179  31.569 -14.305
   84    HA   ALA  14           HA       ALA  14 -10.918  32.368 -12.595
   85    HB1  ALA  14           HB1      ALA  14 -10.528  34.772 -12.448
   86    HB2  ALA  14           HB2      ALA  14 -11.913  35.071 -13.499
   87    HB3  ALA  14           HB3      ALA  14 -10.493  34.234 -14.129
   88    H    LEU  15           HN       LEU  15 -12.170  31.350 -11.041
   89    HA   LEU  15           HA       LEU  15 -14.401  32.820  -9.875
   90    HB2  LEU  15           HB2      LEU  15 -13.418  29.997  -9.578
   91    HB3  LEU  15           HB1      LEU  15 -14.605  30.668  -8.479
   92    HG   LEU  15           HG       LEU  15 -16.085  31.116 -10.460
   93   HD11  LEU  15          HD11      LEU  15 -15.636  29.917 -12.538
   94   HD12  LEU  15          HD12      LEU  15 -14.060  29.427 -11.918
   95   HD13  LEU  15          HD13      LEU  15 -14.400  31.132 -12.210
   96   HD21  LEU  15          HD21      LEU  15 -16.470  29.201  -9.038
   97   HD22  LEU  15          HD22      LEU  15 -15.283  28.256  -9.936
   98   HD23  LEU  15          HD23      LEU  15 -16.777  28.769 -10.718
   99    H    ALA  16           HN       ALA  16 -11.133  31.921  -9.186
  100    HA   ALA  16           HA       ALA  16  -9.668  32.522  -7.552
  101    HB1  ALA  16           HB1      ALA  16 -11.683  34.703  -7.002
  102    HB2  ALA  16           HB2      ALA  16 -10.399  34.780  -8.208
  103    HB3  ALA  16           HB3      ALA  16  -9.997  34.694  -6.491
  104    H    ARG  17           HN       ARG  17 -11.731  30.577  -6.887
  105    HA   ARG  17           HA       ARG  17 -12.459  31.168  -4.126
  106    HB2  ARG  17           HB2      ARG  17 -14.053  30.163  -5.836
  107    HB3  ARG  17           HB1      ARG  17 -13.120  28.680  -5.712
  108    HG2  ARG  17           HG2      ARG  17 -15.192  28.718  -4.340
  109    HG3  ARG  17           HG1      ARG  17 -13.722  28.414  -3.413
  110    HD2  ARG  17           HD2      ARG  17 -13.668  30.745  -2.712
  111    HD3  ARG  17           HD1      ARG  17 -15.098  31.085  -3.682
  112    HE   ARG  17           HE       ARG  17 -16.376  29.732  -2.159
  113   HH11  ARG  17          HH11      ARG  17 -13.105  30.382  -1.142
  114   HH12  ARG  17          HH12      ARG  17 -13.454  30.279   0.551
  115   HH21  ARG  17          HH21      ARG  17 -16.864  29.572   0.080
  116   HH22  ARG  17          HH22      ARG  17 -15.598  29.781   1.249
  117    H    GLU  18           HN       GLU  18  -9.678  30.656  -4.974
  118    HA   GLU  18           HA       GLU  18  -8.770  28.117  -4.275
  119    HB2  GLU  18           HB2      GLU  18  -7.441  29.824  -5.472
  120    HB3  GLU  18           HB1      GLU  18  -7.327  30.761  -3.991
  121    HG2  GLU  18           HG2      GLU  18  -5.288  29.516  -4.407
  122    HG3  GLU  18           HG1      GLU  18  -6.080  28.975  -2.930
  123    H    PHE  19           HN       PHE  19  -8.062  30.951  -2.224
  124    HA   PHE  19           HA       PHE  19  -9.138  29.549   0.101
  125    HB2  PHE  19           HB2      PHE  19  -7.104  29.785   1.403
  126    HB3  PHE  19           HB1      PHE  19  -6.783  28.830  -0.039
  127    HD1  PHE  19           HD2      PHE  19  -5.539  29.859  -1.932
  128    HD2  PHE  19           HD1      PHE  19  -5.975  31.823   1.817
  129    HE1  PHE  19           HE2      PHE  19  -3.673  31.355  -2.497
  130    HE2  PHE  19           HE1      PHE  19  -4.116  33.328   1.252
  131    HZ   PHE  19           HZ       PHE  19  -2.953  33.095  -0.878
  132    H    LEU  20           HN       LEU  20  -9.434  32.157  -1.543
  133    HA   LEU  20           HA       LEU  20  -8.612  34.211   0.304
  134    HB2  LEU  20           HB2      LEU  20 -10.113  34.364  -2.307
  135    HB3  LEU  20           HB1      LEU  20  -9.643  35.761  -1.363
  136    HG   LEU  20           HG       LEU  20  -7.237  34.923  -1.628
  137   HD11  LEU  20          HD11      LEU  20  -6.824  33.564  -3.632
  138   HD12  LEU  20          HD12      LEU  20  -8.560  33.315  -3.810
  139   HD13  LEU  20          HD13      LEU  20  -7.718  32.675  -2.401
  140   HD21  LEU  20          HD21      LEU  20  -8.133  36.888  -2.749
  141   HD22  LEU  20          HD22      LEU  20  -8.770  35.874  -4.043
  142   HD23  LEU  20          HD23      LEU  20  -7.028  36.009  -3.803
  143    H    ALA  21           HN       ALA  21 -11.758  33.438  -1.182
  144    HA   ALA  21           HA       ALA  21 -13.257  34.964   0.647
  145    HB1  ALA  21           HB1      ALA  21 -15.214  33.794  -0.261
  146    HB2  ALA  21           HB2      ALA  21 -14.153  32.623  -1.042
  147    HB3  ALA  21           HB3      ALA  21 -14.129  34.311  -1.552
  148    H    ALA  22           HN       ALA  22 -14.520  34.330   2.413
  149    HA   ALA  22           HA       ALA  22 -13.202  32.303   3.999
  150    HB1  ALA  22           HB1      ALA  22 -14.547  33.184   5.846
  151    HB2  ALA  22           HB2      ALA  22 -15.423  34.214   4.714
  152    HB3  ALA  22           HB3      ALA  22 -13.700  34.474   4.991
  153    H    MET  23           HN       MET  23 -14.806  31.161   5.594
  154    HA   MET  23           HA       MET  23 -16.156  29.394   5.912
  155    HB2  MET  23           HB2      MET  23 -17.918  31.096   5.561
  156    HB3  MET  23           HB1      MET  23 -17.934  30.703   3.847
  157    HG2  MET  23           HG2      MET  23 -18.716  28.485   4.303
  158    HG3  MET  23           HG1      MET  23 -18.537  28.726   6.037
  159    HE1  MET  23           HE1      MET  23 -21.331  31.369   6.775
  160    HE2  MET  23           HE2      MET  23 -19.629  31.670   6.411
  161    HE3  MET  23           HE3      MET  23 -20.083  30.336   7.475
  162    H    GLU  24           HN       GLU  24 -14.452  28.136   4.967
  163    HA   GLU  24           HA       GLU  24 -15.553  26.250   3.139
  164    HB2  GLU  24           HB2      GLU  24 -14.549  28.192   1.701
  165    HB3  GLU  24           HB1      GLU  24 -12.998  27.495   2.157
  166    HG2  GLU  24           HG2      GLU  24 -13.700  26.663   0.004
  167    HG3  GLU  24           HG1      GLU  24 -13.685  25.353   1.182
  168    HA   PRO  25           HA       PRO  25 -13.018  24.323   6.278
  169    HB2  PRO  25           HB2      PRO  25 -14.016  21.822   5.089
  170    HB3  PRO  25           HB1      PRO  25 -14.217  22.442   6.729
  171    HG2  PRO  25           HG2      PRO  25 -16.261  22.374   4.992
  172    HG3  PRO  25           HG1      PRO  25 -16.082  23.692   6.165
  173    HD2  PRO  25           HD2      PRO  25 -15.399  23.642   3.249
  174    HD3  PRO  25           HD1      PRO  25 -16.186  24.924   4.194
  175    H    GLU  26           HN       GLU  26 -11.025  23.447   6.351
  176    HA   GLU  26           HA       GLU  26  -9.479  23.096   4.009
  177    HB2  GLU  26           HB2      GLU  26  -8.831  22.024   6.759
  178    HB3  GLU  26           HB1      GLU  26  -7.697  22.416   5.477
  179    HG2  GLU  26           HG2      GLU  26  -9.375  24.368   7.030
  180    HG3  GLU  26           HG1      GLU  26  -7.648  24.079   7.224
  181    HA   PRO  27           HA       PRO  27 -10.361  18.805   3.082
  182    HB2  PRO  27           HB2      PRO  27  -7.999  18.176   1.853
  183    HB3  PRO  27           HB1      PRO  27  -9.320  19.038   1.060
  184    HG2  PRO  27           HG2      PRO  27  -6.809  20.110   2.268
  185    HG3  PRO  27           HG1      PRO  27  -7.632  20.599   0.776
  186    HD2  PRO  27           HD2      PRO  27  -7.821  22.015   3.080
  187    HD3  PRO  27           HD1      PRO  27  -9.145  21.926   1.900
  188    H    ALA  28           HN       ALA  28 -10.243  17.134   4.465
  189    HA   ALA  28           HA       ALA  28  -7.847  16.958   6.182
  190    HB1  ALA  28           HB1      ALA  28 -10.666  16.153   6.880
  191    HB2  ALA  28           HB2      ALA  28  -9.860  17.625   7.419
  192    HB3  ALA  28           HB3      ALA  28  -9.259  16.049   7.938
  193    HA   PRO  29           HA       PRO  29  -7.399  12.897   4.305
  194    HB2  PRO  29           HB2      PRO  29  -5.190  12.730   6.244
  195    HB3  PRO  29           HB1      PRO  29  -5.141  12.576   4.484
  196    HG2  PRO  29           HG2      PRO  29  -4.136  14.729   5.716
  197    HG3  PRO  29           HG1      PRO  29  -4.989  14.872   4.165
  198    HD2  PRO  29           HD2      PRO  29  -5.995  15.427   6.935
  199    HD3  PRO  29           HD1      PRO  29  -6.215  16.378   5.448
  200    H    ALA  30           HN       ALA  30  -8.544  11.201   4.940
  201    HA   ALA  30           HA       ALA  30  -8.504  10.504   7.799
  202    HB1  ALA  30           HB1      ALA  30 -10.880  10.218   5.971
  203    HB2  ALA  30           HB2      ALA  30 -10.667  11.499   7.166
  204    HB3  ALA  30           HB3      ALA  30 -10.813   9.821   7.688
  205    HA   PRO  31           HA       PRO  31  -6.940   6.774   5.518
  206    HB2  PRO  31           HB2      PRO  31  -5.300   6.120   7.636
  207    HB3  PRO  31           HB1      PRO  31  -4.788   7.075   6.242
  208    HG2  PRO  31           HG2      PRO  31  -5.658   7.997   8.954
  209    HG3  PRO  31           HG1      PRO  31  -4.332   8.595   7.941
  210    HD2  PRO  31           HD2      PRO  31  -6.659   9.915   8.115
  211    HD3  PRO  31           HD1      PRO  31  -5.751   9.830   6.593
  212    H    ALA  32           HN       ALA  32  -8.742   5.506   5.709
  213    HA   ALA  32           HA       ALA  32  -9.953   4.879   8.208
  214    HB1  ALA  32           HB1      ALA  32 -11.237   4.861   6.124
  215    HB2  ALA  32           HB2      ALA  32 -11.308   3.290   6.922
  216    HB3  ALA  32           HB3      ALA  32 -10.256   3.520   5.525
  217    HA   PRO  33           HA       PRO  33  -7.169   1.756   9.579
  218    HB2  PRO  33           HB2      PRO  33  -8.903   0.271  11.098
  219    HB3  PRO  33           HB1      PRO  33  -8.177   1.793  11.626
  220    HG2  PRO  33           HG2      PRO  33 -10.894   1.284  10.475
  221    HG3  PRO  33           HG1      PRO  33 -10.427   2.344  11.818
  222    HD2  PRO  33           HD2      PRO  33 -10.944   3.312   9.366
  223    HD3  PRO  33           HD1      PRO  33  -9.692   4.017  10.408
  224    H    GLU  34           HN       GLU  34 -10.114   0.934   7.934
  225    HA   GLU  34           HA       GLU  34  -9.345  -1.870   7.677
  226    HB2  GLU  34           HB2      GLU  34 -11.630  -1.258   8.449
  227    HB3  GLU  34           HB1      GLU  34 -11.917  -0.486   6.898
  228    HG2  GLU  34           HG2      GLU  34 -11.834  -2.555   5.754
  229    HG3  GLU  34           HG1      GLU  34 -11.223  -3.393   7.180
  230    H    GLU  35           HN       GLU  35 -10.799   0.546   5.479
  231    HA   GLU  35           HA       GLU  35  -9.264  -0.635   3.260
  232    HB2  GLU  35           HB2      GLU  35 -11.802   1.016   3.221
  233    HB3  GLU  35           HB1      GLU  35 -10.986   0.380   1.797
  234    HG2  GLU  35           HG2      GLU  35 -12.158  -1.290   4.012
  235    HG3  GLU  35           HG1      GLU  35 -12.939  -0.953   2.469
  236    H    TRP  36           HN       TRP  36  -7.633   0.552   2.455
  237    HA   TRP  36           HA       TRP  36  -7.432   3.322   3.436
  238    HB2  TRP  36           HB2      TRP  36  -5.021   1.894   2.441
  239    HB3  TRP  36           HB1      TRP  36  -5.183   3.045   3.760
  240    HD1  TRP  36           HD1      TRP  36  -7.255   1.501   5.592
  241    HE1  TRP  36           HE1      TRP  36  -6.536  -0.660   6.789
  242    HE3  TRP  36           HE3      TRP  36  -3.269   0.242   2.640
  243    HZ2  TRP  36           HZ2      TRP  36  -4.533  -2.616   6.524
  244    HZ3  TRP  36           HZ3      TRP  36  -2.022  -1.772   3.189
  245    HH2  TRP  36           HH2      TRP  36  -2.627  -3.181   5.078
  246    H    LEU  37           HN       LEU  37  -5.287   4.138   1.970
  247    HA   LEU  37           HA       LEU  37  -6.545   4.984  -0.466
  248    HB2  LEU  37           HB2      LEU  37  -5.157   6.466   0.933
  249    HB3  LEU  37           HB1      LEU  37  -3.759   5.473   0.601
  250    HG   LEU  37           HG       LEU  37  -4.000   6.046  -1.816
  251   HD11  LEU  37          HD11      LEU  37  -6.054   7.984  -0.782
  252   HD12  LEU  37          HD12      LEU  37  -6.348   6.618  -1.861
  253   HD13  LEU  37          HD13      LEU  37  -5.373   7.984  -2.409
  254   HD21  LEU  37          HD21      LEU  37  -2.406   7.219  -0.406
  255   HD22  LEU  37          HD22      LEU  37  -3.659   8.365   0.072
  256   HD23  LEU  37          HD23      LEU  37  -3.108   8.308  -1.603
  257    H    ASP  38           HN       ASP  38  -6.378   4.027  -2.375
  258    HA   ASP  38           HA       ASP  38  -4.537   1.875  -2.828
  259    HB2  ASP  38           HB2      ASP  38  -6.876   2.941  -4.140
  260    HB3  ASP  38           HB1      ASP  38  -5.581   2.644  -5.302
  261    H    ILE  39           HN       ILE  39  -2.555   2.038  -3.474
  262    HA   ILE  39           HA       ILE  39  -1.272   4.420  -4.182
  263    HB   ILE  39           HB       ILE  39  -0.412   1.584  -4.764
  264   HG12  ILE  39          HG12      ILE  39  -0.205   3.344  -2.339
  265   HG13  ILE  39          HG11      ILE  39  -0.778   1.692  -2.452
  266   HG21  ILE  39          HG21      ILE  39   0.868   3.175  -6.058
  267   HG22  ILE  39          HG22      ILE  39   1.867   2.497  -4.771
  268   HG23  ILE  39          HG23      ILE  39   1.200   4.124  -4.610
  269   HD11  ILE  39          HD11      ILE  39   1.493   0.908  -2.841
  270   HD12  ILE  39          HD12      ILE  39   1.365   1.798  -1.323
  271   HD13  ILE  39          HD13      ILE  39   2.088   2.565  -2.737
  272    H    LEU  40           HN       LEU  40  -2.614   1.815  -6.175
  273    HA   LEU  40           HA       LEU  40  -2.087   3.479  -8.535
  274    HB2  LEU  40           HB2      LEU  40  -2.459   0.500  -8.373
  275    HB3  LEU  40           HB1      LEU  40  -2.220   1.402  -9.856
  276    HG   LEU  40           HG       LEU  40  -0.214   1.135  -7.608
  277   HD11  LEU  40          HD11      LEU  40   1.066  -0.160  -9.254
  278   HD12  LEU  40          HD12      LEU  40  -0.276  -0.026 -10.392
  279   HD13  LEU  40          HD13      LEU  40  -0.486  -0.917  -8.885
  280   HD21  LEU  40          HD21      LEU  40  -0.050   3.310  -8.717
  281   HD22  LEU  40          HD22      LEU  40   0.015   2.509 -10.288
  282   HD23  LEU  40          HD23      LEU  40   1.325   2.283  -9.128
  283    H    GLY  41           HN       GLY  41  -4.484   2.779  -6.486
  284    HA2  GLY  41           HA2      GLY  41  -6.764   3.068  -6.595
  285    HA3  GLY  41           HA1      GLY  41  -6.539   3.666  -8.233
  286    H    ASN  42           HN       ASN  42  -5.300   0.587  -7.362
  287    HA   ASN  42           HA       ASN  42  -7.212  -0.630  -9.203
  288    HB2  ASN  42           HB2      ASN  42  -5.586  -2.605  -9.060
  289    HB3  ASN  42           HB1      ASN  42  -5.087  -1.161  -9.919
  290   HD21  ASN  42          HD21      ASN  42  -5.071  -1.217  -6.418
  291   HD22  ASN  42          HD22      ASN  42  -3.352  -1.262  -6.262
  292    H    GLY  43           HN       GLY  43  -6.400  -0.709  -5.827
  293    HA2  GLY  43           HA2      GLY  43  -8.040  -1.450  -4.260
  294    HA3  GLY  43           HA1      GLY  43  -8.613  -2.621  -5.441
  295    H    LEU  44           HN       LEU  44  -5.626  -3.150  -5.961
  296    HA   LEU  44           HA       LEU  44  -5.478  -5.308  -4.018
  297    HB2  LEU  44           HB2      LEU  44  -3.803  -4.713  -6.472
  298    HB3  LEU  44           HB1      LEU  44  -3.559  -6.092  -5.424
  299    HG   LEU  44           HG       LEU  44  -4.711  -6.841  -7.366
  300   HD11  LEU  44          HD11      LEU  44  -6.652  -6.606  -5.078
  301   HD12  LEU  44          HD12      LEU  44  -5.421  -7.852  -5.291
  302   HD13  LEU  44          HD13      LEU  44  -6.770  -7.746  -6.421
  303   HD21  LEU  44          HD21      LEU  44  -6.864  -5.926  -8.084
  304   HD22  LEU  44          HD22      LEU  44  -5.590  -4.708  -8.145
  305   HD23  LEU  44          HD23      LEU  44  -6.763  -4.694  -6.827
  306    H    LEU  45           HN       LEU  45  -4.006  -2.278  -4.719
  307    HA   LEU  45           HA       LEU  45  -1.843  -2.839  -2.808
  308    HB2  LEU  45           HB2      LEU  45  -0.832  -2.871  -4.911
  309    HB3  LEU  45           HB1      LEU  45  -1.769  -1.518  -5.489
  310    HG   LEU  45           HG       LEU  45  -0.504  -0.003  -4.052
  311   HD11  LEU  45          HD11      LEU  45   1.441  -0.796  -2.825
  312   HD12  LEU  45          HD12      LEU  45   1.066  -2.457  -3.283
  313   HD13  LEU  45          HD13      LEU  45  -0.036  -1.563  -2.231
  314   HD21  LEU  45          HD21      LEU  45   1.223  -1.801  -5.738
  315   HD22  LEU  45          HD22      LEU  45   1.634  -0.164  -5.222
  316   HD23  LEU  45          HD23      LEU  45   0.271  -0.429  -6.314
  317    H    ARG  46           HN       ARG  46  -2.198  -1.665  -1.022
  318    HA   ARG  46           HA       ARG  46  -3.048   1.147  -1.293
  319    HB2  ARG  46           HB2      ARG  46  -4.357  -0.857   0.544
  320    HB3  ARG  46           HB1      ARG  46  -4.774   0.846   0.388
  321    HG2  ARG  46           HG2      ARG  46  -5.403   0.467  -1.947
  322    HG3  ARG  46           HG1      ARG  46  -5.011  -1.237  -1.774
  323    HD2  ARG  46           HD2      ARG  46  -7.181   0.289  -0.367
  324    HD3  ARG  46           HD1      ARG  46  -7.378  -0.959  -1.594
  325    HE   ARG  46           HE       ARG  46  -5.934  -1.982   0.606
  326   HH11  ARG  46          HH11      ARG  46  -9.128  -1.115  -0.462
  327   HH12  ARG  46          HH12      ARG  46  -9.950  -2.136   0.685
  328   HH21  ARG  46          HH21      ARG  46  -6.987  -3.311   2.162
  329   HH22  ARG  46          HH22      ARG  46  -8.725  -3.344   2.219
  330    H    LYS  47           HN       LYS  47  -2.319   2.511   0.270
  331    HA   LYS  47           HA       LYS  47  -0.367   1.406   2.191
  332    HB2  LYS  47           HB2      LYS  47   0.308   2.958   0.173
  333    HB3  LYS  47           HB1      LYS  47  -0.347   4.239   1.176
  334    HG2  LYS  47           HG2      LYS  47   1.255   3.296   2.985
  335    HG3  LYS  47           HG1      LYS  47   2.068   2.544   1.611
  336    HD2  LYS  47           HD2      LYS  47   3.188   4.551   1.875
  337    HD3  LYS  47           HD1      LYS  47   2.055   4.880   0.571
  338    HE2  LYS  47           HE2      LYS  47   0.718   6.238   1.870
  339    HE3  LYS  47           HE1      LYS  47   1.212   5.459   3.371
  340    HZ1  LYS  47           HZ1      LYS  47   2.060   7.773   3.032
  341    HZ2  LYS  47           HZ2      LYS  47   3.028   7.189   1.774
  342    HZ3  LYS  47           HZ3      LYS  47   3.264   6.631   3.362
  343    H    LYS  48           HN       LYS  48  -0.943   1.641   4.290
  344    HA   LYS  48           HA       LYS  48  -2.808   3.818   4.994
  345    HB2  LYS  48           HB2      LYS  48  -3.680   1.622   5.547
  346    HB3  LYS  48           HB1      LYS  48  -2.211   1.220   6.422
  347    HG2  LYS  48           HG2      LYS  48  -2.715   2.965   8.061
  348    HG3  LYS  48           HG1      LYS  48  -4.199   3.351   7.188
  349    HD2  LYS  48           HD2      LYS  48  -4.583   1.894   9.151
  350    HD3  LYS  48           HD1      LYS  48  -5.085   1.147   7.632
  351    HE2  LYS  48           HE2      LYS  48  -2.970  -0.104   7.571
  352    HE3  LYS  48           HE1      LYS  48  -2.497   0.627   9.099
  353    HZ1  LYS  48           HZ1      LYS  48  -5.006  -0.917   8.871
  354    HZ2  LYS  48           HZ2      LYS  48  -4.100  -0.549  10.261
  355    HZ3  LYS  48           HZ3      LYS  48  -3.523  -1.686   9.150
  356    H    THR  49           HN       THR  49  -1.815   5.535   5.809
  357    HA   THR  49           HA       THR  49   0.780   5.425   6.993
  358    HB   THR  49           HB       THR  49   0.191   7.859   7.603
  359    HG1  THR  49           HG1      THR  49  -2.056   7.739   7.446
  360   HG21  THR  49          HG21      THR  49   0.126   7.007   4.704
  361   HG22  THR  49          HG22      THR  49   1.580   7.224   5.680
  362   HG23  THR  49          HG23      THR  49   0.554   8.610   5.306
  363    H    LEU  50           HN       LEU  50   0.834   4.231   8.844
  364    HA   LEU  50           HA       LEU  50  -0.988   4.458  11.013
  365    HB2  LEU  50           HB2      LEU  50   1.946   3.867  11.323
  366    HB3  LEU  50           HB1      LEU  50   0.599   3.221  12.241
  367    HG   LEU  50           HG       LEU  50   0.995   2.550   9.330
  368   HD11  LEU  50          HD11      LEU  50   2.082   1.112  11.741
  369   HD12  LEU  50          HD12      LEU  50   3.022   1.949  10.502
  370   HD13  LEU  50          HD13      LEU  50   2.097   0.502  10.085
  371   HD21  LEU  50          HD21      LEU  50  -0.487   1.221  11.597
  372   HD22  LEU  50          HD22      LEU  50  -0.339   0.586   9.958
  373   HD23  LEU  50          HD23      LEU  50  -1.202   2.096  10.245
  374    H    VAL  51           HN       VAL  51   2.186   5.744  10.342
  375    HA   VAL  51           HA       VAL  51   1.494   8.332  11.558
  376    HB   VAL  51           HB       VAL  51   4.181   6.967  11.747
  377   HG11  VAL  51          HG11      VAL  51   3.241   9.597  12.884
  378   HG12  VAL  51          HG12      VAL  51   4.385   9.373  11.559
  379   HG13  VAL  51          HG13      VAL  51   4.810   8.854  13.190
  380   HG21  VAL  51          HG21      VAL  51   2.610   5.919  13.266
  381   HG22  VAL  51          HG22      VAL  51   2.151   7.493  13.910
  382   HG23  VAL  51          HG23      VAL  51   3.780   6.872  14.175
  383    HA   PRO  52           HA       PRO  52   3.228   9.145   7.501
  384    HB2  PRO  52           HB2      PRO  52   1.746  11.249   6.952
  385    HB3  PRO  52           HB1      PRO  52   0.981   9.686   7.289
  386    HG2  PRO  52           HG2      PRO  52   1.185  12.094   9.039
  387    HG3  PRO  52           HG1      PRO  52  -0.138  10.926   8.886
  388    HD2  PRO  52           HD2      PRO  52   1.994  10.923  10.798
  389    HD3  PRO  52           HD1      PRO  52   0.713   9.708  10.598
  390    H    GLY  53           HN       GLY  53   5.182   9.684   9.181
  391    HA2  GLY  53           HA2      GLY  53   7.111  10.933   9.240
  392    HA3  GLY  53           HA1      GLY  53   6.382  12.006   8.059
  393    HA   PRO  54           HA       PRO  54   6.411  14.161  12.250
  394    HB2  PRO  54           HB2      PRO  54   8.784  15.421  12.206
  395    HB3  PRO  54           HB1      PRO  54   8.637  13.766  12.814
  396    HG2  PRO  54           HG2      PRO  54   9.593  14.726  10.145
  397    HG3  PRO  54           HG1      PRO  54  10.262  13.453  11.182
  398    HD2  PRO  54           HD2      PRO  54   8.636  12.975   9.026
  399    HD3  PRO  54           HD1      PRO  54   8.781  11.889  10.419
  400    HA   PRO  55           HA       PRO  55   5.333  17.986  10.167
  401    HB2  PRO  55           HB2      PRO  55   6.549  19.600  12.303
  402    HB3  PRO  55           HB1      PRO  55   4.855  19.462  11.835
  403    HG2  PRO  55           HG2      PRO  55   5.768  18.415  14.129
  404    HG3  PRO  55           HG1      PRO  55   4.494  17.620  13.182
  405    HD2  PRO  55           HD2      PRO  55   7.423  16.993  13.323
  406    HD3  PRO  55           HD1      PRO  55   6.036  15.881  13.335
  407    H    GLY  56           HN       GLY  56   7.732  16.977   9.178
  408    HA2  GLY  56           HA2      GLY  56   8.869  19.125   7.856
  409    HA3  GLY  56           HA1      GLY  56   9.871  18.857   9.278
  410    H    SER  57           HN       SER  57   8.169  16.504   7.229
  411    HA   SER  57           HA       SER  57  10.656  15.037   6.932
  412    HB2  SER  57           HB2      SER  57   8.788  13.478   5.795
  413    HB3  SER  57           HB1      SER  57   9.084  13.490   7.535
  414    HG   SER  57           HG       SER  57   6.834  14.008   6.333
  415    H    SER  58           HN       SER  58  10.445  13.712   4.699
  416    HA   SER  58           HA       SER  58   9.657  15.370   2.459
  417    HB2  SER  58           HB2      SER  58  12.001  16.104   3.019
  418    HB3  SER  58           HB1      SER  58  12.535  14.443   2.774
  419    HG   SER  58           HG       SER  58  12.837  15.774   0.916
  420    H    ARG  59           HN       ARG  59   9.040  14.037   0.765
  421    HA   ARG  59           HA       ARG  59   9.327  11.186   1.252
  422    HB2  ARG  59           HB2      ARG  59   7.770  11.055  -0.812
  423    HB3  ARG  59           HB1      ARG  59   7.113  11.605   0.729
  424    HG2  ARG  59           HG2      ARG  59   7.451  13.955  -0.075
  425    HG3  ARG  59           HG1      ARG  59   7.841  13.280  -1.661
  426    HD2  ARG  59           HD2      ARG  59   5.485  13.949  -1.514
  427    HD3  ARG  59           HD1      ARG  59   5.658  12.209  -1.768
  428    HE   ARG  59           HE       ARG  59   5.467  12.886   1.014
  429   HH11  ARG  59          HH11      ARG  59   3.568  12.329  -1.889
  430   HH12  ARG  59          HH12      ARG  59   2.125  11.918  -1.010
  431   HH21  ARG  59          HH21      ARG  59   3.569  12.310   2.157
  432   HH22  ARG  59          HH22      ARG  59   2.130  11.894   1.267
  433    HA   PRO  60           HA       PRO  60  13.050  11.025  -1.146
  434    HB2  PRO  60           HB2      PRO  60  12.697   8.252  -1.564
  435    HB3  PRO  60           HB1      PRO  60  13.669   9.029  -0.312
  436    HG2  PRO  60           HG2      PRO  60  10.900   7.946  -0.158
  437    HG3  PRO  60           HG1      PRO  60  12.171   7.989   1.080
  438    HD2  PRO  60           HD2      PRO  60  10.111   9.666   1.213
  439    HD3  PRO  60           HD1      PRO  60  11.751  10.213   1.616
  440    H    VAL  61           HN       VAL  61  13.557  11.036  -3.242
  441    HA   VAL  61           HA       VAL  61  11.408  10.680  -5.171
  442    HB   VAL  61           HB       VAL  61  14.209  11.688  -5.687
  443   HG11  VAL  61          HG11      VAL  61  13.041  11.078  -7.701
  444   HG12  VAL  61          HG12      VAL  61  13.144  12.837  -7.594
  445   HG13  VAL  61          HG13      VAL  61  11.630  12.018  -7.209
  446   HG21  VAL  61          HG21      VAL  61  11.777  13.303  -4.930
  447   HG22  VAL  61          HG22      VAL  61  13.325  13.956  -5.462
  448   HG23  VAL  61          HG23      VAL  61  13.223  13.062  -3.948
  449    H    LYS  62           HN       LYS  62  11.798   9.437  -7.135
  450    HA   LYS  62           HA       LYS  62  12.943   6.914  -6.675
  451    HB2  LYS  62           HB2      LYS  62  11.850   8.276  -9.102
  452    HB3  LYS  62           HB1      LYS  62  12.716   6.756  -9.267
  453    HG2  LYS  62           HG2      LYS  62  11.124   5.764  -7.608
  454    HG3  LYS  62           HG1      LYS  62  10.193   7.260  -7.713
  455    HD2  LYS  62           HD2      LYS  62   9.704   6.922  -9.990
  456    HD3  LYS  62           HD1      LYS  62  10.933   5.670 -10.148
  457    HE2  LYS  62           HE2      LYS  62   9.617   4.226  -8.651
  458    HE3  LYS  62           HE1      LYS  62   8.372   5.471  -8.567
  459    HZ1  LYS  62           HZ1      LYS  62   9.265   4.218 -11.101
  460    HZ2  LYS  62           HZ2      LYS  62   7.921   5.228 -10.871
  461    HZ3  LYS  62           HZ3      LYS  62   7.938   3.673 -10.207
  462    H    GLY  63           HN       GLY  63  14.962   6.496  -6.496
  463    HA2  GLY  63           HA2      GLY  63  17.040   6.447  -7.989
  464    HA3  GLY  63           HA1      GLY  63  16.917   8.199  -7.874
  465    H    GLN  64           HN       GLN  64  15.926   8.154  -5.146
  466    HA   GLN  64           HA       GLN  64  18.498   8.088  -3.840
  467    HB2  GLN  64           HB2      GLN  64  16.030   8.241  -2.196
  468    HB3  GLN  64           HB1      GLN  64  17.516   9.188  -2.092
  469    HG2  GLN  64           HG2      GLN  64  15.325   9.547  -4.113
  470    HG3  GLN  64           HG1      GLN  64  15.576  10.535  -2.684
  471   HE21  GLN  64          HE21      GLN  64  18.180   9.398  -4.793
  472   HE22  GLN  64          HE22      GLN  64  18.604  10.964  -5.388
  473    H    VAL  65           HN       VAL  65  19.290   6.525  -2.449
  474    HA   VAL  65           HA       VAL  65  17.684   4.100  -2.281
  475    HB   VAL  65           HB       VAL  65  19.542   2.889  -1.576
  476   HG11  VAL  65          HG11      VAL  65  19.747   3.545  -3.893
  477   HG12  VAL  65          HG12      VAL  65  21.335   3.382  -3.146
  478   HG13  VAL  65          HG13      VAL  65  20.652   4.984  -3.424
  479   HG21  VAL  65          HG21      VAL  65  20.308   4.189   0.260
  480   HG22  VAL  65          HG22      VAL  65  20.872   5.474  -0.811
  481   HG23  VAL  65          HG23      VAL  65  21.676   3.902  -0.815
  482    H    VAL  66           HN       VAL  66  16.719   3.442  -0.478
  483    HA   VAL  66           HA       VAL  66  16.860   5.224   1.847
  484    HB   VAL  66           HB       VAL  66  14.447   5.202   2.045
  485   HG11  VAL  66          HG11      VAL  66  15.232   5.981  -0.766
  486   HG12  VAL  66          HG12      VAL  66  15.491   6.969   0.668
  487   HG13  VAL  66          HG13      VAL  66  13.851   6.591   0.146
  488   HG21  VAL  66          HG21      VAL  66  13.003   4.244   0.359
  489   HG22  VAL  66          HG22      VAL  66  14.059   2.988   1.009
  490   HG23  VAL  66          HG23      VAL  66  14.397   3.702  -0.572
  491    H    THR  67           HN       THR  67  16.346   4.317   3.823
  492    HA   THR  67           HA       THR  67  16.518   1.401   3.858
  493    HB   THR  67           HB       THR  67  16.919   1.737   6.330
  494    HG1  THR  67           HG1      THR  67  17.681   3.999   6.736
  495   HG21  THR  67          HG21      THR  67  18.770   1.361   4.775
  496   HG22  THR  67          HG22      THR  67  19.231   2.473   6.065
  497   HG23  THR  67          HG23      THR  67  18.855   3.095   4.456
  498    H    VAL  68           HN       VAL  68  14.589   0.428   3.847
  499    HA   VAL  68           HA       VAL  68  12.559   1.591   5.603
  500    HB   VAL  68           HB       VAL  68  10.898   0.142   4.434
  501   HG11  VAL  68          HG11      VAL  68  10.784   1.503   2.391
  502   HG12  VAL  68          HG12      VAL  68  12.414   2.095   2.705
  503   HG13  VAL  68          HG13      VAL  68  11.106   2.478   3.825
  504   HG21  VAL  68          HG21      VAL  68  11.505  -0.811   2.256
  505   HG22  VAL  68          HG22      VAL  68  12.417  -1.554   3.570
  506   HG23  VAL  68          HG23      VAL  68  13.187  -0.358   2.527
  507    H    HIS  69           HN       HIS  69  11.668   0.394   7.205
  508    HA   HIS  69           HA       HIS  69  12.792  -2.288   7.587
  509    HB2  HIS  69           HB2      HIS  69  12.982  -0.843   9.572
  510    HB3  HIS  69           HB1      HIS  69  11.255  -0.507   9.520
  511    HD1  HIS  69           HD1      HIS  69  12.771  -1.919  11.976
  512    HD2  HIS  69           HD2      HIS  69  10.541  -3.794   9.020
  513    HE1  HIS  69           HE1      HIS  69  11.945  -4.105  12.963
  514    HE2  HIS  69           HE2      HIS  69  10.480  -5.093  11.241
  515    H    LEU  70           HN       LEU  70  11.550  -3.892   6.805
  516    HA   LEU  70           HA       LEU  70   8.670  -3.422   6.948
  517    HB2  LEU  70           HB2      LEU  70   8.252  -4.165   4.875
  518    HB3  LEU  70           HB1      LEU  70   9.873  -3.569   4.593
  519    HG   LEU  70           HG       LEU  70   9.268  -6.443   5.234
  520   HD11  LEU  70          HD11      LEU  70   9.600  -5.130   2.528
  521   HD12  LEU  70          HD12      LEU  70   8.104  -5.805   3.177
  522   HD13  LEU  70          HD13      LEU  70   9.468  -6.865   2.821
  523   HD21  LEU  70          HD21      LEU  70  11.470  -6.847   4.303
  524   HD22  LEU  70          HD22      LEU  70  11.579  -5.671   5.612
  525   HD23  LEU  70          HD23      LEU  70  11.660  -5.134   3.934
  526    H    GLN  71           HN       GLN  71   7.538  -4.830   7.948
  527    HA   GLN  71           HA       GLN  71   8.490  -7.609   8.171
  528    HB2  GLN  71           HB2      GLN  71   6.578  -6.609  10.183
  529    HB3  GLN  71           HB1      GLN  71   7.824  -7.832  10.351
  530    HG2  GLN  71           HG2      GLN  71   8.761  -6.264  11.650
  531    HG3  GLN  71           HG1      GLN  71   9.394  -5.719  10.102
  532   HE21  GLN  71          HE21      GLN  71   6.611  -4.868   9.370
  533   HE22  GLN  71          HE22      GLN  71   6.445  -3.338  10.155
  534    H    THR  72           HN       THR  72   7.252  -8.801   7.079
  535    HA   THR  72           HA       THR  72   4.866  -7.514   6.005
  536    HB   THR  72           HB       THR  72   6.655  -9.622   4.825
  537    HG1  THR  72           HG1      THR  72   7.603  -7.960   3.734
  538   HG21  THR  72          HG21      THR  72   5.483  -9.077   2.732
  539   HG22  THR  72          HG22      THR  72   4.405  -8.020   3.649
  540   HG23  THR  72          HG23      THR  72   4.407  -9.757   3.955
  541    H    SER  73           HN       SER  73   2.974  -8.392   6.404
  542    HA   SER  73           HA       SER  73   2.914 -11.101   7.510
  543    HB2  SER  73           HB2      SER  73   0.506  -9.377   7.654
  544    HB3  SER  73           HB1      SER  73   1.236 -10.410   8.895
  545    HG   SER  73           HG       SER  73   2.041  -7.812   8.087
  546    H    LEU  74           HN       LEU  74   0.816 -12.204   7.015
  547    HA   LEU  74           HA       LEU  74   0.347 -12.068   4.151
  548    HB2  LEU  74           HB2      LEU  74  -0.218 -14.135   6.264
  549    HB3  LEU  74           HB1      LEU  74  -0.821 -14.278   4.632
  550    HG   LEU  74           HG       LEU  74   1.999 -14.434   5.617
  551   HD11  LEU  74          HD11      LEU  74   0.727 -16.502   5.487
  552   HD12  LEU  74          HD12      LEU  74   2.011 -16.487   4.276
  553   HD13  LEU  74          HD13      LEU  74   0.341 -16.177   3.799
  554   HD21  LEU  74          HD21      LEU  74   2.088 -12.838   3.820
  555   HD22  LEU  74          HD22      LEU  74   1.107 -13.890   2.794
  556   HD23  LEU  74          HD23      LEU  74   2.737 -14.382   3.261
  557    H    GLU  75           HN       GLU  75  -1.943 -12.404   3.434
  558    HA   GLU  75           HA       GLU  75  -3.638 -10.475   4.502
  559    HB2  GLU  75           HB2      GLU  75  -5.404 -11.471   3.110
  560    HB3  GLU  75           HB1      GLU  75  -3.899 -11.253   2.233
  561    HG2  GLU  75           HG2      GLU  75  -3.405 -13.633   2.495
  562    HG3  GLU  75           HG1      GLU  75  -4.922 -13.841   3.372
  563    H    ASN  76           HN       ASN  76  -2.957 -13.619   5.619
  564    HA   ASN  76           HA       ASN  76  -5.445 -13.795   7.137
  565    HB2  ASN  76           HB2      ASN  76  -4.808 -16.044   7.710
  566    HB3  ASN  76           HB1      ASN  76  -4.549 -15.823   5.984
  567   HD21  ASN  76          HD21      ASN  76  -2.547 -16.091   5.151
  568   HD22  ASN  76          HD22      ASN  76  -1.167 -16.536   6.091
  569    H    GLY  77           HN       GLY  77  -2.273 -12.639   7.505
  570    HA2  GLY  77           HA2      GLY  77  -2.050 -11.237   9.543
  571    HA3  GLY  77           HA1      GLY  77  -2.620 -12.634  10.439
  572    H    THR  78           HN       THR  78  -0.888 -14.384   8.642
  573    HA   THR  78           HA       THR  78   1.252 -14.555  10.457
  574    HB   THR  78           HB       THR  78   0.969 -15.891   7.774
  575    HG1  THR  78           HG1      THR  78   0.222 -16.676  10.423
  576   HG21  THR  78          HG21      THR  78   2.687 -16.632  10.149
  577   HG22  THR  78          HG22      THR  78   3.279 -15.952   8.634
  578   HG23  THR  78          HG23      THR  78   2.536 -17.551   8.650
  579    H    ARG  79           HN       ARG  79   2.941 -13.251  10.599
  580    HA   ARG  79           HA       ARG  79   3.909 -11.769   8.323
  581    HB2  ARG  79           HB2      ARG  79   4.868 -11.996  11.165
  582    HB3  ARG  79           HB1      ARG  79   5.706 -11.047   9.941
  583    HG2  ARG  79           HG2      ARG  79   3.301 -10.037   9.579
  584    HG3  ARG  79           HG1      ARG  79   3.093 -10.572  11.248
  585    HD2  ARG  79           HD2      ARG  79   4.923  -9.249  11.987
  586    HD3  ARG  79           HD1      ARG  79   5.424  -8.905  10.325
  587    HE   ARG  79           HE       ARG  79   2.858  -7.921  10.555
  588   HH11  ARG  79          HH11      ARG  79   5.898  -7.388  12.204
  589   HH12  ARG  79          HH12      ARG  79   5.600  -5.698  12.493
  590   HH21  ARG  79          HH21      ARG  79   2.474  -5.662  10.943
  591   HH22  ARG  79          HH22      ARG  79   3.679  -4.713  11.769
  592    H    VAL  80           HN       VAL  80   5.259 -12.420   6.914
  593    HA   VAL  80           HA       VAL  80   6.456 -15.060   7.253
  594    HB   VAL  80           HB       VAL  80   6.639 -15.064   4.816
  595   HG11  VAL  80          HG11      VAL  80   4.608 -15.880   5.880
  596   HG12  VAL  80          HG12      VAL  80   4.250 -15.137   4.322
  597   HG13  VAL  80          HG13      VAL  80   3.915 -14.258   5.814
  598   HG21  VAL  80          HG21      VAL  80   7.014 -12.678   4.445
  599   HG22  VAL  80          HG22      VAL  80   5.359 -12.333   4.949
  600   HG23  VAL  80          HG23      VAL  80   5.657 -13.262   3.482
  601    H    GLN  81           HN       GLN  81   7.397 -11.858   7.421
  602    HA   GLN  81           HA       GLN  81  10.171 -12.515   7.412
  603    HB2  GLN  81           HB2      GLN  81  10.852 -11.108   5.524
  604    HB3  GLN  81           HB1      GLN  81   9.815 -12.422   4.993
  605    HG2  GLN  81           HG2      GLN  81   7.909 -10.849   4.943
  606    HG3  GLN  81           HG1      GLN  81   9.025  -9.534   5.327
  607   HE21  GLN  81          HE21      GLN  81   7.818 -11.672   2.958
  608   HE22  GLN  81          HE22      GLN  81   8.664 -11.028   1.601
  609    H    GLU  82           HN       GLU  82  11.125 -11.223   8.856
  610    HA   GLU  82           HA       GLU  82  10.107  -8.468   9.105
  611    HB2  GLU  82           HB2      GLU  82   9.544  -9.680  11.154
  612    HB3  GLU  82           HB1      GLU  82  11.216 -10.194  11.325
  613    HG2  GLU  82           HG2      GLU  82  11.957  -8.012  11.784
  614    HG3  GLU  82           HG1      GLU  82  10.421  -7.315  11.282
  615    H    GLU  83           HN       GLU  83  11.503  -7.193   8.175
  616    HA   GLU  83           HA       GLU  83  14.366  -7.683   8.597
  617    HB2  GLU  83           HB2      GLU  83  14.116  -8.305   6.381
  618    HB3  GLU  83           HB1      GLU  83  12.822  -7.162   6.097
  619    HG2  GLU  83           HG2      GLU  83  14.299  -5.379   5.817
  620    HG3  GLU  83           HG1      GLU  83  15.655  -6.279   6.502
  621    HA   PRO  84           HA       PRO  84  13.825  -3.764  10.507
  622    HB2  PRO  84           HB2      PRO  84  16.356  -3.506  11.430
  623    HB3  PRO  84           HB1      PRO  84  15.175  -4.600  12.157
  624    HG2  PRO  84           HG2      PRO  84  17.390  -5.205  10.239
  625    HG3  PRO  84           HG1      PRO  84  16.869  -6.111  11.673
  626    HD2  PRO  84           HD2      PRO  84  16.178  -6.822   9.146
  627    HD3  PRO  84           HD1      PRO  84  15.147  -7.135  10.554
  628    H    GLU  85           HN       GLU  85  15.948  -4.377   7.865
  629    HA   GLU  85           HA       GLU  85  15.851  -1.648   7.062
  630    HB2  GLU  85           HB2      GLU  85  17.634  -1.554   8.785
  631    HB3  GLU  85           HB1      GLU  85  18.558  -2.724   7.853
  632    HG2  GLU  85           HG2      GLU  85  18.949  -1.214   6.119
  633    HG3  GLU  85           HG1      GLU  85  17.665  -0.130   6.660
  634    H    LEU  86           HN       LEU  86  15.281  -1.965   5.187
  635    HA   LEU  86           HA       LEU  86  16.925  -3.580   3.379
  636    HB2  LEU  86           HB2      LEU  86  14.670  -4.438   3.588
  637    HB3  LEU  86           HB1      LEU  86  14.002  -2.849   3.318
  638    HG   LEU  86           HG       LEU  86  14.755  -2.864   1.040
  639   HD11  LEU  86          HD11      LEU  86  15.774  -4.851   0.043
  640   HD12  LEU  86          HD12      LEU  86  15.840  -5.615   1.631
  641   HD13  LEU  86          HD13      LEU  86  16.800  -4.171   1.305
  642   HD21  LEU  86          HD21      LEU  86  13.356  -4.747   0.213
  643   HD22  LEU  86          HD22      LEU  86  12.576  -3.784   1.465
  644   HD23  LEU  86          HD23      LEU  86  13.274  -5.354   1.869
  645    H    VAL  87           HN       VAL  87  18.290  -2.150   2.477
  646    HA   VAL  87           HA       VAL  87  17.260   0.498   1.739
  647    HB   VAL  87           HB       VAL  87  19.338   0.442   3.066
  648   HG11  VAL  87          HG11      VAL  87  21.435  -0.332   2.075
  649   HG12  VAL  87          HG12      VAL  87  20.542  -0.951   0.685
  650   HG13  VAL  87          HG13      VAL  87  20.283  -1.652   2.284
  651   HG21  VAL  87          HG21      VAL  87  20.685   1.919   1.627
  652   HG22  VAL  87          HG22      VAL  87  18.969   2.328   1.620
  653   HG23  VAL  87          HG23      VAL  87  19.675   1.462   0.253
  654    H    PHE  88           HN       PHE  88  16.975   1.056  -0.351
  655    HA   PHE  88           HA       PHE  88  18.130  -0.527  -2.512
  656    HB2  PHE  88           HB2      PHE  88  16.001  -1.126  -3.499
  657    HB3  PHE  88           HB1      PHE  88  16.089  -1.769  -1.862
  658    HD1  PHE  88           HD2      PHE  88  14.907  -0.535  -0.020
  659    HD2  PHE  88           HD1      PHE  88  14.274   0.287  -4.143
  660    HE1  PHE  88           HE2      PHE  88  12.784   0.580   0.533
  661    HE2  PHE  88           HE1      PHE  88  12.153   1.390  -3.613
  662    HZ   PHE  88           HZ       PHE  88  11.395   1.524  -1.275
  663    H    THR  89           HN       THR  89  17.841   0.427  -4.574
  664    HA   THR  89           HA       THR  89  17.618   3.284  -4.537
  665    HB   THR  89           HB       THR  89  17.735   1.466  -6.949
  666    HG1  THR  89           HG1      THR  89  19.494   0.973  -5.612
  667   HG21  THR  89          HG21      THR  89  18.622   4.326  -6.547
  668   HG22  THR  89          HG22      THR  89  17.186   3.808  -7.428
  669   HG23  THR  89          HG23      THR  89  18.790   3.394  -8.035
  670    H    LEU  90           HN       LEU  90  15.717   4.275  -4.460
  671    HA   LEU  90           HA       LEU  90  13.223   3.083  -4.833
  672    HB2  LEU  90           HB2      LEU  90  13.776   5.240  -3.622
  673    HB3  LEU  90           HB1      LEU  90  13.784   6.012  -5.180
  674    HG   LEU  90           HG       LEU  90  11.465   5.516  -5.540
  675   HD11  LEU  90          HD11      LEU  90  10.130   4.323  -3.924
  676   HD12  LEU  90          HD12      LEU  90  11.538   4.102  -2.882
  677   HD13  LEU  90          HD13      LEU  90  11.472   3.313  -4.458
  678   HD21  LEU  90          HD21      LEU  90  11.911   6.579  -2.754
  679   HD22  LEU  90          HD22      LEU  90  10.471   6.822  -3.741
  680   HD23  LEU  90          HD23      LEU  90  12.009   7.517  -4.243
  681    H    GLY  91           HN       GLY  91  12.105   2.541  -6.587
  682    HA2  GLY  91           HA2      GLY  91  11.100   2.872  -8.654
  683    HA3  GLY  91           HA1      GLY  91  12.148   4.245  -8.915
  684    H    ASP  92           HN       ASP  92  14.035   1.774  -7.895
  685    HA   ASP  92           HA       ASP  92  14.879   1.142 -10.609
  686    HB2  ASP  92           HB2      ASP  92  16.584   1.717  -8.859
  687    HB3  ASP  92           HB1      ASP  92  16.085   0.282  -7.964
  688    H    CYS  93           HN       CYS  93  12.642   0.160  -8.494
  689    HA   CYS  93           HA       CYS  93  11.448  -1.733  -8.095
  690    HB2  CYS  93           HB2      CYS  93  12.545  -2.738 -10.722
  691    HB3  CYS  93           HB1      CYS  93  11.018  -3.174  -9.949
  692    HG   CYS  93           HG       CYS  93  11.521   0.068 -10.840
  693    H    ASP  94           HN       ASP  94  14.147  -1.569  -7.117
  694    HA   ASP  94           HA       ASP  94  15.468  -4.048  -7.447
  695    HB2  ASP  94           HB2      ASP  94  16.655  -2.054  -6.665
  696    HB3  ASP  94           HB1      ASP  94  15.662  -2.021  -5.209
  697    H    VAL  95           HN       VAL  95  12.810  -2.973  -5.755
  698    HA   VAL  95           HA       VAL  95  12.776  -5.265  -3.900
  699    HB   VAL  95           HB       VAL  95  11.147  -3.804  -2.612
  700   HG11  VAL  95          HG11      VAL  95  13.429  -4.080  -1.875
  701   HG12  VAL  95          HG12      VAL  95  12.955  -2.395  -1.666
  702   HG13  VAL  95          HG13      VAL  95  13.978  -2.862  -3.024
  703   HG21  VAL  95          HG21      VAL  95  11.297  -1.371  -3.082
  704   HG22  VAL  95          HG22      VAL  95  10.543  -2.272  -4.396
  705   HG23  VAL  95          HG23      VAL  95  12.219  -1.739  -4.543
  706    H    ILE  96           HN       ILE  96  10.064  -4.938  -3.180
  707    HA   ILE  96           HA       ILE  96   8.721  -6.067  -5.446
  708    HB   ILE  96           HB       ILE  96   6.753  -6.192  -3.949
  709   HG12  ILE  96          HG12      ILE  96   8.571  -4.921  -1.887
  710   HG13  ILE  96          HG11      ILE  96   7.184  -4.145  -2.639
  711   HG21  ILE  96          HG21      ILE  96   9.300  -7.212  -2.700
  712   HG22  ILE  96          HG22      ILE  96   8.364  -8.012  -3.962
  713   HG23  ILE  96          HG23      ILE  96   7.674  -7.798  -2.354
  714   HD11  ILE  96          HD11      ILE  96   7.105  -6.569  -0.862
  715   HD12  ILE  96          HD12      ILE  96   5.711  -5.807  -1.628
  716   HD13  ILE  96          HD13      ILE  96   6.644  -4.926  -0.415
  717    H    GLN  97           HN       GLN  97   7.228  -5.022  -6.679
  718    HA   GLN  97           HA       GLN  97   7.709  -2.320  -7.147
  719    HB2  GLN  97           HB2      GLN  97   6.618  -4.163  -8.666
  720    HB3  GLN  97           HB1      GLN  97   5.113  -3.512  -8.026
  721    HG2  GLN  97           HG2      GLN  97   5.511  -2.353 -10.026
  722    HG3  GLN  97           HG1      GLN  97   5.944  -1.239  -8.730
  723   HE21  GLN  97          HE21      GLN  97   8.212  -0.858  -8.302
  724   HE22  GLN  97          HE22      GLN  97   9.372  -1.130  -9.557
  725    H    ALA  98           HN       ALA  98   5.309  -3.895  -5.170
  726    HA   ALA  98           HA       ALA  98   3.577  -1.786  -4.616
  727    HB1  ALA  98           HB1      ALA  98   3.184  -2.938  -2.462
  728    HB2  ALA  98           HB2      ALA  98   4.553  -3.996  -2.810
  729    HB3  ALA  98           HB3      ALA  98   3.125  -4.026  -3.847
  730    H    LEU  99           HN       LEU  99   6.622  -2.685  -3.067
  731    HA   LEU  99           HA       LEU  99   6.574  -0.579  -1.158
  732    HB2  LEU  99           HB2      LEU  99   7.856  -2.657  -0.826
  733    HB3  LEU  99           HB1      LEU  99   8.906  -2.195  -2.161
  734    HG   LEU  99           HG       LEU  99   9.666  -0.234  -0.902
  735   HD11  LEU  99          HD11      LEU  99   7.673   0.232   0.378
  736   HD12  LEU  99          HD12      LEU  99   9.047   0.021   1.464
  737   HD13  LEU  99          HD13      LEU  99   7.860  -1.271   1.276
  738   HD21  LEU  99          HD21      LEU  99   9.870  -2.803   0.658
  739   HD22  LEU  99          HD22      LEU  99  10.913  -1.392   0.852
  740   HD23  LEU  99          HD23      LEU  99  10.920  -2.292  -0.666
  741    H    ASP 100           HN       ASP 100   7.971  -1.045  -4.302
  742    HA   ASP 100           HA       ASP 100   9.823   1.067  -4.309
  743    HB2  ASP 100           HB2      ASP 100   9.848  -0.853  -5.860
  744    HB3  ASP 100           HB1      ASP 100   8.388  -0.258  -6.622
  745    H    LEU 101           HN       LEU 101   6.426   0.877  -5.016
  746    HA   LEU 101           HA       LEU 101   6.291   3.650  -5.830
  747    HB2  LEU 101           HB2      LEU 101   4.152   1.565  -5.458
  748    HB3  LEU 101           HB1      LEU 101   3.912   3.150  -6.144
  749    HG   LEU 101           HG       LEU 101   5.584   0.939  -7.324
  750   HD11  LEU 101          HD11      LEU 101   3.206   0.530  -7.548
  751   HD12  LEU 101          HD12      LEU 101   3.907   0.946  -9.112
  752   HD13  LEU 101          HD13      LEU 101   2.970   2.143  -8.219
  753   HD21  LEU 101          HD21      LEU 101   6.595   3.093  -7.801
  754   HD22  LEU 101          HD22      LEU 101   5.049   3.716  -8.377
  755   HD23  LEU 101          HD23      LEU 101   5.864   2.422  -9.258
  756    H    SER 102           HN       SER 102   5.559   1.688  -3.007
  757    HA   SER 102           HA       SER 102   3.823   3.502  -1.734
  758    HB2  SER 102           HB2      SER 102   3.877   1.166  -1.073
  759    HB3  SER 102           HB1      SER 102   5.564   1.314  -0.578
  760    HG   SER 102           HG       SER 102   4.826   2.875   0.983
  761    H    VAL 103           HN       VAL 103   7.278   3.210  -1.859
  762    HA   VAL 103           HA       VAL 103   7.899   4.742   0.417
  763    HB   VAL 103           HB       VAL 103   9.477   4.096  -2.031
  764   HG11  VAL 103          HG11      VAL 103  10.313   6.198  -1.052
  765   HG12  VAL 103          HG12      VAL 103  11.466   4.883  -0.828
  766   HG13  VAL 103          HG13      VAL 103  10.454   5.409   0.518
  767   HG21  VAL 103          HG21      VAL 103   9.185   2.957   0.708
  768   HG22  VAL 103          HG22      VAL 103  10.709   2.771  -0.147
  769   HG23  VAL 103          HG23      VAL 103   9.222   2.135  -0.853
  770    HA   PRO 104           HA       PRO 104   8.441   8.524  -2.562
  771    HB2  PRO 104           HB2      PRO 104   6.992   8.335  -4.905
  772    HB3  PRO 104           HB1      PRO 104   8.732   8.069  -4.763
  773    HG2  PRO 104           HG2      PRO 104   6.520   6.075  -4.877
  774    HG3  PRO 104           HG1      PRO 104   8.134   6.008  -5.594
  775    HD2  PRO 104           HD2      PRO 104   7.530   4.639  -3.376
  776    HD3  PRO 104           HD1      PRO 104   9.134   5.336  -3.646
  777    H    LEU 105           HN       LEU 105   5.551   6.580  -2.330
  778    HA   LEU 105           HA       LEU 105   3.790   8.855  -1.999
  779    HB2  LEU 105           HB2      LEU 105   3.549   5.890  -1.627
  780    HB3  LEU 105           HB1      LEU 105   2.277   6.970  -1.064
  781    HG   LEU 105           HG       LEU 105   3.146   6.403  -3.878
  782   HD11  LEU 105          HD11      LEU 105   0.467   6.417  -2.506
  783   HD12  LEU 105          HD12      LEU 105   1.431   4.988  -2.880
  784   HD13  LEU 105          HD13      LEU 105   0.770   5.972  -4.186
  785   HD21  LEU 105          HD21      LEU 105   3.058   8.823  -3.723
  786   HD22  LEU 105          HD22      LEU 105   1.480   8.740  -2.941
  787   HD23  LEU 105          HD23      LEU 105   1.660   8.226  -4.618
  788    H    MET 106           HN       MET 106   5.975   7.160  -0.109
  789    HA   MET 106           HA       MET 106   4.800   7.800   2.473
  790    HB2  MET 106           HB2      MET 106   5.629   5.584   2.203
  791    HB3  MET 106           HB1      MET 106   7.129   6.164   1.507
  792    HG2  MET 106           HG2      MET 106   7.905   6.937   3.594
  793    HG3  MET 106           HG1      MET 106   6.324   6.665   4.343
  794    HE1  MET 106           HE1      MET 106   5.606   3.858   2.845
  795    HE2  MET 106           HE2      MET 106   5.223   4.243   4.519
  796    HE3  MET 106           HE3      MET 106   6.069   2.743   4.128
  797    H    ASP 107           HN       ASP 107   5.682   9.242   3.926
  798    HA   ASP 107           HA       ASP 107   7.811  10.964   2.865
  799    HB2  ASP 107           HB2      ASP 107   5.838  11.336   5.113
  800    HB3  ASP 107           HB1      ASP 107   7.243  12.377   4.937
  801    H    VAL 108           HN       VAL 108   9.664  11.481   4.119
  802    HA   VAL 108           HA       VAL 108  10.859   9.238   5.291
  803    HB   VAL 108           HB       VAL 108  11.626  12.132   5.171
  804   HG11  VAL 108          HG11      VAL 108  12.326  11.469   7.405
  805   HG12  VAL 108          HG12      VAL 108  13.725  11.653   6.343
  806   HG13  VAL 108          HG13      VAL 108  13.128  10.040   6.745
  807   HG21  VAL 108          HG21      VAL 108  13.583  11.175   3.992
  808   HG22  VAL 108          HG22      VAL 108  12.048  10.774   3.225
  809   HG23  VAL 108          HG23      VAL 108  12.886   9.568   4.201
  810    H    GLY 109           HN       GLY 109  10.634   8.361   7.191
  811    HA2  GLY 109           HA2      GLY 109  10.778   8.427   9.558
  812    HA3  GLY 109           HA1      GLY 109  10.186  10.079   9.520
  813    H    GLU 110           HN       GLU 110   8.390   7.982   7.491
  814    HA   GLU 110           HA       GLU 110   6.325   7.866   9.571
  815    HB2  GLU 110           HB2      GLU 110   4.671   7.885   7.954
  816    HB3  GLU 110           HB1      GLU 110   5.876   8.974   7.276
  817    HG2  GLU 110           HG2      GLU 110   6.600   7.320   5.746
  818    HG3  GLU 110           HG1      GLU 110   5.633   6.081   6.537
  819    H    THR 111           HN       THR 111   4.852   5.956   9.415
  820    HA   THR 111           HA       THR 111   6.225   3.548   8.504
  821    HB   THR 111           HB       THR 111   4.734   3.680  11.137
  822    HG1  THR 111           HG1      THR 111   7.225   4.516  10.544
  823   HG21  THR 111          HG21      THR 111   6.555   1.589   9.925
  824   HG22  THR 111          HG22      THR 111   4.803   1.466  10.084
  825   HG23  THR 111          HG23      THR 111   5.818   1.504  11.523
  826    H    ALA 112           HN       ALA 112   4.928   2.560   7.100
  827    HA   ALA 112           HA       ALA 112   2.035   3.040   7.366
  828    HB1  ALA 112           HB1      ALA 112   3.590   2.891   4.788
  829    HB2  ALA 112           HB2      ALA 112   2.977   4.369   5.529
  830    HB3  ALA 112           HB3      ALA 112   1.853   3.140   4.950
  831    H    MET 113           HN       MET 113   0.721   1.365   7.064
  832    HA   MET 113           HA       MET 113   1.953  -1.260   6.597
  833    HB2  MET 113           HB2      MET 113   0.573  -1.283   8.546
  834    HB3  MET 113           HB1      MET 113  -0.699  -0.373   7.742
  835    HG2  MET 113           HG2      MET 113  -1.172  -2.281   6.314
  836    HG3  MET 113           HG1      MET 113   0.093  -3.213   7.109
  837    HE1  MET 113           HE1      MET 113  -3.196  -4.895   8.412
  838    HE2  MET 113           HE2      MET 113  -1.604  -5.189   7.715
  839    HE3  MET 113           HE3      MET 113  -2.816  -4.292   6.800
  840    H    VAL 114           HN       VAL 114   1.875  -1.986   4.572
  841    HA   VAL 114           HA       VAL 114  -0.165  -0.824   2.788
  842    HB   VAL 114           HB       VAL 114   2.432  -2.014   1.888
  843   HG11  VAL 114          HG11      VAL 114   0.621   0.002   0.585
  844   HG12  VAL 114          HG12      VAL 114   0.723  -1.712   0.179
  845   HG13  VAL 114          HG13      VAL 114   2.109  -0.659  -0.098
  846   HG21  VAL 114          HG21      VAL 114   1.933   0.847   2.629
  847   HG22  VAL 114          HG22      VAL 114   3.378   0.238   1.818
  848   HG23  VAL 114          HG23      VAL 114   2.997  -0.286   3.460
  849    H    THR 115           HN       THR 115  -1.554  -2.216   1.885
  850    HA   THR 115           HA       THR 115  -0.762  -5.030   1.942
  851    HB   THR 115           HB       THR 115  -3.560  -3.896   1.766
  852    HG1  THR 115           HG1      THR 115  -1.913  -4.825   3.803
  853   HG21  THR 115          HG21      THR 115  -4.252  -6.242   1.918
  854   HG22  THR 115          HG22      THR 115  -2.558  -6.734   1.872
  855   HG23  THR 115          HG23      THR 115  -3.288  -5.956   0.468
  856    H    ALA 116           HN       ALA 116  -0.038  -5.721   0.195
  857    HA   ALA 116           HA       ALA 116  -1.034  -4.689  -2.382
  858    HB1  ALA 116           HB1      ALA 116   1.215  -3.840  -1.885
  859    HB2  ALA 116           HB2      ALA 116   1.201  -4.925  -3.276
  860    HB3  ALA 116           HB3      ALA 116   1.786  -5.500  -1.715
  861    H    ASP 117           HN       ASP 117  -1.714  -6.187  -3.755
  862    HA   ASP 117           HA       ASP 117  -1.962  -8.884  -3.215
  863    HB2  ASP 117           HB2      ASP 117  -2.958  -7.543  -5.171
  864    HB3  ASP 117           HB1      ASP 117  -1.422  -7.806  -5.958
  865    H    SER 118           HN       SER 118  -0.697 -10.705  -3.761
  866    HA   SER 118           HA       SER 118   2.045 -10.451  -3.351
  867    HB2  SER 118           HB2      SER 118   0.414 -12.517  -3.172
  868    HB3  SER 118           HB1      SER 118   0.955 -12.816  -4.822
  869    HG   SER 118           HG       SER 118   2.218 -13.828  -3.083
  870    H    LYS 119           HN       LYS 119   0.150 -10.347  -6.270
  871    HA   LYS 119           HA       LYS 119   2.110 -10.676  -8.210
  872    HB2  LYS 119           HB2      LYS 119   0.727  -9.077  -9.570
  873    HB3  LYS 119           HB1      LYS 119  -0.157 -10.447  -8.906
  874    HG2  LYS 119           HG2      LYS 119  -1.092  -9.043  -7.201
  875    HG3  LYS 119           HG1      LYS 119  -0.067  -7.698  -7.697
  876    HD2  LYS 119           HD2      LYS 119  -2.290  -7.355  -8.553
  877    HD3  LYS 119           HD1      LYS 119  -1.203  -7.694  -9.901
  878    HE2  LYS 119           HE2      LYS 119  -2.850  -9.118 -10.501
  879    HE3  LYS 119           HE1      LYS 119  -2.051 -10.188  -9.347
  880    HZ1  LYS 119           HZ1      LYS 119  -3.632  -9.428  -7.644
  881    HZ2  LYS 119           HZ2      LYS 119  -4.420 -10.146  -8.962
  882    HZ3  LYS 119           HZ3      LYS 119  -4.409  -8.461  -8.804
  883    H    TYR 120           HN       TYR 120   1.542  -7.942  -6.047
  884    HA   TYR 120           HA       TYR 120   3.701  -6.443  -7.346
  885    HB2  TYR 120           HB2      TYR 120   1.788  -5.657  -5.139
  886    HB3  TYR 120           HB1      TYR 120   3.061  -4.617  -5.769
  887    HD1  TYR 120           HD2      TYR 120  -0.195  -6.127  -6.422
  888    HD2  TYR 120           HD1      TYR 120   2.858  -3.596  -7.946
  889    HE1  TYR 120           HE2      TYR 120  -1.743  -5.303  -8.145
  890    HE2  TYR 120           HE1      TYR 120   1.328  -2.769  -9.673
  891    HH   TYR 120           HH       TYR 120  -2.035  -3.368  -9.590
  892    H    CYS 121           HN       CYS 121   3.503  -8.849  -5.304
  893    HA   CYS 121           HA       CYS 121   5.704  -7.903  -3.602
  894    HB2  CYS 121           HB2      CYS 121   3.489  -9.803  -2.812
  895    HB3  CYS 121           HB1      CYS 121   4.853  -9.333  -1.798
  896    HG   CYS 121           HG       CYS 121   1.957  -7.838  -2.185
  897    H    TYR 122           HN       TYR 122   4.416 -11.187  -3.557
  898    HA   TYR 122           HA       TYR 122   6.622 -12.073  -5.271
  899    HB2  TYR 122           HB2      TYR 122   6.087 -13.473  -2.655
  900    HB3  TYR 122           HB1      TYR 122   7.457 -13.649  -3.734
  901    HD1  TYR 122           HD2      TYR 122   9.228 -11.911  -3.805
  902    HD2  TYR 122           HD1      TYR 122   6.041 -11.746  -0.987
  903    HE1  TYR 122           HE2      TYR 122  10.494 -10.304  -2.471
  904    HE2  TYR 122           HE1      TYR 122   7.309 -10.126   0.353
  905    HH   TYR 122           HH       TYR 122   9.672  -9.468   0.689
  906    H    GLY 123           HN       GLY 123   3.839 -12.039  -5.956
  907    HA2  GLY 123           HA2      GLY 123   2.385 -14.326  -5.499
  908    HA3  GLY 123           HA1      GLY 123   2.363 -13.450  -7.019
  909    HA   PRO 124           HA       PRO 124   4.350 -17.064  -8.749
  910    HB2  PRO 124           HB2      PRO 124   5.288 -15.581 -11.022
  911    HB3  PRO 124           HB1      PRO 124   3.885 -16.645 -10.930
  912    HG2  PRO 124           HG2      PRO 124   3.758 -13.919 -11.294
  913    HG3  PRO 124           HG1      PRO 124   2.443 -14.911 -10.637
  914    HD2  PRO 124           HD2      PRO 124   4.431 -13.194  -9.199
  915    HD3  PRO 124           HD1      PRO 124   2.705 -13.450  -8.858
  916    H    GLN 125           HN       GLN 125   5.864 -14.753  -7.219
  917    HA   GLN 125           HA       GLN 125   8.544 -15.157  -8.344
  918    HB2  GLN 125           HB2      GLN 125   7.592 -13.116  -6.329
  919    HB3  GLN 125           HB1      GLN 125   9.149 -13.139  -7.148
  920    HG2  GLN 125           HG2      GLN 125   8.149 -12.649  -9.238
  921    HG3  GLN 125           HG1      GLN 125   6.532 -12.884  -8.592
  922   HE21  GLN 125          HE21      GLN 125   5.578 -11.274  -7.404
  923   HE22  GLN 125          HE22      GLN 125   6.240  -9.690  -7.244
  924    H    GLY 126           HN       GLY 126   6.691 -15.130  -5.360
  925    HA2  GLY 126           HA2      GLY 126   6.946 -16.283  -3.415
  926    HA3  GLY 126           HA1      GLY 126   8.288 -17.159  -4.136
  927    H    SER 127           HN       SER 127   7.903 -15.901  -1.522
  928    HA   SER 127           HA       SER 127   9.712 -13.683  -1.550
  929    HB2  SER 127           HB2      SER 127   7.861 -13.246  -0.193
  930    HB3  SER 127           HB1      SER 127   7.870 -14.858   0.491
  931    HG   SER 127           HG       SER 127   9.043 -14.076   2.040
  932    H    ARG 128           HN       ARG 128  11.437 -13.479  -0.008
  933    HA   ARG 128           HA       ARG 128  13.463 -15.253  -0.411
  934    HB2  ARG 128           HB2      ARG 128  13.007 -13.325   1.859
  935    HB3  ARG 128           HB1      ARG 128  14.517 -14.201   1.644
  936    HG2  ARG 128           HG2      ARG 128  14.904 -13.131  -0.467
  937    HG3  ARG 128           HG1      ARG 128  13.308 -12.380  -0.427
  938    HD2  ARG 128           HD2      ARG 128  15.396 -11.887   1.678
  939    HD3  ARG 128           HD1      ARG 128  15.279 -10.912   0.217
  940    HE   ARG 128           HE       ARG 128  12.769 -11.001   1.485
  941   HH11  ARG 128          HH11      ARG 128  15.963  -9.670   1.971
  942   HH12  ARG 128          HH12      ARG 128  15.392  -8.262   2.820
  943   HH21  ARG 128          HH21      ARG 128  12.009  -9.132   2.610
  944   HH22  ARG 128          HH22      ARG 128  13.171  -7.953   3.165
  945    H    SER 129           HN       SER 129  11.546 -15.039   2.600
  946    HA   SER 129           HA       SER 129  12.725 -17.503   3.518
  947    HB2  SER 129           HB2      SER 129  12.194 -15.661   5.108
  948    HB3  SER 129           HB1      SER 129  10.480 -15.907   4.784
  949    HG   SER 129           HG       SER 129  11.855 -18.194   5.476
  950    HA   PRO 130           HA       PRO 130   8.669 -19.397   2.220
  951    HB2  PRO 130           HB2      PRO 130   6.340 -17.935   2.425
  952    HB3  PRO 130           HB1      PRO 130   7.066 -18.815   3.763
  953    HG2  PRO 130           HG2      PRO 130   6.758 -16.002   3.523
  954    HG3  PRO 130           HG1      PRO 130   7.636 -16.872   4.792
  955    HD2  PRO 130           HD2      PRO 130   8.679 -15.604   2.295
  956    HD3  PRO 130           HD1      PRO 130   9.437 -15.739   3.891
  957    H    TYR 131           HN       TYR 131   8.669 -19.671  -0.028
  958    HA   TYR 131           HA       TYR 131   8.028 -17.800  -1.946
  959    HB2  TYR 131           HB2      TYR 131   8.728 -20.008  -2.617
  960    HB3  TYR 131           HB1      TYR 131   7.335 -20.747  -1.836
  961    HD1  TYR 131           HD1      TYR 131   5.121 -20.641  -2.884
  962    HD2  TYR 131           HD2      TYR 131   8.524 -18.935  -4.790
  963    HE1  TYR 131           HE1      TYR 131   3.865 -20.497  -4.986
  964    HE2  TYR 131           HE2      TYR 131   7.271 -18.790  -6.900
  965    HH   TYR 131           HH       TYR 131   5.378 -19.766  -7.989
  966    H    ILE 132           HN       ILE 132   6.478 -16.358  -1.435
  967    HA   ILE 132           HA       ILE 132   4.065 -16.968  -0.129
  968    HB   ILE 132           HB       ILE 132   4.606 -14.610  -1.926
  969   HG12  ILE 132          HG12      ILE 132   6.370 -14.641  -0.320
  970   HG13  ILE 132          HG11      ILE 132   5.220 -13.397   0.159
  971   HG21  ILE 132          HG21      ILE 132   2.939 -13.486  -0.514
  972   HG22  ILE 132          HG22      ILE 132   2.703 -14.990   0.380
  973   HG23  ILE 132          HG23      ILE 132   2.268 -14.898  -1.330
  974   HD11  ILE 132          HD11      ILE 132   5.410 -16.140   1.349
  975   HD12  ILE 132          HD12      ILE 132   4.331 -14.839   1.863
  976   HD13  ILE 132          HD13      ILE 132   6.081 -14.659   2.032
  977    HA   PRO 133           HA       PRO 133   1.825 -18.886  -3.493
  978    HB2  PRO 133           HB2      PRO 133  -0.685 -18.230  -2.462
  979    HB3  PRO 133           HB1      PRO 133   0.222 -19.701  -2.117
  980    HG2  PRO 133           HG2      PRO 133  -0.017 -17.204  -0.512
  981    HG3  PRO 133           HG1      PRO 133   0.103 -18.888   0.032
  982    HD2  PRO 133           HD2      PRO 133   2.193 -17.211   0.180
  983    HD3  PRO 133           HD1      PRO 133   2.405 -18.932  -0.208
  984    HA   PRO 134           HA       PRO 134   1.173 -15.503  -6.256
  985    HB2  PRO 134           HB2      PRO 134  -0.821 -17.378  -7.431
  986    HB3  PRO 134           HB1      PRO 134   0.479 -16.468  -8.216
  987    HG2  PRO 134           HG2      PRO 134   0.739 -19.075  -7.749
  988    HG3  PRO 134           HG1      PRO 134   2.114 -17.974  -7.543
  989    HD2  PRO 134           HD2      PRO 134   0.390 -19.269  -5.479
  990    HD3  PRO 134           HD1      PRO 134   2.123 -18.884  -5.425
  991    H    HIS 135           HN       HIS 135  -0.002 -13.794  -5.958
  992    HA   HIS 135           HA       HIS 135  -1.746 -12.376  -5.746
  993    HB2  HIS 135           HB2      HIS 135  -3.410 -14.833  -6.302
  994    HB3  HIS 135           HB1      HIS 135  -4.085 -13.218  -6.112
  995    HD1  HIS 135           HD1      HIS 135  -4.607 -14.499  -8.743
  996    HD2  HIS 135           HD2      HIS 135  -1.163 -12.290  -7.981
  997    HE1  HIS 135           HE1      HIS 135  -3.748 -13.782 -10.996
  998    HE2  HIS 135           HE2      HIS 135  -1.523 -12.695 -10.518
  999    H    ALA 136           HN       ALA 136  -0.777 -14.316  -3.467
 1000    HA   ALA 136           HA       ALA 136  -2.895 -13.992  -1.545
 1001    HB1  ALA 136           HB1      ALA 136  -1.234 -14.651   0.113
 1002    HB2  ALA 136           HB2      ALA 136   0.050 -14.481  -1.082
 1003    HB3  ALA 136           HB3      ALA 136  -1.171 -15.738  -1.276
 1004    H    ALA 137           HN       ALA 137  -3.374 -12.170  -0.440
 1005    HA   ALA 137           HA       ALA 137  -2.020  -9.775  -1.263
 1006    HB1  ALA 137           HB1      ALA 137  -4.404  -9.700  -1.037
 1007    HB2  ALA 137           HB2      ALA 137  -3.700  -8.626   0.171
 1008    HB3  ALA 137           HB3      ALA 137  -4.311 -10.208   0.642
 1009    H    LEU 138           HN       LEU 138  -0.266  -9.039  -0.383
 1010    HA   LEU 138           HA       LEU 138   0.600 -10.010   2.199
 1011    HB2  LEU 138           HB2      LEU 138   1.869  -9.114  -0.197
 1012    HB3  LEU 138           HB1      LEU 138   2.438  -8.149   1.148
 1013    HG   LEU 138           HG       LEU 138   3.115 -10.135   2.343
 1014   HD11  LEU 138          HD11      LEU 138   2.966 -12.331   1.332
 1015   HD12  LEU 138          HD12      LEU 138   2.115 -11.642  -0.051
 1016   HD13  LEU 138          HD13      LEU 138   1.369 -11.615   1.549
 1017   HD21  LEU 138          HD21      LEU 138   4.107 -10.139  -0.501
 1018   HD22  LEU 138          HD22      LEU 138   4.922 -10.882   0.876
 1019   HD23  LEU 138          HD23      LEU 138   4.722  -9.130   0.808
 1020    H    CYS 139           HN       CYS 139   0.742  -8.810   4.028
 1021    HA   CYS 139           HA       CYS 139   0.126  -5.953   3.735
 1022    HB2  CYS 139           HB2      CYS 139  -1.036  -6.016   5.878
 1023    HB3  CYS 139           HB1      CYS 139  -1.710  -7.179   4.757
 1024    HG   CYS 139           HG       CYS 139  -1.741  -9.083   6.408
 1025    H    LEU 140           HN       LEU 140   2.032  -5.045   3.812
 1026    HA   LEU 140           HA       LEU 140   3.950  -5.980   5.827
 1027    HB2  LEU 140           HB2      LEU 140   5.659  -4.922   4.329
 1028    HB3  LEU 140           HB1      LEU 140   4.868  -6.357   3.701
 1029    HG   LEU 140           HG       LEU 140   3.450  -4.003   2.843
 1030   HD11  LEU 140          HD11      LEU 140   6.391  -4.100   2.187
 1031   HD12  LEU 140          HD12      LEU 140   5.590  -2.867   3.162
 1032   HD13  LEU 140          HD13      LEU 140   5.205  -3.028   1.446
 1033   HD21  LEU 140          HD21      LEU 140   5.040  -6.096   1.367
 1034   HD22  LEU 140          HD22      LEU 140   3.906  -4.961   0.637
 1035   HD23  LEU 140          HD23      LEU 140   3.326  -6.182   1.769
 1036    H    GLU 141           HN       GLU 141   4.783  -4.632   7.255
 1037    HA   GLU 141           HA       GLU 141   3.800  -1.874   7.266
 1038    HB2  GLU 141           HB2      GLU 141   3.243  -3.201   9.212
 1039    HB3  GLU 141           HB1      GLU 141   4.917  -3.670   9.421
 1040    HG2  GLU 141           HG2      GLU 141   5.509  -1.396  10.016
 1041    HG3  GLU 141           HG1      GLU 141   3.840  -0.881   9.739
 1042    H    VAL 142           HN       VAL 142   5.180  -0.428   6.455
 1043    HA   VAL 142           HA       VAL 142   8.047  -1.057   6.562
 1044    HB   VAL 142           HB       VAL 142   8.116   0.605   4.548
 1045   HG11  VAL 142          HG11      VAL 142   8.694  -1.769   4.468
 1046   HG12  VAL 142          HG12      VAL 142   7.809  -1.275   3.021
 1047   HG13  VAL 142          HG13      VAL 142   6.988  -2.176   4.297
 1048   HG21  VAL 142          HG21      VAL 142   5.285  -0.411   4.358
 1049   HG22  VAL 142          HG22      VAL 142   6.135   0.577   3.170
 1050   HG23  VAL 142          HG23      VAL 142   5.731   1.246   4.752
 1051    H    THR 143           HN       THR 143   9.105   0.088   7.958
 1052    HA   THR 143           HA       THR 143   8.442   2.849   8.593
 1053    HB   THR 143           HB       THR 143  10.916   1.363   9.484
 1054    HG1  THR 143           HG1      THR 143   8.367   1.281  10.779
 1055   HG21  THR 143          HG21      THR 143  10.847   3.715  10.047
 1056   HG22  THR 143          HG22      THR 143  10.582   2.768  11.514
 1057   HG23  THR 143          HG23      THR 143   9.220   3.551  10.710
 1058    H    LEU 144           HN       LEU 144   9.082   4.371   7.143
 1059    HA   LEU 144           HA       LEU 144  11.594   4.046   5.710
 1060    HB2  LEU 144           HB2      LEU 144   9.635   5.085   4.605
 1061    HB3  LEU 144           HB1      LEU 144   9.674   6.381   5.788
 1062    HG   LEU 144           HG       LEU 144  11.867   7.099   4.936
 1063   HD11  LEU 144          HD11      LEU 144  12.755   4.984   4.199
 1064   HD12  LEU 144          HD12      LEU 144  12.736   6.121   2.850
 1065   HD13  LEU 144          HD13      LEU 144  11.509   4.858   2.956
 1066   HD21  LEU 144          HD21      LEU 144   9.831   8.049   3.978
 1067   HD22  LEU 144          HD22      LEU 144   9.804   6.770   2.764
 1068   HD23  LEU 144          HD23      LEU 144  11.121   7.944   2.782
 1069    H    LYS 145           HN       LYS 145  13.254   4.152   7.056
 1070    HA   LYS 145           HA       LYS 145  13.176   6.030   9.285
 1071    HB2  LYS 145           HB2      LYS 145  15.351   4.032   8.708
 1072    HB3  LYS 145           HB1      LYS 145  14.894   4.740  10.252
 1073    HG2  LYS 145           HG2      LYS 145  12.879   3.463  10.325
 1074    HG3  LYS 145           HG1      LYS 145  13.144   2.874   8.682
 1075    HD2  LYS 145           HD2      LYS 145  14.943   2.314  11.042
 1076    HD3  LYS 145           HD1      LYS 145  13.739   1.194  10.387
 1077    HE2  LYS 145           HE2      LYS 145  14.901   0.929   8.386
 1078    HE3  LYS 145           HE1      LYS 145  15.907   2.356   8.659
 1079    HZ1  LYS 145           HZ1      LYS 145  17.315   0.582   9.134
 1080    HZ2  LYS 145           HZ2      LYS 145  16.106  -0.315   9.920
 1081    HZ3  LYS 145           HZ3      LYS 145  16.773   1.046  10.676
 1082    H    THR 146           HN       THR 146  14.861   5.478   6.273
 1083    HA   THR 146           HA       THR 146  16.135   8.067   6.519
 1084    HB   THR 146           HB       THR 146  17.826   5.622   5.957
 1085    HG1  THR 146           HG1      THR 146  17.027   6.748   8.330
 1086   HG21  THR 146          HG21      THR 146  18.622   8.475   6.557
 1087   HG22  THR 146          HG22      THR 146  18.630   7.734   4.957
 1088   HG23  THR 146          HG23      THR 146  19.715   7.136   6.213
 1089    H    ALA 147           HN       ALA 147  16.672   8.983   4.564
 1090    HA   ALA 147           HA       ALA 147  16.554   7.326   2.153
 1091    HB1  ALA 147           HB1      ALA 147  15.255   9.064   0.983
 1092    HB2  ALA 147           HB2      ALA 147  15.078   9.939   2.505
 1093    HB3  ALA 147           HB3      ALA 147  14.347   8.346   2.312
 1094    H    VAL 148           HN       VAL 148  18.286   7.779   0.812
 1095    HA   VAL 148           HA       VAL 148  19.584  10.381   1.302
 1096    HB   VAL 148           HB       VAL 148  21.807   9.389   1.053
 1097   HG11  VAL 148          HG11      VAL 148  20.882   9.793   3.286
 1098   HG12  VAL 148          HG12      VAL 148  21.911   8.359   3.289
 1099   HG13  VAL 148          HG13      VAL 148  20.153   8.185   3.289
 1100   HG21  VAL 148          HG21      VAL 148  21.297   7.392  -0.190
 1101   HG22  VAL 148          HG22      VAL 148  20.340   6.755   1.146
 1102   HG23  VAL 148          HG23      VAL 148  22.086   6.946   1.320
 1103    H    ASP 149           HN       ASP 149  20.287  11.470  -0.403
 1104    HA   ASP 149           HA       ASP 149  19.550  10.416  -2.982
 1105    HB2  ASP 149           HB2      ASP 149  20.024  12.736  -3.730
 1106    HB3  ASP 149           HB1      ASP 149  18.810  12.648  -2.472
 1107    H    LEU 150           HN       LEU 150  20.970   9.323  -4.080
 1108    HA   LEU 150           HA       LEU 150  23.491  10.455  -4.722
 1109    HB2  LEU 150           HB2      LEU 150  24.896   8.744  -3.968
 1110    HB3  LEU 150           HB1      LEU 150  23.823   9.101  -2.633
 1111    HG   LEU 150           HG       LEU 150  23.320   6.779  -4.483
 1112   HD11  LEU 150          HD11      LEU 150  24.416   5.354  -2.842
 1113   HD12  LEU 150          HD12      LEU 150  24.849   6.766  -1.881
 1114   HD13  LEU 150          HD13      LEU 150  25.558   6.540  -3.478
 1115   HD21  LEU 150          HD21      LEU 150  22.441   7.400  -1.662
 1116   HD22  LEU 150          HD22      LEU 150  22.016   5.960  -2.586
 1117   HD23  LEU 150          HD23      LEU 150  21.438   7.544  -3.107
 1118    H    GLU 151           HN       GLU 151  21.245   7.905  -4.905
 1119    HA   GLU 151           HA       GLU 151  20.363   6.629  -6.529
 1120    HB2  GLU 151           HB2      GLU 151  20.163   8.987  -7.537
 1121    HB3  GLU 151           HB1      GLU 151  21.501   8.507  -8.574
 1122    HG2  GLU 151           HG2      GLU 151  20.042   6.464  -9.127
 1123    HG3  GLU 151           HG1      GLU 151  18.709   7.419  -8.471
 1124    H    HIS 152           HN       HIS 152  21.196   5.917  -9.078
 1125    HA   HIS 152           HA       HIS 152  23.913   4.934  -8.830
 1126    HB2  HIS 152           HB2      HIS 152  22.312   3.436  -7.476
 1127    HB3  HIS 152           HB1      HIS 152  21.677   2.921  -9.033
 1128    HD1  HIS 152           HD1      HIS 152  22.507   0.497  -8.626
 1129    HD2  HIS 152           HD2      HIS 152  25.528   3.359  -8.670
 1130    HE1  HIS 152           HE1      HIS 152  24.657  -0.792  -8.790
 1131    HE2  HIS 152           HE2      HIS 152  26.467   0.960  -8.943
 1132    H    HIS 153           HN       HIS 153  21.872   6.397 -10.715
 1133    HA   HIS 153           HA       HIS 153  22.090   4.627 -13.042
 1134    HB2  HIS 153           HB2      HIS 153  19.887   5.791 -12.324
 1135    HB3  HIS 153           HB1      HIS 153  20.602   7.240 -13.025
 1136    HD1  HIS 153           HD1      HIS 153  20.093   7.576 -15.451
 1137    HD2  HIS 153           HD2      HIS 153  19.761   3.587 -14.311
 1138    HE1  HIS 153           HE1      HIS 153  19.222   6.360 -17.476
 1139    HE2  HIS 153           HE2      HIS 153  18.787   4.015 -16.670
 1140    H    HIS 154           HN       HIS 154  24.398   5.043 -13.027
 1141    HA   HIS 154           HA       HIS 154  26.228   5.809 -14.090
 1142    HB2  HIS 154           HB2      HIS 154  24.250   7.438 -15.687
 1143    HB3  HIS 154           HB1      HIS 154  25.972   7.336 -16.050
 1144    HD1  HIS 154           HD1      HIS 154  23.104   6.141 -17.432
 1145    HD2  HIS 154           HD2      HIS 154  26.492   4.190 -16.020
 1146    HE1  HIS 154           HE1      HIS 154  23.139   3.912 -18.606
 1147    HE2  HIS 154           HE2      HIS 154  25.109   2.685 -17.598
 1148    H    HIS 155           HN       HIS 155  24.809   8.942 -14.678
 1149    HA   HIS 155           HA       HIS 155  26.588  10.075 -12.625
 1150    HB2  HIS 155           HB2      HIS 155  26.692  10.468 -15.560
 1151    HB3  HIS 155           HB1      HIS 155  26.848  11.920 -14.580
 1152    HD1  HIS 155           HD1      HIS 155  29.144  12.458 -13.818
 1153    HD2  HIS 155           HD2      HIS 155  28.708   8.426 -14.779
 1154    HE1  HIS 155           HE1      HIS 155  31.435  11.447 -13.577
 1155    HE2  HIS 155           HE2      HIS 155  31.167   9.030 -14.237
 1156    H    HIS 156           HN       HIS 156  26.036  12.101 -11.856
 1157    HA   HIS 156           HA       HIS 156  23.512  13.247 -12.867
 1158    HB2  HIS 156           HB2      HIS 156  24.616  13.181 -10.059
 1159    HB3  HIS 156           HB1      HIS 156  23.411  14.367 -10.551
 1160    HD1  HIS 156           HD1      HIS 156  21.313  13.566  -9.423
 1161    HD2  HIS 156           HD2      HIS 156  23.352  10.503 -11.373
 1162    HE1  HIS 156           HE1      HIS 156  19.826  11.541  -9.270
 1163    HE2  HIS 156           HE2      HIS 156  20.996   9.762 -10.629
 1164    H    HIS 157           HN       HIS 157  26.581  13.938 -11.290
 1165    HA   HIS 157           HA       HIS 157  27.060  15.954 -13.356
 1166    HB2  HIS 157           HB2      HIS 157  27.400  16.273 -10.397
 1167    HB3  HIS 157           HB1      HIS 157  28.607  16.993 -11.455
 1168    HD1  HIS 157           HD1      HIS 157  28.120  19.315 -12.095
 1169    HD2  HIS 157           HD2      HIS 157  24.642  17.184 -11.292
 1170    HE1  HIS 157           HE1      HIS 157  26.234  20.952 -12.396
 1171    HE2  HIS 157           HE2      HIS 157  24.144  19.575 -12.142
  Start of MODEL    5
    1    H1   MET   1           HT1      MET   1 -14.235  -9.336   1.746
    2    H2   MET   1           HT2      MET   1 -13.873 -10.990   1.737
    3    H3   MET   1           HT3      MET   1 -12.980  -9.939   2.717
    4    HA   MET   1           HA       MET   1 -14.973  -9.448   4.009
    5    HB2  MET   1           HB2      MET   1 -16.146 -11.615   2.256
    6    HB3  MET   1           HB1      MET   1 -16.890 -11.047   3.740
    7    HG2  MET   1           HG2      MET   1 -17.994  -9.985   1.955
    8    HG3  MET   1           HG1      MET   1 -16.971  -8.769   2.715
    9    HE1  MET   1           HE1      MET   1 -18.347  -8.536  -0.150
   10    HE2  MET   1           HE2      MET   1 -17.053  -7.851  -1.133
   11    HE3  MET   1           HE3      MET   1 -17.345  -7.238   0.495
   12    H    GLY   2           HN       GLY   2 -15.247 -10.605   5.943
   13    HA2  GLY   2           HA2      GLY   2 -13.379 -12.890   6.130
   14    HA3  GLY   2           HA1      GLY   2 -13.615 -11.698   7.396
   15    H    GLN   3           HN       GLN   3 -16.048 -13.402   5.481
   16    HA   GLN   3           HA       GLN   3 -16.580 -15.336   7.486
   17    HB2  GLN   3           HB2      GLN   3 -17.639 -13.167   8.394
   18    HB3  GLN   3           HB1      GLN   3 -18.839 -13.379   7.122
   19    HG2  GLN   3           HG2      GLN   3 -18.224 -15.557   9.087
   20    HG3  GLN   3           HG1      GLN   3 -19.378 -14.276   9.451
   21   HE21  GLN   3          HE21      GLN   3 -19.647 -17.213   9.039
   22   HE22  GLN   3          HE22      GLN   3 -20.888 -17.380   7.846
   23    HA   PRO   4           HA       PRO   4 -19.836 -15.619   3.726
   24    HB2  PRO   4           HB2      PRO   4 -18.210 -13.880   1.921
   25    HB3  PRO   4           HB1      PRO   4 -19.954 -14.176   1.935
   26    HG2  PRO   4           HG2      PRO   4 -18.986 -11.929   2.959
   27    HG3  PRO   4           HG1      PRO   4 -20.311 -12.788   3.766
   28    HD2  PRO   4           HD2      PRO   4 -17.423 -12.635   4.502
   29    HD3  PRO   4           HD1      PRO   4 -18.854 -12.717   5.547
   30    HA   PRO   5           HA       PRO   5 -16.229 -17.559   1.187
   31    HB2  PRO   5           HB2      PRO   5 -13.723 -16.495   2.265
   32    HB3  PRO   5           HB1      PRO   5 -14.271 -16.566   0.589
   33    HG2  PRO   5           HG2      PRO   5 -14.057 -14.241   1.947
   34    HG3  PRO   5           HG1      PRO   5 -15.288 -14.503   0.696
   35    HD2  PRO   5           HD2      PRO   5 -15.557 -14.626   3.681
   36    HD3  PRO   5           HD1      PRO   5 -16.649 -13.902   2.480
   37    H    ALA   6           HN       ALA   6 -16.028 -19.582   1.937
   38    HA   ALA   6           HA       ALA   6 -14.823 -19.993   4.575
   39    HB1  ALA   6           HB1      ALA   6 -17.262 -19.918   4.886
   40    HB2  ALA   6           HB2      ALA   6 -16.606 -21.518   5.233
   41    HB3  ALA   6           HB3      ALA   6 -17.440 -21.220   3.708
   42    H    GLU   7           HN       GLU   7 -13.812 -21.958   4.862
   43    HA   GLU   7           HA       GLU   7 -13.398 -23.546   2.421
   44    HB2  GLU   7           HB2      GLU   7 -11.360 -22.529   3.241
   45    HB3  GLU   7           HB1      GLU   7 -11.656 -23.134   4.863
   46    HG2  GLU   7           HG2      GLU   7  -9.914 -24.398   3.750
   47    HG3  GLU   7           HG1      GLU   7 -11.308 -25.414   4.092
   48    H    GLU   8           HN       GLU   8 -13.446 -25.808   2.551
   49    HA   GLU   8           HA       GLU   8 -15.291 -26.768   4.605
   50    HB2  GLU   8           HB2      GLU   8 -14.303 -28.121   2.086
   51    HB3  GLU   8           HB1      GLU   8 -15.592 -28.698   3.134
   52    HG2  GLU   8           HG2      GLU   8 -16.989 -26.849   2.543
   53    HG3  GLU   8           HG1      GLU   8 -15.674 -26.079   1.654
   54    H    ALA   9           HN       ALA   9 -12.007 -26.697   4.080
   55    HA   ALA   9           HA       ALA   9 -11.324 -29.304   5.051
   56    HB1  ALA   9           HB1      ALA   9  -9.029 -28.438   5.161
   57    HB2  ALA   9           HB2      ALA   9  -9.628 -26.814   4.829
   58    HB3  ALA   9           HB3      ALA   9  -9.782 -28.075   3.605
   59    H    GLU  10           HN       GLU  10 -11.981 -26.215   6.450
   60    HA   GLU  10           HA       GLU  10 -12.182 -25.428   8.544
   61    HB2  GLU  10           HB2      GLU  10 -13.643 -27.312   8.967
   62    HB3  GLU  10           HB1      GLU  10 -12.261 -28.352   9.292
   63    HG2  GLU  10           HG2      GLU  10 -13.254 -27.723  11.372
   64    HG3  GLU  10           HG1      GLU  10 -11.688 -26.928  11.227
   65    H    GLN  11           HN       GLN  11 -10.259 -24.400   8.639
   66    HA   GLN  11           HA       GLN  11  -8.654 -25.116  10.838
   67    HB2  GLN  11           HB2      GLN  11  -6.442 -25.105   9.544
   68    HB3  GLN  11           HB1      GLN  11  -7.382 -26.587   9.538
   69    HG2  GLN  11           HG2      GLN  11  -8.165 -26.146   7.312
   70    HG3  GLN  11           HG1      GLN  11  -7.406 -24.553   7.318
   71   HE21  GLN  11          HE21      GLN  11  -6.813 -28.008   7.324
   72   HE22  GLN  11          HE22      GLN  11  -5.207 -27.917   6.681
   73    HA   PRO  12           HA       PRO  12  -8.547 -20.653   9.886
   74    HB2  PRO  12           HB2      PRO  12  -9.944 -19.774  11.994
   75    HB3  PRO  12           HB1      PRO  12 -10.755 -20.420  10.561
   76    HG2  PRO  12           HG2      PRO  12 -10.299 -21.688  13.217
   77    HG3  PRO  12           HG1      PRO  12 -11.680 -21.844  12.120
   78    HD2  PRO  12           HD2      PRO  12  -9.560 -23.661  12.387
   79    HD3  PRO  12           HD1      PRO  12 -10.747 -23.623  11.067
   80    H    GLY  13           HN       GLY  13  -7.872 -18.853  11.534
   81    HA2  GLY  13           HA2      GLY  13  -5.458 -19.722  12.803
   82    HA3  GLY  13           HA1      GLY  13  -6.099 -18.084  12.798
   83    H    ALA  14           HN       ALA  14  -5.106 -20.255  14.852
   84    HA   ALA  14           HA       ALA  14  -7.385 -20.236  16.675
   85    HB1  ALA  14           HB1      ALA  14  -4.695 -21.581  16.955
   86    HB2  ALA  14           HB2      ALA  14  -6.163 -22.344  16.342
   87    HB3  ALA  14           HB3      ALA  14  -6.083 -21.798  18.019
   88    H    LEU  15           HN       LEU  15  -7.595 -18.584  18.037
   89    HA   LEU  15           HA       LEU  15  -5.165 -17.531  19.313
   90    HB2  LEU  15           HB2      LEU  15  -6.152 -15.260  19.277
   91    HB3  LEU  15           HB1      LEU  15  -5.751 -15.873  17.689
   92    HG   LEU  15           HG       LEU  15  -8.297 -16.536  17.631
   93   HD11  LEU  15          HD11      LEU  15  -9.708 -14.939  18.813
   94   HD12  LEU  15          HD12      LEU  15  -8.287 -14.257  19.604
   95   HD13  LEU  15          HD13      LEU  15  -8.775 -15.918  19.946
   96   HD21  LEU  15          HD21      LEU  15  -7.276 -13.720  17.298
   97   HD22  LEU  15          HD22      LEU  15  -8.786 -14.341  16.631
   98   HD23  LEU  15          HD23      LEU  15  -7.243 -15.001  16.087
   99    H    ALA  16           HN       ALA  16  -5.957 -16.043  21.249
  100    HA   ALA  16           HA       ALA  16  -6.824 -16.004  23.342
  101    HB1  ALA  16           HB1      ALA  16  -9.221 -17.332  22.067
  102    HB2  ALA  16           HB2      ALA  16  -8.973 -15.595  22.245
  103    HB3  ALA  16           HB3      ALA  16  -9.182 -16.607  23.676
  104    H    ARG  17           HN       ARG  17  -5.195 -17.393  24.037
  105    HA   ARG  17           HA       ARG  17  -6.112 -20.107  24.682
  106    HB2  ARG  17           HB2      ARG  17  -3.812 -20.929  24.273
  107    HB3  ARG  17           HB1      ARG  17  -4.567 -20.314  22.811
  108    HG2  ARG  17           HG2      ARG  17  -3.346 -18.175  23.159
  109    HG3  ARG  17           HG1      ARG  17  -2.500 -18.941  24.504
  110    HD2  ARG  17           HD2      ARG  17  -1.097 -19.081  22.580
  111    HD3  ARG  17           HD1      ARG  17  -1.710 -20.699  22.924
  112    HE   ARG  17           HE       ARG  17  -3.481 -19.896  21.113
  113   HH11  ARG  17          HH11      ARG  17   0.011 -19.568  21.163
  114   HH12  ARG  17          HH12      ARG  17   0.166 -19.566  19.430
  115   HH21  ARG  17          HH21      ARG  17  -3.280 -19.872  18.818
  116   HH22  ARG  17          HH22      ARG  17  -1.705 -19.727  18.097
  117    H    GLU  18           HN       GLU  18  -5.092 -21.007  26.592
  118    HA   GLU  18           HA       GLU  18  -4.423 -18.918  28.491
  119    HB2  GLU  18           HB2      GLU  18  -4.398 -20.838  30.150
  120    HB3  GLU  18           HB1      GLU  18  -5.940 -20.454  29.403
  121    HG2  GLU  18           HG2      GLU  18  -5.697 -22.336  27.892
  122    HG3  GLU  18           HG1      GLU  18  -4.118 -22.706  28.586
  123    H    PHE  19           HN       PHE  19  -2.467 -18.357  27.469
  124    HA   PHE  19           HA       PHE  19  -0.231 -19.973  28.424
  125    HB2  PHE  19           HB2      PHE  19  -0.508 -20.541  26.048
  126    HB3  PHE  19           HB1      PHE  19  -0.457 -18.834  25.627
  127    HD1  PHE  19           HD1      PHE  19   1.572 -21.400  27.405
  128    HD2  PHE  19           HD2      PHE  19   1.547 -17.939  24.924
  129    HE1  PHE  19           HE1      PHE  19   4.019 -21.554  27.168
  130    HE2  PHE  19           HE2      PHE  19   3.991 -18.082  24.690
  131    HZ   PHE  19           HZ       PHE  19   5.234 -19.850  25.841
  132    H    LEU  20           HN       LEU  20   1.609 -18.763  28.937
  133    HA   LEU  20           HA       LEU  20   1.094 -16.083  29.746
  134    HB2  LEU  20           HB2      LEU  20   3.749 -17.515  29.642
  135    HB3  LEU  20           HB1      LEU  20   3.353 -16.100  30.597
  136    HG   LEU  20           HG       LEU  20   2.230 -18.870  30.984
  137   HD11  LEU  20          HD11      LEU  20   4.177 -17.240  32.609
  138   HD12  LEU  20          HD12      LEU  20   4.530 -18.711  31.703
  139   HD13  LEU  20          HD13      LEU  20   3.475 -18.778  33.115
  140   HD21  LEU  20          HD21      LEU  20   0.580 -17.130  31.504
  141   HD22  LEU  20          HD22      LEU  20   1.742 -16.352  32.576
  142   HD23  LEU  20          HD23      LEU  20   1.126 -17.958  32.962
  143    H    ALA  21           HN       ALA  21   0.865 -14.592  28.179
  144    HA   ALA  21           HA       ALA  21   2.359 -14.700  25.735
  145    HB1  ALA  21           HB1      ALA  21   0.082 -13.846  25.750
  146    HB2  ALA  21           HB2      ALA  21   1.197 -12.591  25.201
  147    HB3  ALA  21           HB3      ALA  21   0.557 -12.547  26.843
  148    H    ALA  22           HN       ALA  22   4.449 -14.743  26.956
  149    HA   ALA  22           HA       ALA  22   5.376 -12.167  27.930
  150    HB1  ALA  22           HB1      ALA  22   7.414 -13.349  28.540
  151    HB2  ALA  22           HB2      ALA  22   6.873 -14.776  27.656
  152    HB3  ALA  22           HB3      ALA  22   6.003 -14.252  29.097
  153    H    MET  23           HN       MET  23   5.839 -14.293  25.157
  154    HA   MET  23           HA       MET  23   7.467 -12.174  23.917
  155    HB2  MET  23           HB2      MET  23   7.669 -15.165  23.533
  156    HB3  MET  23           HB1      MET  23   8.540 -13.982  22.570
  157    HG2  MET  23           HG2      MET  23   9.657 -13.182  24.624
  158    HG3  MET  23           HG1      MET  23   8.830 -14.446  25.531
  159    HE1  MET  23           HE1      MET  23  11.944 -15.271  22.223
  160    HE2  MET  23           HE2      MET  23  11.459 -13.655  22.731
  161    HE3  MET  23           HE3      MET  23  10.310 -14.694  21.889
  162    H    GLU  24           HN       GLU  24   4.490 -13.054  23.939
  163    HA   GLU  24           HA       GLU  24   4.155 -12.527  21.080
  164    HB2  GLU  24           HB2      GLU  24   2.628 -14.638  22.618
  165    HB3  GLU  24           HB1      GLU  24   2.176 -14.051  21.029
  166    HG2  GLU  24           HG2      GLU  24   4.475 -14.827  20.261
  167    HG3  GLU  24           HG1      GLU  24   4.560 -15.688  21.800
  168    HA   PRO  25           HA       PRO  25   1.252  -9.656  22.998
  169    HB2  PRO  25           HB2      PRO  25   1.167  -8.338  20.424
  170    HB3  PRO  25           HB1      PRO  25   1.861  -7.747  21.934
  171    HG2  PRO  25           HG2      PRO  25   3.349  -8.404  19.733
  172    HG3  PRO  25           HG1      PRO  25   3.964  -8.463  21.396
  173    HD2  PRO  25           HD2      PRO  25   2.974 -10.695  19.658
  174    HD3  PRO  25           HD1      PRO  25   4.362 -10.660  20.769
  175    H    GLU  26           HN       GLU  26  -0.984  -9.214  22.592
  176    HA   GLU  26           HA       GLU  26  -2.498 -11.246  21.473
  177    HB2  GLU  26           HB2      GLU  26  -3.265  -8.347  21.852
  178    HB3  GLU  26           HB1      GLU  26  -4.400  -9.644  21.510
  179    HG2  GLU  26           HG2      GLU  26  -4.607  -9.458  23.775
  180    HG3  GLU  26           HG1      GLU  26  -3.380 -10.717  23.655
  181    HA   PRO  27           HA       PRO  27  -2.235 -10.778  17.096
  182    HB2  PRO  27           HB2      PRO  27  -5.082 -11.595  17.054
  183    HB3  PRO  27           HB1      PRO  27  -3.684 -12.345  16.279
  184    HG2  PRO  27           HG2      PRO  27  -4.828 -13.466  18.414
  185    HG3  PRO  27           HG1      PRO  27  -3.066 -13.496  18.198
  186    HD2  PRO  27           HD2      PRO  27  -4.736 -11.750  19.967
  187    HD3  PRO  27           HD1      PRO  27  -3.171 -12.523  20.298
  188    H    ALA  28           HN       ALA  28  -2.182  -8.754  16.359
  189    HA   ALA  28           HA       ALA  28  -4.304  -6.866  16.809
  190    HB1  ALA  28           HB1      ALA  28  -1.815  -6.668  15.113
  191    HB2  ALA  28           HB2      ALA  28  -1.976  -6.134  16.786
  192    HB3  ALA  28           HB3      ALA  28  -2.894  -5.331  15.512
  193    HA   PRO  29           HA       PRO  29  -6.657  -7.699  13.159
  194    HB2  PRO  29           HB2      PRO  29  -7.304  -4.842  13.008
  195    HB3  PRO  29           HB1      PRO  29  -8.367  -6.215  13.324
  196    HG2  PRO  29           HG2      PRO  29  -7.715  -4.436  15.242
  197    HG3  PRO  29           HG1      PRO  29  -8.006  -6.150  15.593
  198    HD2  PRO  29           HD2      PRO  29  -5.409  -4.680  15.329
  199    HD3  PRO  29           HD1      PRO  29  -5.879  -5.943  16.488
  200    H    ALA  30           HN       ALA  30  -5.972  -7.936  11.136
  201    HA   ALA  30           HA       ALA  30  -4.081  -6.018  10.043
  202    HB1  ALA  30           HB1      ALA  30  -3.519  -8.401   9.923
  203    HB2  ALA  30           HB2      ALA  30  -3.623  -7.664   8.323
  204    HB3  ALA  30           HB3      ALA  30  -4.941  -8.677   8.915
  205    HA   PRO  31           HA       PRO  31  -7.546  -5.750   6.749
  206    HB2  PRO  31           HB2      PRO  31  -9.920  -7.073   7.785
  207    HB3  PRO  31           HB1      PRO  31  -9.062  -7.363   6.270
  208    HG2  PRO  31           HG2      PRO  31  -9.093  -9.148   8.316
  209    HG3  PRO  31           HG1      PRO  31  -7.742  -9.003   7.176
  210    HD2  PRO  31           HD2      PRO  31  -8.001  -7.911   9.959
  211    HD3  PRO  31           HD1      PRO  31  -6.604  -8.681   9.175
  212    H    ALA  32           HN       ALA  32  -7.671  -3.635   7.325
  213    HA   ALA  32           HA       ALA  32  -9.097  -2.654   9.572
  214    HB1  ALA  32           HB1      ALA  32  -7.309  -1.365   8.551
  215    HB2  ALA  32           HB2      ALA  32  -8.817  -0.451   8.513
  216    HB3  ALA  32           HB3      ALA  32  -8.230  -1.241   7.050
  217    HA   PRO  33           HA       PRO  33 -13.200  -2.817   7.986
  218    HB2  PRO  33           HB2      PRO  33 -14.423  -1.006   9.555
  219    HB3  PRO  33           HB1      PRO  33 -13.817  -2.542  10.193
  220    HG2  PRO  33           HG2      PRO  33 -12.583   0.184  10.316
  221    HG3  PRO  33           HG1      PRO  33 -12.699  -1.048  11.586
  222    HD2  PRO  33           HD2      PRO  33 -10.451  -0.631  10.094
  223    HD3  PRO  33           HD1      PRO  33 -10.875  -2.202  10.806
  224    H    GLU  34           HN       GLU  34 -11.204  -0.204   7.433
  225    HA   GLU  34           HA       GLU  34 -13.188   1.011   5.654
  226    HB2  GLU  34           HB2      GLU  34 -11.196   2.531   7.350
  227    HB3  GLU  34           HB1      GLU  34 -12.252   3.248   6.141
  228    HG2  GLU  34           HG2      GLU  34 -14.203   2.460   7.437
  229    HG3  GLU  34           HG1      GLU  34 -13.098   1.868   8.674
  230    H    GLU  35           HN       GLU  35 -12.318   2.000   3.775
  231    HA   GLU  35           HA       GLU  35 -10.131   0.436   2.728
  232    HB2  GLU  35           HB2      GLU  35 -11.880   2.523   1.414
  233    HB3  GLU  35           HB1      GLU  35 -10.769   1.447   0.579
  234    HG2  GLU  35           HG2      GLU  35 -13.024   0.404   2.257
  235    HG3  GLU  35           HG1      GLU  35 -13.230   0.834   0.558
  236    H    TRP  36           HN       TRP  36  -8.082   1.093   2.445
  237    HA   TRP  36           HA       TRP  36  -7.323   3.799   3.137
  238    HB2  TRP  36           HB2      TRP  36  -5.396   1.863   1.909
  239    HB3  TRP  36           HB1      TRP  36  -5.110   3.081   3.139
  240    HD1  TRP  36           HD1      TRP  36  -7.625   1.749   4.992
  241    HE1  TRP  36           HE1      TRP  36  -6.990  -0.336   6.359
  242    HE3  TRP  36           HE3      TRP  36  -3.384   0.396   2.469
  243    HZ2  TRP  36           HZ2      TRP  36  -4.923  -2.280   6.366
  244    HZ3  TRP  36           HZ3      TRP  36  -2.161  -1.566   3.221
  245    HH2  TRP  36           HH2      TRP  36  -2.900  -2.894   5.107
  246    H    LEU  37           HN       LEU  37  -5.249   4.376   1.517
  247    HA   LEU  37           HA       LEU  37  -6.511   5.138  -0.970
  248    HB2  LEU  37           HB2      LEU  37  -5.080   6.704   0.272
  249    HB3  LEU  37           HB1      LEU  37  -3.722   5.616   0.092
  250    HG   LEU  37           HG       LEU  37  -3.917   5.935  -2.397
  251   HD11  LEU  37          HD11      LEU  37  -5.140   7.884  -3.193
  252   HD12  LEU  37          HD12      LEU  37  -5.769   8.156  -1.568
  253   HD13  LEU  37          HD13      LEU  37  -6.226   6.703  -2.459
  254   HD21  LEU  37          HD21      LEU  37  -2.788   8.085  -2.383
  255   HD22  LEU  37          HD22      LEU  37  -2.243   7.099  -1.026
  256   HD23  LEU  37          HD23      LEU  37  -3.391   8.411  -0.759
  257    H    ASP  38           HN       ASP  38  -6.546   3.696  -2.638
  258    HA   ASP  38           HA       ASP  38  -4.503   1.680  -2.851
  259    HB2  ASP  38           HB2      ASP  38  -6.936   1.390  -3.647
  260    HB3  ASP  38           HB1      ASP  38  -6.441   2.320  -5.061
  261    H    ILE  39           HN       ILE  39  -2.649   1.891  -3.755
  262    HA   ILE  39           HA       ILE  39  -1.647   4.327  -4.700
  263    HB   ILE  39           HB       ILE  39  -0.516   1.571  -5.196
  264   HG12  ILE  39          HG12      ILE  39  -0.323   3.385  -2.789
  265   HG13  ILE  39          HG11      ILE  39  -0.948   1.741  -2.854
  266   HG21  ILE  39          HG21      ILE  39   1.648   2.730  -5.224
  267   HG22  ILE  39          HG22      ILE  39   0.807   4.272  -5.076
  268   HG23  ILE  39          HG23      ILE  39   0.572   3.274  -6.511
  269   HD11  ILE  39          HD11      ILE  39   1.284   0.894  -3.303
  270   HD12  ILE  39          HD12      ILE  39   1.251   1.827  -1.808
  271   HD13  ILE  39          HD13      ILE  39   1.931   2.534  -3.275
  272    H    LEU  40           HN       LEU  40  -2.951   1.515  -6.345
  273    HA   LEU  40           HA       LEU  40  -2.481   2.821  -8.909
  274    HB2  LEU  40           HB2      LEU  40  -3.186  -0.016  -8.264
  275    HB3  LEU  40           HB1      LEU  40  -3.129   0.625  -9.895
  276    HG   LEU  40           HG       LEU  40  -0.801   0.434  -7.984
  277   HD11  LEU  40          HD11      LEU  40  -1.418  -1.041 -10.530
  278   HD12  LEU  40          HD12      LEU  40  -1.468  -1.709  -8.898
  279   HD13  LEU  40          HD13      LEU  40   0.068  -1.183  -9.590
  280   HD21  LEU  40          HD21      LEU  40  -0.948   1.496 -10.799
  281   HD22  LEU  40          HD22      LEU  40   0.547   1.147  -9.933
  282   HD23  LEU  40          HD23      LEU  40  -0.541   2.404  -9.344
  283    H    GLY  41           HN       GLY  41  -4.736   2.661  -6.609
  284    HA2  GLY  41           HA2      GLY  41  -6.986   3.066  -6.487
  285    HA3  GLY  41           HA1      GLY  41  -6.843   3.754  -8.094
  286    H    ASN  42           HN       ASN  42  -5.962   0.460  -7.407
  287    HA   ASN  42           HA       ASN  42  -8.238  -0.358  -9.078
  288    HB2  ASN  42           HB2      ASN  42  -6.938  -2.118  -9.995
  289    HB3  ASN  42           HB1      ASN  42  -6.035  -0.631 -10.142
  290   HD21  ASN  42          HD21      ASN  42  -5.151  -0.759  -7.283
  291   HD22  ASN  42          HD22      ASN  42  -3.936  -1.984  -7.275
  292    H    GLY  43           HN       GLY  43  -6.630  -1.065  -6.025
  293    HA2  GLY  43           HA2      GLY  43  -8.253  -1.623  -4.293
  294    HA3  GLY  43           HA1      GLY  43  -9.066  -2.651  -5.457
  295    H    LEU  44           HN       LEU  44  -5.588  -2.657  -5.077
  296    HA   LEU  44           HA       LEU  44  -5.658  -4.849  -3.211
  297    HB2  LEU  44           HB2      LEU  44  -4.135  -6.285  -4.695
  298    HB3  LEU  44           HB1      LEU  44  -5.850  -6.313  -4.996
  299    HG   LEU  44           HG       LEU  44  -4.359  -6.342  -7.017
  300   HD11  LEU  44          HD11      LEU  44  -5.772  -4.858  -8.311
  301   HD12  LEU  44          HD12      LEU  44  -6.350  -4.096  -6.827
  302   HD13  LEU  44          HD13      LEU  44  -6.722  -5.791  -7.154
  303   HD21  LEU  44          HD21      LEU  44  -2.696  -4.737  -6.337
  304   HD22  LEU  44          HD22      LEU  44  -3.916  -3.470  -6.234
  305   HD23  LEU  44          HD23      LEU  44  -3.507  -4.172  -7.800
  306    H    LEU  45           HN       LEU  45  -4.209  -2.218  -4.584
  307    HA   LEU  45           HA       LEU  45  -1.714  -2.654  -3.079
  308    HB2  LEU  45           HB2      LEU  45  -1.536  -2.374  -5.615
  309    HB3  LEU  45           HB1      LEU  45  -2.151  -0.765  -5.384
  310    HG   LEU  45           HG       LEU  45  -0.216   0.024  -4.451
  311   HD11  LEU  45          HD11      LEU  45   1.446  -1.310  -3.318
  312   HD12  LEU  45          HD12      LEU  45   0.631  -2.797  -3.801
  313   HD13  LEU  45          HD13      LEU  45  -0.148  -1.698  -2.659
  314   HD21  LEU  45          HD21      LEU  45   1.636  -0.776  -5.805
  315   HD22  LEU  45          HD22      LEU  45   0.159  -0.675  -6.772
  316   HD23  LEU  45          HD23      LEU  45   0.733  -2.241  -6.196
  317    H    ARG  46           HN       ARG  46  -2.174  -1.607  -1.104
  318    HA   ARG  46           HA       ARG  46  -3.154   1.164  -1.325
  319    HB2  ARG  46           HB2      ARG  46  -4.369  -0.836   0.580
  320    HB3  ARG  46           HB1      ARG  46  -4.898   0.815   0.275
  321    HG2  ARG  46           HG2      ARG  46  -5.443   0.185  -2.039
  322    HG3  ARG  46           HG1      ARG  46  -4.987  -1.475  -1.669
  323    HD2  ARG  46           HD2      ARG  46  -7.238   0.094  -0.443
  324    HD3  ARG  46           HD1      ARG  46  -7.371  -1.280  -1.536
  325    HE   ARG  46           HE       ARG  46  -5.903  -2.119   0.679
  326   HH11  ARG  46          HH11      ARG  46  -9.118  -1.093  -0.169
  327   HH12  ARG  46          HH12      ARG  46  -9.896  -1.872   1.181
  328   HH21  ARG  46          HH21      ARG  46  -6.921  -3.194   2.497
  329   HH22  ARG  46          HH22      ARG  46  -8.646  -3.072   2.672
  330    H    LYS  47           HN       LYS  47  -2.365   2.558   0.160
  331    HA   LYS  47           HA       LYS  47  -0.473   1.476   2.152
  332    HB2  LYS  47           HB2      LYS  47   0.300   2.966   0.152
  333    HB3  LYS  47           HB1      LYS  47  -0.425   4.282   1.058
  334    HG2  LYS  47           HG2      LYS  47   1.061   3.401   3.001
  335    HG3  LYS  47           HG1      LYS  47   1.974   2.636   1.699
  336    HD2  LYS  47           HD2      LYS  47   3.050   4.668   1.988
  337    HD3  LYS  47           HD1      LYS  47   1.982   4.976   0.625
  338    HE2  LYS  47           HE2      LYS  47   0.597   6.349   1.811
  339    HE3  LYS  47           HE1      LYS  47   0.899   5.512   3.331
  340    HZ1  LYS  47           HZ1      LYS  47   2.966   6.643   3.591
  341    HZ2  LYS  47           HZ2      LYS  47   1.805   7.811   3.205
  342    HZ3  LYS  47           HZ3      LYS  47   2.889   7.287   2.019
  343    H    LYS  48           HN       LYS  48  -1.050   1.783   4.254
  344    HA   LYS  48           HA       LYS  48  -2.887   4.003   4.876
  345    HB2  LYS  48           HB2      LYS  48  -3.864   1.820   5.393
  346    HB3  LYS  48           HB1      LYS  48  -2.467   1.406   6.377
  347    HG2  LYS  48           HG2      LYS  48  -3.032   2.982   8.032
  348    HG3  LYS  48           HG1      LYS  48  -4.205   3.778   6.980
  349    HD2  LYS  48           HD2      LYS  48  -5.453   2.490   8.538
  350    HD3  LYS  48           HD1      LYS  48  -5.525   1.628   7.006
  351    HE2  LYS  48           HE2      LYS  48  -5.166   0.009   8.701
  352    HE3  LYS  48           HE1      LYS  48  -3.640   0.187   7.842
  353    HZ1  LYS  48           HZ1      LYS  48  -3.381   0.106  10.277
  354    HZ2  LYS  48           HZ2      LYS  48  -4.302   1.520  10.416
  355    HZ3  LYS  48           HZ3      LYS  48  -2.810   1.556   9.620
  356    H    THR  49           HN       THR  49  -1.954   5.668   5.825
  357    HA   THR  49           HA       THR  49   0.661   5.512   6.961
  358    HB   THR  49           HB       THR  49   0.200   7.899   7.658
  359    HG1  THR  49           HG1      THR  49  -2.127   7.639   7.727
  360   HG21  THR  49          HG21      THR  49  -0.212   7.152   4.761
  361   HG22  THR  49          HG22      THR  49   1.332   7.421   5.573
  362   HG23  THR  49          HG23      THR  49   0.212   8.762   5.343
  363    H    LEU  50           HN       LEU  50   0.868   4.354   8.799
  364    HA   LEU  50           HA       LEU  50  -0.908   4.508  11.029
  365    HB2  LEU  50           HB2      LEU  50   2.050   3.995  11.240
  366    HB3  LEU  50           HB1      LEU  50   0.762   3.343  12.234
  367    HG   LEU  50           HG       LEU  50   1.140   2.594   9.336
  368   HD11  LEU  50          HD11      LEU  50   2.137   1.191  11.811
  369   HD12  LEU  50          HD12      LEU  50   3.130   1.976  10.577
  370   HD13  LEU  50          HD13      LEU  50   2.179   0.545  10.169
  371   HD21  LEU  50          HD21      LEU  50  -0.380   1.273  11.573
  372   HD22  LEU  50          HD22      LEU  50  -0.295   0.736   9.894
  373   HD23  LEU  50          HD23      LEU  50  -1.092   2.257  10.297
  374    H    VAL  51           HN       VAL  51   2.256   5.817  10.324
  375    HA   VAL  51           HA       VAL  51   1.477   8.419  11.458
  376    HB   VAL  51           HB       VAL  51   4.215   7.144  11.555
  377   HG11  VAL  51          HG11      VAL  51   4.397   9.522  11.233
  378   HG12  VAL  51          HG12      VAL  51   4.870   9.116  12.882
  379   HG13  VAL  51          HG13      VAL  51   3.286   9.824  12.569
  380   HG21  VAL  51          HG21      VAL  51   2.323   7.773  13.813
  381   HG22  VAL  51          HG22      VAL  51   3.956   7.126  13.986
  382   HG23  VAL  51          HG23      VAL  51   2.704   6.168  13.197
  383    HA   PRO  52           HA       PRO  52   3.083   9.281   7.344
  384    HB2  PRO  52           HB2      PRO  52   1.627  11.433   6.892
  385    HB3  PRO  52           HB1      PRO  52   0.868   9.861   7.191
  386    HG2  PRO  52           HG2      PRO  52   1.019  12.234   8.967
  387    HG3  PRO  52           HG1      PRO  52  -0.206  10.957   8.906
  388    HD2  PRO  52           HD2      PRO  52   2.138  11.150  10.615
  389    HD3  PRO  52           HD1      PRO  52   0.825   9.949  10.659
  390    H    GLY  53           HN       GLY  53   5.032   9.872   9.201
  391    HA2  GLY  53           HA2      GLY  53   7.014  11.026   9.082
  392    HA3  GLY  53           HA1      GLY  53   6.292  12.077   7.876
  393    HA   PRO  54           HA       PRO  54   6.542  14.334  12.062
  394    HB2  PRO  54           HB2      PRO  54   9.050  15.451  10.998
  395    HB3  PRO  54           HB1      PRO  54   8.698  14.847  12.620
  396    HG2  PRO  54           HG2      PRO  54  10.302  13.505  10.935
  397    HG3  PRO  54           HG1      PRO  54   9.227  12.668  12.070
  398    HD2  PRO  54           HD2      PRO  54   8.875  13.157   9.135
  399    HD3  PRO  54           HD1      PRO  54   8.525  11.697  10.085
  400    HA   PRO  55           HA       PRO  55   4.858  17.780   9.844
  401    HB2  PRO  55           HB2      PRO  55   6.363  19.595  11.653
  402    HB3  PRO  55           HB1      PRO  55   4.628  19.515  11.319
  403    HG2  PRO  55           HG2      PRO  55   5.597  18.596  13.620
  404    HG3  PRO  55           HG1      PRO  55   4.299  17.735  12.774
  405    HD2  PRO  55           HD2      PRO  55   7.220  17.100  12.903
  406    HD3  PRO  55           HD1      PRO  55   5.825  16.001  12.978
  407    H    GLY  56           HN       GLY  56   8.243  17.394  10.152
  408    HA2  GLY  56           HA2      GLY  56   8.615  19.122   7.791
  409    HA3  GLY  56           HA1      GLY  56   9.817  19.034   9.075
  410    H    SER  57           HN       SER  57   7.930  16.588   7.279
  411    HA   SER  57           HA       SER  57  10.242  14.905   7.029
  412    HB2  SER  57           HB2      SER  57   8.523  13.505   5.753
  413    HB3  SER  57           HB1      SER  57   8.203  13.782   7.463
  414    HG   SER  57           HG       SER  57   6.575  14.287   5.503
  415    H    SER  58           HN       SER  58  10.037  13.735   4.696
  416    HA   SER  58           HA       SER  58   9.767  15.515   2.468
  417    HB2  SER  58           HB2      SER  58  12.058  16.073   3.364
  418    HB3  SER  58           HB1      SER  58  12.513  14.389   3.103
  419    HG   SER  58           HG       SER  58  11.763  16.321   1.159
  420    H    ARG  59           HN       ARG  59   9.131  14.266   0.767
  421    HA   ARG  59           HA       ARG  59   9.201  11.386   1.138
  422    HB2  ARG  59           HB2      ARG  59   7.892  12.978  -1.074
  423    HB3  ARG  59           HB1      ARG  59   7.627  11.272  -0.693
  424    HG2  ARG  59           HG2      ARG  59   6.690  11.910   1.473
  425    HG3  ARG  59           HG1      ARG  59   6.927  13.607   1.072
  426    HD2  ARG  59           HD2      ARG  59   5.411  13.394  -0.819
  427    HD3  ARG  59           HD1      ARG  59   5.186  11.681  -0.463
  428    HE   ARG  59           HE       ARG  59   4.446  12.780   1.863
  429   HH11  ARG  59          HH11      ARG  59   3.561  13.561  -1.436
  430   HH12  ARG  59          HH12      ARG  59   2.019  14.232  -1.014
  431   HH21  ARG  59          HH21      ARG  59   2.404  13.655   2.444
  432   HH22  ARG  59          HH22      ARG  59   1.346  14.261   1.204
  433    HA   PRO  60           HA       PRO  60  13.072  11.089  -1.083
  434    HB2  PRO  60           HB2      PRO  60  12.597   8.357  -1.602
  435    HB3  PRO  60           HB1      PRO  60  13.533   9.038  -0.268
  436    HG2  PRO  60           HG2      PRO  60  10.689   8.143  -0.331
  437    HG3  PRO  60           HG1      PRO  60  11.882   8.013   0.977
  438    HD2  PRO  60           HD2      PRO  60   9.966   9.837   1.122
  439    HD3  PRO  60           HD1      PRO  60  11.628  10.257   1.586
  440    H    VAL  61           HN       VAL  61  13.796  10.748  -3.162
  441    HA   VAL  61           HA       VAL  61  11.701  10.754  -5.224
  442    HB   VAL  61           HB       VAL  61  14.589  11.537  -5.600
  443   HG11  VAL  61          HG11      VAL  61  13.370  11.088  -7.642
  444   HG12  VAL  61          HG12      VAL  61  13.727  12.810  -7.505
  445   HG13  VAL  61          HG13      VAL  61  12.104  12.213  -7.156
  446   HG21  VAL  61          HG21      VAL  61  13.959  13.861  -5.262
  447   HG22  VAL  61          HG22      VAL  61  13.623  12.913  -3.813
  448   HG23  VAL  61          HG23      VAL  61  12.305  13.370  -4.891
  449    H    LYS  62           HN       LYS  62  11.969   9.451  -7.089
  450    HA   LYS  62           HA       LYS  62  13.104   6.917  -6.653
  451    HB2  LYS  62           HB2      LYS  62  11.957   8.193  -9.109
  452    HB3  LYS  62           HB1      LYS  62  12.658   6.576  -9.133
  453    HG2  LYS  62           HG2      LYS  62  11.076   6.148  -7.119
  454    HG3  LYS  62           HG1      LYS  62  10.209   7.556  -7.735
  455    HD2  LYS  62           HD2      LYS  62   9.748   6.506  -9.776
  456    HD3  LYS  62           HD1      LYS  62  10.934   5.232  -9.491
  457    HE2  LYS  62           HE2      LYS  62   9.523   4.578  -7.485
  458    HE3  LYS  62           HE1      LYS  62   8.280   5.643  -8.135
  459    HZ1  LYS  62           HZ1      LYS  62   7.743   4.166  -9.707
  460    HZ2  LYS  62           HZ2      LYS  62   8.570   3.033  -8.734
  461    HZ3  LYS  62           HZ3      LYS  62   9.352   3.763 -10.046
  462    H    GLY  63           HN       GLY  63  15.060   6.481  -6.487
  463    HA2  GLY  63           HA2      GLY  63  17.132   6.344  -7.997
  464    HA3  GLY  63           HA1      GLY  63  17.056   8.099  -7.887
  465    H    GLN  64           HN       GLN  64  16.014   8.037  -5.152
  466    HA   GLN  64           HA       GLN  64  18.563   8.025  -3.851
  467    HB2  GLN  64           HB2      GLN  64  15.975   8.106  -2.337
  468    HB3  GLN  64           HB1      GLN  64  17.507   8.885  -1.954
  469    HG2  GLN  64           HG2      GLN  64  15.528   9.691  -4.070
  470    HG3  GLN  64           HG1      GLN  64  15.861  10.519  -2.559
  471   HE21  GLN  64          HE21      GLN  64  18.301   9.264  -4.797
  472   HE22  GLN  64          HE22      GLN  64  18.961  10.820  -5.192
  473    H    VAL  65           HN       VAL  65  19.418   6.603  -2.470
  474    HA   VAL  65           HA       VAL  65  18.244   3.959  -2.332
  475    HB   VAL  65           HB       VAL  65  20.859   5.087  -1.311
  476   HG11  VAL  65          HG11      VAL  65  21.492   2.776  -0.787
  477   HG12  VAL  65          HG12      VAL  65  19.849   2.252  -1.164
  478   HG13  VAL  65          HG13      VAL  65  20.140   3.334   0.199
  479   HG21  VAL  65          HG21      VAL  65  20.713   4.808  -3.730
  480   HG22  VAL  65          HG22      VAL  65  20.234   3.124  -3.512
  481   HG23  VAL  65          HG23      VAL  65  21.845   3.653  -3.028
  482    H    VAL  66           HN       VAL  66  16.971   3.334  -0.706
  483    HA   VAL  66           HA       VAL  66  16.874   5.051   1.678
  484    HB   VAL  66           HB       VAL  66  14.435   4.827   1.715
  485   HG11  VAL  66          HG11      VAL  66  15.350   6.808   0.698
  486   HG12  VAL  66          HG12      VAL  66  13.940   6.293  -0.223
  487   HG13  VAL  66          HG13      VAL  66  15.561   5.968  -0.836
  488   HG21  VAL  66          HG21      VAL  66  14.301   2.706   0.448
  489   HG22  VAL  66          HG22      VAL  66  14.721   3.592  -1.021
  490   HG23  VAL  66          HG23      VAL  66  13.217   3.949  -0.176
  491    H    THR  67           HN       THR  67  16.333   4.128   3.625
  492    HA   THR  67           HA       THR  67  16.418   1.188   3.701
  493    HB   THR  67           HB       THR  67  16.763   1.515   6.172
  494    HG1  THR  67           HG1      THR  67  17.338   3.604   6.859
  495   HG21  THR  67          HG21      THR  67  19.096   2.228   6.003
  496   HG22  THR  67          HG22      THR  67  18.803   2.783   4.352
  497   HG23  THR  67          HG23      THR  67  18.664   1.070   4.747
  498    H    VAL  68           HN       VAL  68  14.479   0.262   3.748
  499    HA   VAL  68           HA       VAL  68  12.461   1.519   5.458
  500    HB   VAL  68           HB       VAL  68  10.779   0.036   4.340
  501   HG11  VAL  68          HG11      VAL  68  10.622   1.376   2.301
  502   HG12  VAL  68          HG12      VAL  68  12.276   1.939   2.536
  503   HG13  VAL  68          HG13      VAL  68  11.023   2.375   3.699
  504   HG21  VAL  68          HG21      VAL  68  13.061  -0.493   2.436
  505   HG22  VAL  68          HG22      VAL  68  11.377  -0.944   2.169
  506   HG23  VAL  68          HG23      VAL  68  12.284  -1.672   3.493
  507    H    HIS  69           HN       HIS  69  11.561   0.378   7.111
  508    HA   HIS  69           HA       HIS  69  12.651  -2.318   7.571
  509    HB2  HIS  69           HB2      HIS  69  12.831  -0.822   9.521
  510    HB3  HIS  69           HB1      HIS  69  11.105  -0.476   9.440
  511    HD1  HIS  69           HD1      HIS  69  12.195  -1.675  12.060
  512    HD2  HIS  69           HD2      HIS  69  10.692  -3.928   8.914
  513    HE1  HIS  69           HE1      HIS  69  11.464  -3.889  13.045
  514    HE2  HIS  69           HE2      HIS  69  10.487  -5.169  11.158
  515    H    LEU  70           HN       LEU  70  11.373  -3.973   6.951
  516    HA   LEU  70           HA       LEU  70   8.508  -3.428   6.948
  517    HB2  LEU  70           HB2      LEU  70   8.113  -4.211   4.874
  518    HB3  LEU  70           HB1      LEU  70   9.735  -3.594   4.614
  519    HG   LEU  70           HG       LEU  70   9.130  -6.469   5.268
  520   HD11  LEU  70          HD11      LEU  70   8.052  -5.849   3.160
  521   HD12  LEU  70          HD12      LEU  70   9.427  -6.912   2.873
  522   HD13  LEU  70          HD13      LEU  70   9.574  -5.183   2.564
  523   HD21  LEU  70          HD21      LEU  70  11.417  -5.731   5.751
  524   HD22  LEU  70          HD22      LEU  70  11.582  -5.146   4.093
  525   HD23  LEU  70          HD23      LEU  70  11.374  -6.870   4.408
  526    H    GLN  71           HN       GLN  71   7.314  -4.816   7.924
  527    HA   GLN  71           HA       GLN  71   8.269  -7.584   8.254
  528    HB2  GLN  71           HB2      GLN  71   6.300  -6.551  10.179
  529    HB3  GLN  71           HB1      GLN  71   7.571  -7.733  10.421
  530    HG2  GLN  71           HG2      GLN  71   8.186  -5.978  11.789
  531    HG3  GLN  71           HG1      GLN  71   9.176  -5.743  10.358
  532   HE21  GLN  71          HE21      GLN  71   5.906  -5.051   9.916
  533   HE22  GLN  71          HE22      GLN  71   6.038  -3.330  10.046
  534    H    THR  72           HN       THR  72   7.060  -8.836   7.202
  535    HA   THR  72           HA       THR  72   4.609  -7.667   6.121
  536    HB   THR  72           HB       THR  72   6.430  -9.699   4.886
  537    HG1  THR  72           HG1      THR  72   6.646  -7.453   3.587
  538   HG21  THR  72          HG21      THR  72   4.259  -7.967   3.744
  539   HG22  THR  72          HG22      THR  72   4.134  -9.696   4.074
  540   HG23  THR  72          HG23      THR  72   5.254  -9.112   2.840
  541    H    SER  73           HN       SER  73   2.806  -8.618   6.605
  542    HA   SER  73           HA       SER  73   2.861 -11.384   7.570
  543    HB2  SER  73           HB2      SER  73   0.450  -9.618   7.823
  544    HB3  SER  73           HB1      SER  73   1.056 -10.857   8.934
  545    HG   SER  73           HG       SER  73   1.959  -8.209   8.568
  546    H    LEU  74           HN       LEU  74   0.758 -12.519   7.041
  547    HA   LEU  74           HA       LEU  74   0.325 -12.297   4.171
  548    HB2  LEU  74           HB2      LEU  74  -0.152 -14.485   6.172
  549    HB3  LEU  74           HB1      LEU  74  -0.794 -14.566   4.547
  550    HG   LEU  74           HG       LEU  74   2.052 -14.707   5.459
  551   HD11  LEU  74          HD11      LEU  74   0.337 -16.350   3.606
  552   HD12  LEU  74          HD12      LEU  74   0.880 -16.792   5.225
  553   HD13  LEU  74          HD13      LEU  74   2.050 -16.640   3.913
  554   HD21  LEU  74          HD21      LEU  74   2.731 -14.468   3.088
  555   HD22  LEU  74          HD22      LEU  74   2.084 -12.981   3.790
  556   HD23  LEU  74          HD23      LEU  74   1.085 -13.955   2.704
  557    H    GLU  75           HN       GLU  75  -1.927 -12.774   3.413
  558    HA   GLU  75           HA       GLU  75  -3.778 -10.990   4.418
  559    HB2  GLU  75           HB2      GLU  75  -5.465 -12.288   3.082
  560    HB3  GLU  75           HB1      GLU  75  -4.044 -11.766   2.195
  561    HG2  GLU  75           HG2      GLU  75  -3.098 -14.001   2.369
  562    HG3  GLU  75           HG1      GLU  75  -4.509 -14.529   3.286
  563    H    ASN  76           HN       ASN  76  -2.916 -14.089   5.648
  564    HA   ASN  76           HA       ASN  76  -5.392 -14.256   7.204
  565    HB2  ASN  76           HB2      ASN  76  -4.974 -16.490   7.592
  566    HB3  ASN  76           HB1      ASN  76  -4.244 -16.289   6.004
  567   HD21  ASN  76          HD21      ASN  76  -2.026 -16.490   5.794
  568   HD22  ASN  76          HD22      ASN  76  -1.016 -17.059   7.083
  569    H    GLY  77           HN       GLY  77  -2.227 -13.089   7.458
  570    HA2  GLY  77           HA2      GLY  77  -1.905 -11.679   9.472
  571    HA3  GLY  77           HA1      GLY  77  -2.451 -13.060  10.407
  572    H    THR  78           HN       THR  78  -0.809 -14.797   8.491
  573    HA   THR  78           HA       THR  78   1.370 -15.136  10.214
  574    HB   THR  78           HB       THR  78   1.161 -16.125   7.376
  575    HG1  THR  78           HG1      THR  78   0.093 -17.140   9.814
  576   HG21  THR  78          HG21      THR  78   2.583 -17.946   8.124
  577   HG22  THR  78          HG22      THR  78   2.623 -17.272   9.753
  578   HG23  THR  78          HG23      THR  78   3.377 -16.399   8.420
  579    H    ARG  79           HN       ARG  79   2.987 -13.723  10.463
  580    HA   ARG  79           HA       ARG  79   3.955 -12.091   8.313
  581    HB2  ARG  79           HB2      ARG  79   4.977 -12.584  11.095
  582    HB3  ARG  79           HB1      ARG  79   5.775 -11.518   9.943
  583    HG2  ARG  79           HG2      ARG  79   3.357 -10.512   9.724
  584    HG3  ARG  79           HG1      ARG  79   3.188 -11.197  11.345
  585    HD2  ARG  79           HD2      ARG  79   5.061  -9.926  12.140
  586    HD3  ARG  79           HD1      ARG  79   5.443  -9.377  10.501
  587    HE   ARG  79           HE       ARG  79   2.851  -8.558  11.022
  588   HH11  ARG  79          HH11      ARG  79   6.054  -7.976  12.329
  589   HH12  ARG  79          HH12      ARG  79   5.661  -6.374  12.876
  590   HH21  ARG  79          HH21      ARG  79   2.358  -6.430  11.748
  591   HH22  ARG  79          HH22      ARG  79   3.587  -5.489  12.541
  592    H    VAL  80           HN       VAL  80   5.227 -12.621   6.815
  593    HA   VAL  80           HA       VAL  80   6.537 -15.224   6.896
  594    HB   VAL  80           HB       VAL  80   6.678 -14.961   4.443
  595   HG11  VAL  80          HG11      VAL  80   4.752 -16.061   5.459
  596   HG12  VAL  80          HG12      VAL  80   4.297 -15.188   3.995
  597   HG13  VAL  80          HG13      VAL  80   3.931 -14.507   5.580
  598   HG21  VAL  80          HG21      VAL  80   6.821 -12.517   4.362
  599   HG22  VAL  80          HG22      VAL  80   5.151 -12.407   4.921
  600   HG23  VAL  80          HG23      VAL  80   5.510 -13.123   3.349
  601    H    GLN  81           HN       GLN  81   7.264 -12.007   7.306
  602    HA   GLN  81           HA       GLN  81  10.067 -12.450   7.331
  603    HB2  GLN  81           HB2      GLN  81  10.668 -10.847   5.551
  604    HB3  GLN  81           HB1      GLN  81   9.805 -12.238   4.913
  605    HG2  GLN  81           HG2      GLN  81   7.719 -10.839   4.975
  606    HG3  GLN  81           HG1      GLN  81   8.760  -9.463   5.312
  607   HE21  GLN  81          HE21      GLN  81   7.739 -11.779   2.981
  608   HE22  GLN  81          HE22      GLN  81   8.475 -11.044   1.604
  609    H    GLU  82           HN       GLU  82  11.156 -10.796   8.371
  610    HA   GLU  82           HA       GLU  82   9.800  -8.319   8.963
  611    HB2  GLU  82           HB2      GLU  82   8.957  -9.817  10.737
  612    HB3  GLU  82           HB1      GLU  82  10.609 -10.211  11.184
  613    HG2  GLU  82           HG2      GLU  82  10.994  -8.147  12.128
  614    HG3  GLU  82           HG1      GLU  82   9.712  -7.379  11.199
  615    H    GLU  83           HN       GLU  83  11.350  -7.031   8.250
  616    HA   GLU  83           HA       GLU  83  14.134  -7.663   8.973
  617    HB2  GLU  83           HB2      GLU  83  13.505  -6.343   6.369
  618    HB3  GLU  83           HB1      GLU  83  14.875  -7.352   6.799
  619    HG2  GLU  83           HG2      GLU  83  12.074  -8.372   6.396
  620    HG3  GLU  83           HG1      GLU  83  13.319  -8.357   5.147
  621    HA   PRO  84           HA       PRO  84  13.677  -3.552  10.612
  622    HB2  PRO  84           HB2      PRO  84  16.212  -3.383  11.610
  623    HB3  PRO  84           HB1      PRO  84  14.897  -4.241  12.420
  624    HG2  PRO  84           HG2      PRO  84  17.092  -5.334  10.701
  625    HG3  PRO  84           HG1      PRO  84  16.443  -5.969  12.223
  626    HD2  PRO  84           HD2      PRO  84  15.747  -6.994   9.835
  627    HD3  PRO  84           HD1      PRO  84  14.605  -6.907  11.193
  628    H    GLU  85           HN       GLU  85  15.704  -4.581   8.082
  629    HA   GLU  85           HA       GLU  85  16.169  -1.859   7.210
  630    HB2  GLU  85           HB2      GLU  85  18.120  -2.919   8.777
  631    HB3  GLU  85           HB1      GLU  85  18.621  -3.538   7.209
  632    HG2  GLU  85           HG2      GLU  85  19.790  -1.575   7.303
  633    HG3  GLU  85           HG1      GLU  85  18.326  -1.052   6.461
  634    H    LEU  86           HN       LEU  86  15.351  -1.993   5.311
  635    HA   LEU  86           HA       LEU  86  16.558  -3.894   3.445
  636    HB2  LEU  86           HB2      LEU  86  14.289  -4.610   3.753
  637    HB3  LEU  86           HB1      LEU  86  13.696  -2.968   3.607
  638    HG   LEU  86           HG       LEU  86  14.425  -2.932   1.273
  639   HD11  LEU  86          HD11      LEU  86  16.216  -4.565   1.355
  640   HD12  LEU  86          HD12      LEU  86  15.016  -5.052   0.158
  641   HD13  LEU  86          HD13      LEU  86  15.062  -5.844   1.733
  642   HD21  LEU  86          HD21      LEU  86  12.678  -4.441   0.409
  643   HD22  LEU  86          HD22      LEU  86  12.129  -3.484   1.784
  644   HD23  LEU  86          HD23      LEU  86  12.560  -5.179   2.007
  645    H    VAL  87           HN       VAL  87  17.910  -2.673   2.300
  646    HA   VAL  87           HA       VAL  87  17.124   0.101   1.714
  647    HB   VAL  87           HB       VAL  87  19.190  -0.314   3.111
  648   HG11  VAL  87          HG11      VAL  87  20.058  -2.273   1.989
  649   HG12  VAL  87          HG12      VAL  87  21.247  -0.970   1.935
  650   HG13  VAL  87          HG13      VAL  87  20.284  -1.348   0.506
  651   HG21  VAL  87          HG21      VAL  87  20.568   1.338   1.900
  652   HG22  VAL  87          HG22      VAL  87  18.869   1.798   2.023
  653   HG23  VAL  87          HG23      VAL  87  19.501   1.154   0.508
  654    H    PHE  88           HN       PHE  88  17.143   0.820  -0.399
  655    HA   PHE  88           HA       PHE  88  18.140  -0.799  -2.566
  656    HB2  PHE  88           HB2      PHE  88  16.002  -1.287  -3.600
  657    HB3  PHE  88           HB1      PHE  88  16.058  -1.994  -1.990
  658    HD1  PHE  88           HD2      PHE  88  14.894  -0.768  -0.098
  659    HD2  PHE  88           HD1      PHE  88  14.287   0.173  -4.206
  660    HE1  PHE  88           HE2      PHE  88  12.786   0.355   0.474
  661    HE2  PHE  88           HE1      PHE  88  12.170   1.294  -3.646
  662    HZ   PHE  88           HZ       PHE  88  11.410   1.376  -1.313
  663    H    THR  89           HN       THR  89  17.612   0.166  -4.682
  664    HA   THR  89           HA       THR  89  17.608   3.061  -4.571
  665    HB   THR  89           HB       THR  89  17.687   1.263  -7.000
  666    HG1  THR  89           HG1      THR  89  19.933   2.469  -5.754
  667   HG21  THR  89          HG21      THR  89  18.582   4.121  -6.605
  668   HG22  THR  89          HG22      THR  89  17.110   3.621  -7.435
  669   HG23  THR  89          HG23      THR  89  18.687   3.196  -8.101
  670    H    LEU  90           HN       LEU  90  15.741   4.094  -4.485
  671    HA   LEU  90           HA       LEU  90  13.203   3.016  -4.975
  672    HB2  LEU  90           HB2      LEU  90  13.921   5.123  -3.678
  673    HB3  LEU  90           HB1      LEU  90  13.876   5.926  -5.208
  674    HG   LEU  90           HG       LEU  90  11.523   5.460  -5.467
  675   HD11  LEU  90          HD11      LEU  90  11.482   3.287  -4.353
  676   HD12  LEU  90          HD12      LEU  90  10.249   4.369  -3.705
  677   HD13  LEU  90          HD13      LEU  90  11.734   4.079  -2.799
  678   HD21  LEU  90          HD21      LEU  90  12.111   6.557  -2.723
  679   HD22  LEU  90          HD22      LEU  90  10.668   6.855  -3.691
  680   HD23  LEU  90          HD23      LEU  90  12.232   7.467  -4.229
  681    H    GLY  91           HN       GLY  91  12.171   2.584  -6.859
  682    HA2  GLY  91           HA2      GLY  91  11.308   3.199  -8.956
  683    HA3  GLY  91           HA1      GLY  91  12.592   4.385  -9.122
  684    H    ASP  92           HN       ASP  92  13.883   1.489  -8.070
  685    HA   ASP  92           HA       ASP  92  14.714   0.854 -10.813
  686    HB2  ASP  92           HB2      ASP  92  16.517   1.340  -9.169
  687    HB3  ASP  92           HB1      ASP  92  15.963  -0.027  -8.208
  688    H    CYS  93           HN       CYS  93  12.520  -0.076  -8.562
  689    HA   CYS  93           HA       CYS  93  11.386  -1.972  -8.035
  690    HB2  CYS  93           HB2      CYS  93  12.335  -3.001 -10.719
  691    HB3  CYS  93           HB1      CYS  93  10.909  -3.522  -9.813
  692    HG   CYS  93           HG       CYS  93  11.363  -0.651 -11.590
  693    H    ASP  94           HN       ASP  94  14.062  -1.721  -7.135
  694    HA   ASP  94           HA       ASP  94  15.446  -4.190  -7.465
  695    HB2  ASP  94           HB2      ASP  94  16.571  -2.080  -6.768
  696    HB3  ASP  94           HB1      ASP  94  15.692  -2.142  -5.243
  697    H    VAL  95           HN       VAL  95  12.798  -3.106  -5.812
  698    HA   VAL  95           HA       VAL  95  12.712  -5.419  -3.994
  699    HB   VAL  95           HB       VAL  95  11.118  -3.961  -2.670
  700   HG11  VAL  95          HG11      VAL  95  13.958  -3.015  -2.996
  701   HG12  VAL  95          HG12      VAL  95  13.418  -4.346  -1.969
  702   HG13  VAL  95          HG13      VAL  95  12.919  -2.692  -1.608
  703   HG21  VAL  95          HG21      VAL  95  10.560  -2.349  -4.384
  704   HG22  VAL  95          HG22      VAL  95  12.254  -1.871  -4.536
  705   HG23  VAL  95          HG23      VAL  95  11.363  -1.514  -3.052
  706    H    ILE  96           HN       ILE  96   9.970  -4.907  -3.303
  707    HA   ILE  96           HA       ILE  96   8.629  -5.950  -5.627
  708    HB   ILE  96           HB       ILE  96   6.680  -6.154  -4.163
  709   HG12  ILE  96          HG12      ILE  96   8.403  -4.830  -2.054
  710   HG13  ILE  96          HG11      ILE  96   7.028  -4.080  -2.855
  711   HG21  ILE  96          HG21      ILE  96   7.599  -7.734  -2.536
  712   HG22  ILE  96          HG22      ILE  96   9.213  -7.077  -2.806
  713   HG23  ILE  96          HG23      ILE  96   8.375  -7.919  -4.110
  714   HD11  ILE  96          HD11      ILE  96   6.432  -4.854  -0.641
  715   HD12  ILE  96          HD12      ILE  96   6.936  -6.490  -1.061
  716   HD13  ILE  96          HD13      ILE  96   5.550  -5.760  -1.870
  717    H    GLN  97           HN       GLN  97   7.131  -4.795  -6.812
  718    HA   GLN  97           HA       GLN  97   7.697  -2.080  -7.106
  719    HB2  GLN  97           HB2      GLN  97   6.666  -3.641  -8.847
  720    HB3  GLN  97           HB1      GLN  97   5.121  -3.293  -8.072
  721    HG2  GLN  97           HG2      GLN  97   5.202  -1.750  -9.786
  722    HG3  GLN  97           HG1      GLN  97   5.756  -0.824  -8.392
  723   HE21  GLN  97          HE21      GLN  97   8.118  -0.494  -8.174
  724   HE22  GLN  97          HE22      GLN  97   9.081  -0.469  -9.610
  725    H    ALA  98           HN       ALA  98   5.185  -3.708  -5.288
  726    HA   ALA  98           HA       ALA  98   3.525  -1.575  -4.648
  727    HB1  ALA  98           HB1      ALA  98   3.016  -3.861  -4.015
  728    HB2  ALA  98           HB2      ALA  98   3.004  -2.819  -2.594
  729    HB3  ALA  98           HB3      ALA  98   4.381  -3.875  -2.899
  730    H    LEU  99           HN       LEU  99   6.582  -2.575  -3.226
  731    HA   LEU  99           HA       LEU  99   6.518  -0.587  -1.155
  732    HB2  LEU  99           HB2      LEU  99   7.742  -2.679  -0.836
  733    HB3  LEU  99           HB1      LEU  99   8.808  -2.256  -2.170
  734    HG   LEU  99           HG       LEU  99   9.636  -0.322  -0.907
  735   HD11  LEU  99          HD11      LEU  99   9.052  -0.062   1.455
  736   HD12  LEU  99          HD12      LEU  99   7.855  -1.346   1.297
  737   HD13  LEU  99          HD13      LEU  99   7.653   0.162   0.405
  738   HD21  LEU  99          HD21      LEU  99  10.816  -2.435  -0.717
  739   HD22  LEU  99          HD22      LEU  99   9.778  -2.908   0.627
  740   HD23  LEU  99          HD23      LEU  99  10.879  -1.538   0.801
  741    H    ASP 100           HN       ASP 100   8.006  -0.953  -4.281
  742    HA   ASP 100           HA       ASP 100   9.825   1.176  -4.171
  743    HB2  ASP 100           HB2      ASP 100   9.970  -0.629  -5.807
  744    HB3  ASP 100           HB1      ASP 100   8.442  -0.155  -6.515
  745    H    LEU 101           HN       LEU 101   6.446   0.970  -4.875
  746    HA   LEU 101           HA       LEU 101   6.258   3.739  -5.679
  747    HB2  LEU 101           HB2      LEU 101   4.110   1.666  -5.224
  748    HB3  LEU 101           HB1      LEU 101   3.893   3.231  -5.968
  749    HG   LEU 101           HG       LEU 101   5.527   0.961  -7.080
  750   HD11  LEU 101          HD11      LEU 101   3.822   0.946  -8.857
  751   HD12  LEU 101          HD12      LEU 101   2.897   2.149  -7.955
  752   HD13  LEU 101          HD13      LEU 101   3.160   0.543  -7.274
  753   HD21  LEU 101          HD21      LEU 101   6.531   3.114  -7.634
  754   HD22  LEU 101          HD22      LEU 101   4.980   3.697  -8.235
  755   HD23  LEU 101          HD23      LEU 101   5.808   2.378  -9.064
  756    H    SER 102           HN       SER 102   5.546   1.751  -2.856
  757    HA   SER 102           HA       SER 102   3.855   3.614  -1.589
  758    HB2  SER 102           HB2      SER 102   3.757   1.273  -0.977
  759    HB3  SER 102           HB1      SER 102   5.441   1.297  -0.459
  760    HG   SER 102           HG       SER 102   4.662   3.012   1.057
  761    H    VAL 103           HN       VAL 103   7.299   3.229  -1.724
  762    HA   VAL 103           HA       VAL 103   7.965   4.644   0.612
  763    HB   VAL 103           HB       VAL 103   9.507   4.105  -1.889
  764   HG11  VAL 103          HG11      VAL 103  11.510   4.879  -0.741
  765   HG12  VAL 103          HG12      VAL 103  10.564   5.293   0.687
  766   HG13  VAL 103          HG13      VAL 103  10.330   6.186  -0.814
  767   HG21  VAL 103          HG21      VAL 103  10.778   2.673  -0.181
  768   HG22  VAL 103          HG22      VAL 103   9.199   2.112  -0.726
  769   HG23  VAL 103          HG23      VAL 103   9.365   2.894   0.848
  770    HA   PRO 104           HA       PRO 104   8.450   8.602  -2.171
  771    HB2  PRO 104           HB2      PRO 104   7.108   8.480  -4.573
  772    HB3  PRO 104           HB1      PRO 104   8.844   8.209  -4.380
  773    HG2  PRO 104           HG2      PRO 104   6.632   6.210  -4.591
  774    HG3  PRO 104           HG1      PRO 104   8.244   6.184  -5.325
  775    HD2  PRO 104           HD2      PRO 104   7.677   4.719  -3.168
  776    HD3  PRO 104           HD1      PRO 104   9.264   5.485  -3.387
  777    H    LEU 105           HN       LEU 105   5.656   6.547  -2.049
  778    HA   LEU 105           HA       LEU 105   3.781   8.739  -1.856
  779    HB2  LEU 105           HB2      LEU 105   3.593   5.765  -1.521
  780    HB3  LEU 105           HB1      LEU 105   2.242   6.816  -1.109
  781    HG   LEU 105           HG       LEU 105   3.446   6.278  -3.804
  782   HD11  LEU 105          HD11      LEU 105   1.693   4.789  -3.040
  783   HD12  LEU 105          HD12      LEU 105   1.123   5.788  -4.376
  784   HD13  LEU 105          HD13      LEU 105   0.643   6.169  -2.723
  785   HD21  LEU 105          HD21      LEU 105   1.522   8.502  -3.125
  786   HD22  LEU 105          HD22      LEU 105   2.080   8.055  -4.738
  787   HD23  LEU 105          HD23      LEU 105   3.215   8.722  -3.564
  788    H    MET 106           HN       MET 106   5.926   7.162   0.232
  789    HA   MET 106           HA       MET 106   4.428   8.026   2.603
  790    HB2  MET 106           HB2      MET 106   4.954   5.940   3.272
  791    HB3  MET 106           HB1      MET 106   6.150   5.746   1.999
  792    HG2  MET 106           HG2      MET 106   7.870   6.559   3.318
  793    HG3  MET 106           HG1      MET 106   6.757   7.399   4.405
  794    HE1  MET 106           HE1      MET 106   6.948   2.784   4.466
  795    HE2  MET 106           HE2      MET 106   7.904   3.702   3.296
  796    HE3  MET 106           HE3      MET 106   6.141   3.737   3.218
  797    H    ASP 107           HN       ASP 107   5.288   9.475   4.067
  798    HA   ASP 107           HA       ASP 107   7.419  11.173   3.095
  799    HB2  ASP 107           HB2      ASP 107   5.645  11.238   5.530
  800    HB3  ASP 107           HB1      ASP 107   7.024  12.317   5.376
  801    H    VAL 108           HN       VAL 108   9.383  11.603   4.227
  802    HA   VAL 108           HA       VAL 108  10.609   9.261   5.192
  803    HB   VAL 108           HB       VAL 108  11.629  11.481   4.143
  804   HG11  VAL 108          HG11      VAL 108  12.189  11.884   7.072
  805   HG12  VAL 108          HG12      VAL 108  11.150  12.901   6.080
  806   HG13  VAL 108          HG13      VAL 108  12.876  12.802   5.732
  807   HG21  VAL 108          HG21      VAL 108  13.830  10.692   4.802
  808   HG22  VAL 108          HG22      VAL 108  12.770   9.339   4.411
  809   HG23  VAL 108          HG23      VAL 108  13.114   9.732   6.094
  810    H    GLY 109           HN       GLY 109  10.582   8.389   7.092
  811    HA2  GLY 109           HA2      GLY 109  10.924   8.425   9.438
  812    HA3  GLY 109           HA1      GLY 109  10.333  10.081   9.472
  813    H    GLU 110           HN       GLU 110   8.388   8.128   7.512
  814    HA   GLU 110           HA       GLU 110   6.484   7.866   9.723
  815    HB2  GLU 110           HB2      GLU 110   4.697   7.988   8.242
  816    HB3  GLU 110           HB1      GLU 110   5.821   9.193   7.630
  817    HG2  GLU 110           HG2      GLU 110   6.441   7.823   5.827
  818    HG3  GLU 110           HG1      GLU 110   5.679   6.409   6.543
  819    H    THR 111           HN       THR 111   4.927   6.021   9.403
  820    HA   THR 111           HA       THR 111   6.253   3.671   8.307
  821    HB   THR 111           HB       THR 111   4.780   3.622  10.919
  822    HG1  THR 111           HG1      THR 111   7.281   4.507  10.417
  823   HG21  THR 111          HG21      THR 111   6.625   1.638   9.598
  824   HG22  THR 111          HG22      THR 111   4.874   1.493   9.747
  825   HG23  THR 111          HG23      THR 111   5.883   1.442  11.191
  826    H    ALA 112           HN       ALA 112   4.951   2.778   6.888
  827    HA   ALA 112           HA       ALA 112   2.069   3.304   7.146
  828    HB1  ALA 112           HB1      ALA 112   3.692   3.002   4.628
  829    HB2  ALA 112           HB2      ALA 112   3.063   4.516   5.276
  830    HB3  ALA 112           HB3      ALA 112   1.953   3.265   4.707
  831    H    MET 113           HN       MET 113   0.696   1.642   6.944
  832    HA   MET 113           HA       MET 113   1.840  -1.045   6.575
  833    HB2  MET 113           HB2      MET 113   0.456  -0.897   8.541
  834    HB3  MET 113           HB1      MET 113  -0.816  -0.070   7.654
  835    HG2  MET 113           HG2      MET 113  -1.298  -2.071   6.396
  836    HG3  MET 113           HG1      MET 113   0.032  -2.924   7.179
  837    HE1  MET 113           HE1      MET 113  -2.830  -4.149   7.053
  838    HE2  MET 113           HE2      MET 113  -3.073  -4.709   8.708
  839    HE3  MET 113           HE3      MET 113  -1.506  -4.917   7.920
  840    H    VAL 114           HN       VAL 114   1.758  -1.839   4.633
  841    HA   VAL 114           HA       VAL 114  -0.269  -0.754   2.782
  842    HB   VAL 114           HB       VAL 114   2.313  -1.996   1.917
  843   HG11  VAL 114          HG11      VAL 114   0.534   0.030   0.595
  844   HG12  VAL 114          HG12      VAL 114   0.619  -1.690   0.206
  845   HG13  VAL 114          HG13      VAL 114   2.013  -0.649  -0.085
  846   HG21  VAL 114          HG21      VAL 114   2.949  -0.254   3.442
  847   HG22  VAL 114          HG22      VAL 114   1.903   0.889   2.601
  848   HG23  VAL 114          HG23      VAL 114   3.318   0.223   1.785
  849    H    THR 115           HN       THR 115  -1.642  -2.163   1.980
  850    HA   THR 115           HA       THR 115  -0.867  -4.980   2.089
  851    HB   THR 115           HB       THR 115  -3.656  -3.856   1.775
  852    HG1  THR 115           HG1      THR 115  -2.105  -4.406   3.952
  853   HG21  THR 115          HG21      THR 115  -2.555  -6.638   2.035
  854   HG22  THR 115          HG22      THR 115  -3.439  -5.964   0.665
  855   HG23  THR 115          HG23      THR 115  -4.265  -6.243   2.200
  856    H    ALA 116           HN       ALA 116  -0.113  -5.686   0.365
  857    HA   ALA 116           HA       ALA 116  -1.033  -4.634  -2.239
  858    HB1  ALA 116           HB1      ALA 116   1.751  -5.512  -1.491
  859    HB2  ALA 116           HB2      ALA 116   1.221  -3.842  -1.691
  860    HB3  ALA 116           HB3      ALA 116   1.227  -4.939  -3.073
  861    H    ASP 117           HN       ASP 117  -1.720  -6.146  -3.647
  862    HA   ASP 117           HA       ASP 117  -1.945  -8.850  -3.038
  863    HB2  ASP 117           HB2      ASP 117  -3.007  -7.587  -5.010
  864    HB3  ASP 117           HB1      ASP 117  -1.483  -7.876  -5.825
  865    H    SER 118           HN       SER 118  -0.709 -10.666  -3.633
  866    HA   SER 118           HA       SER 118   2.031 -10.435  -3.188
  867    HB2  SER 118           HB2      SER 118   0.443 -12.484  -3.005
  868    HB3  SER 118           HB1      SER 118   0.851 -12.746  -4.702
  869    HG   SER 118           HG       SER 118   2.194 -13.818  -3.025
  870    H    LYS 119           HN       LYS 119   0.174 -10.322  -6.113
  871    HA   LYS 119           HA       LYS 119   2.128 -10.661  -8.051
  872    HB2  LYS 119           HB2      LYS 119   0.702  -9.159  -9.435
  873    HB3  LYS 119           HB1      LYS 119  -0.193 -10.457  -8.645
  874    HG2  LYS 119           HG2      LYS 119  -0.985  -8.915  -6.977
  875    HG3  LYS 119           HG1      LYS 119   0.029  -7.632  -7.639
  876    HD2  LYS 119           HD2      LYS 119  -2.127  -7.209  -8.448
  877    HD3  LYS 119           HD1      LYS 119  -1.269  -7.940  -9.803
  878    HE2  LYS 119           HE2      LYS 119  -2.295 -10.117  -9.187
  879    HE3  LYS 119           HE1      LYS 119  -3.227  -9.277  -7.945
  880    HZ1  LYS 119           HZ1      LYS 119  -4.658  -9.347  -9.765
  881    HZ2  LYS 119           HZ2      LYS 119  -3.426  -9.021 -10.880
  882    HZ3  LYS 119           HZ3      LYS 119  -3.993  -7.792  -9.863
  883    H    TYR 120           HN       TYR 120   1.511  -7.851  -5.953
  884    HA   TYR 120           HA       TYR 120   3.757  -6.460  -7.244
  885    HB2  TYR 120           HB2      TYR 120   1.764  -5.437  -5.194
  886    HB3  TYR 120           HB1      TYR 120   3.068  -4.487  -5.908
  887    HD1  TYR 120           HD1      TYR 120   3.002  -3.959  -8.328
  888    HD2  TYR 120           HD2      TYR 120  -0.243  -5.823  -6.321
  889    HE1  TYR 120           HE1      TYR 120   1.514  -3.416 -10.224
  890    HE2  TYR 120           HE2      TYR 120  -1.730  -5.288  -8.184
  891    HH   TYR 120           HH       TYR 120  -0.616  -4.320 -11.197
  892    H    CYS 121           HN       CYS 121   3.522  -8.777  -5.213
  893    HA   CYS 121           HA       CYS 121   5.674  -7.776  -3.484
  894    HB2  CYS 121           HB2      CYS 121   3.448  -9.673  -2.733
  895    HB3  CYS 121           HB1      CYS 121   4.839  -9.310  -1.710
  896    HG   CYS 121           HG       CYS 121   3.033  -6.670  -2.782
  897    H    TYR 122           HN       TYR 122   4.500 -11.116  -3.420
  898    HA   TYR 122           HA       TYR 122   6.700 -11.894  -5.202
  899    HB2  TYR 122           HB2      TYR 122   6.331 -13.356  -2.591
  900    HB3  TYR 122           HB1      TYR 122   7.673 -13.424  -3.712
  901    HD1  TYR 122           HD1      TYR 122   6.144 -11.518  -0.995
  902    HD2  TYR 122           HD2      TYR 122   9.414 -11.731  -3.705
  903    HE1  TYR 122           HE1      TYR 122   7.345  -9.833   0.327
  904    HE2  TYR 122           HE2      TYR 122  10.619 -10.055  -2.390
  905    HH   TYR 122           HH       TYR 122  10.159  -8.262  -0.801
  906    H    GLY 123           HN       GLY 123   3.871 -11.968  -5.778
  907    HA2  GLY 123           HA2      GLY 123   2.601 -14.384  -5.363
  908    HA3  GLY 123           HA1      GLY 123   2.428 -13.425  -6.822
  909    HA   PRO 124           HA       PRO 124   4.521 -16.758  -8.925
  910    HB2  PRO 124           HB2      PRO 124   5.379 -14.988 -11.037
  911    HB3  PRO 124           HB1      PRO 124   4.054 -16.153 -11.062
  912    HG2  PRO 124           HG2      PRO 124   3.701 -13.437 -11.154
  913    HG3  PRO 124           HG1      PRO 124   2.490 -14.571 -10.527
  914    HD2  PRO 124           HD2      PRO 124   4.439 -12.856  -9.035
  915    HD3  PRO 124           HD1      PRO 124   2.740 -13.225  -8.661
  916    H    GLN 125           HN       GLN 125   5.998 -14.483  -7.258
  917    HA   GLN 125           HA       GLN 125   8.656 -14.744  -8.481
  918    HB2  GLN 125           HB2      GLN 125   7.741 -12.779  -6.375
  919    HB3  GLN 125           HB1      GLN 125   9.229 -12.720  -7.314
  920    HG2  GLN 125           HG2      GLN 125   8.054 -12.222  -9.310
  921    HG3  GLN 125           HG1      GLN 125   6.501 -12.560  -8.555
  922   HE21  GLN 125          HE21      GLN 125   5.574 -11.047  -7.227
  923   HE22  GLN 125          HE22      GLN 125   6.143  -9.425  -7.096
  924    H    GLY 126           HN       GLY 126   6.920 -14.856  -5.429
  925    HA2  GLY 126           HA2      GLY 126   7.293 -16.049  -3.530
  926    HA3  GLY 126           HA1      GLY 126   8.632 -16.861  -4.329
  927    H    SER 127           HN       SER 127   8.307 -15.663  -1.664
  928    HA   SER 127           HA       SER 127  10.085 -13.414  -1.720
  929    HB2  SER 127           HB2      SER 127   8.266 -13.039  -0.278
  930    HB3  SER 127           HB1      SER 127   8.355 -14.652   0.397
  931    HG   SER 127           HG       SER 127   9.795 -13.967   1.800
  932    H    ARG 128           HN       ARG 128  11.919 -13.248  -0.253
  933    HA   ARG 128           HA       ARG 128  13.795 -15.229  -0.793
  934    HB2  ARG 128           HB2      ARG 128  15.202 -14.024   0.955
  935    HB3  ARG 128           HB1      ARG 128  14.636 -13.076  -0.412
  936    HG2  ARG 128           HG2      ARG 128  12.867 -12.122   0.953
  937    HG3  ARG 128           HG1      ARG 128  13.383 -13.102   2.330
  938    HD2  ARG 128           HD2      ARG 128  15.391 -11.920   2.555
  939    HD3  ARG 128           HD1      ARG 128  15.268 -11.233   0.936
  940    HE   ARG 128           HE       ARG 128  13.097 -10.371   2.531
  941   HH11  ARG 128          HH11      ARG 128  16.554  -9.914   2.197
  942   HH12  ARG 128          HH12      ARG 128  16.516  -8.245   2.692
  943   HH21  ARG 128          HH21      ARG 128  13.034  -8.174   3.197
  944   HH22  ARG 128          HH22      ARG 128  14.503  -7.261   3.264
  945    H    SER 129           HN       SER 129  12.021 -14.642   2.249
  946    HA   SER 129           HA       SER 129  13.208 -16.978   3.404
  947    HB2  SER 129           HB2      SER 129  11.109 -16.345   5.063
  948    HB3  SER 129           HB1      SER 129  12.745 -15.703   5.195
  949    HG   SER 129           HG       SER 129  10.886 -14.157   5.073
  950    HA   PRO 130           HA       PRO 130   9.293 -19.152   2.044
  951    HB2  PRO 130           HB2      PRO 130   6.858 -17.863   2.307
  952    HB3  PRO 130           HB1      PRO 130   7.650 -18.743   3.607
  953    HG2  PRO 130           HG2      PRO 130   7.143 -15.960   3.499
  954    HG3  PRO 130           HG1      PRO 130   8.121 -16.815   4.702
  955    HD2  PRO 130           HD2      PRO 130   8.990 -15.379   2.226
  956    HD3  PRO 130           HD1      PRO 130   9.792 -15.487   3.804
  957    H    TYR 131           HN       TYR 131   9.196 -19.414  -0.218
  958    HA   TYR 131           HA       TYR 131   8.453 -17.518  -2.081
  959    HB2  TYR 131           HB2      TYR 131   9.188 -19.753  -2.751
  960    HB3  TYR 131           HB1      TYR 131   7.742 -20.468  -2.047
  961    HD1  TYR 131           HD1      TYR 131   5.510 -20.008  -3.109
  962    HD2  TYR 131           HD2      TYR 131   9.165 -18.846  -4.945
  963    HE1  TYR 131           HE1      TYR 131   4.337 -19.729  -5.250
  964    HE2  TYR 131           HE2      TYR 131   8.002 -18.564  -7.092
  965    HH   TYR 131           HH       TYR 131   4.677 -18.372  -7.360
  966    H    ILE 132           HN       ILE 132   6.867 -16.124  -1.527
  967    HA   ILE 132           HA       ILE 132   4.569 -16.808  -0.070
  968    HB   ILE 132           HB       ILE 132   4.945 -14.424  -1.887
  969   HG12  ILE 132          HG12      ILE 132   6.728 -14.317  -0.339
  970   HG13  ILE 132          HG11      ILE 132   5.488 -13.200   0.235
  971   HG21  ILE 132          HG21      ILE 132   3.109 -14.878   0.444
  972   HG22  ILE 132          HG22      ILE 132   2.639 -14.814  -1.256
  973   HG23  ILE 132          HG23      ILE 132   3.265 -13.369  -0.458
  974   HD11  ILE 132          HD11      ILE 132   6.534 -14.472   2.017
  975   HD12  ILE 132          HD12      ILE 132   5.946 -15.971   1.290
  976   HD13  ILE 132          HD13      ILE 132   4.798 -14.777   1.906
  977    HA   PRO 133           HA       PRO 133   2.007 -18.772  -3.170
  978    HB2  PRO 133           HB2      PRO 133  -0.368 -17.811  -2.005
  979    HB3  PRO 133           HB1      PRO 133   0.396 -19.371  -1.692
  980    HG2  PRO 133           HG2      PRO 133   0.531 -16.840  -0.132
  981    HG3  PRO 133           HG1      PRO 133   0.552 -18.516   0.442
  982    HD2  PRO 133           HD2      PRO 133   2.780 -17.039   0.389
  983    HD3  PRO 133           HD1      PRO 133   2.815 -18.771  -0.012
  984    HA   PRO 134           HA       PRO 134   1.423 -15.351  -5.897
  985    HB2  PRO 134           HB2      PRO 134  -0.160 -16.558  -7.754
  986    HB3  PRO 134           HB1      PRO 134   1.593 -16.789  -7.658
  987    HG2  PRO 134           HG2      PRO 134  -0.600 -18.546  -6.615
  988    HG3  PRO 134           HG1      PRO 134   0.896 -19.001  -7.453
  989    HD2  PRO 134           HD2      PRO 134   0.648 -19.200  -4.773
  990    HD3  PRO 134           HD1      PRO 134   2.190 -18.764  -5.542
  991    H    HIS 135           HN       HIS 135   0.075 -13.720  -5.946
  992    HA   HIS 135           HA       HIS 135  -1.779 -12.427  -5.831
  993    HB2  HIS 135           HB2      HIS 135  -3.220 -15.066  -6.085
  994    HB3  HIS 135           HB1      HIS 135  -4.069 -13.536  -5.911
  995    HD1  HIS 135           HD1      HIS 135  -4.549 -12.289  -8.011
  996    HD2  HIS 135           HD2      HIS 135  -1.614 -15.197  -8.537
  997    HE1  HIS 135           HE1      HIS 135  -4.113 -12.382 -10.489
  998    HE2  HIS 135           HE2      HIS 135  -2.464 -14.261 -10.786
  999    H    ALA 136           HN       ALA 136  -0.691 -14.280  -3.418
 1000    HA   ALA 136           HA       ALA 136  -2.813 -14.001  -1.515
 1001    HB1  ALA 136           HB1      ALA 136  -1.099 -15.701  -1.211
 1002    HB2  ALA 136           HB2      ALA 136  -1.114 -14.586   0.153
 1003    HB3  ALA 136           HB3      ALA 136   0.140 -14.452  -1.079
 1004    H    ALA 137           HN       ALA 137  -3.357 -12.240  -0.360
 1005    HA   ALA 137           HA       ALA 137  -2.086  -9.778  -1.104
 1006    HB1  ALA 137           HB1      ALA 137  -4.278 -10.252   0.921
 1007    HB2  ALA 137           HB2      ALA 137  -4.510  -9.877  -0.785
 1008    HB3  ALA 137           HB3      ALA 137  -3.770  -8.689   0.286
 1009    H    LEU 138           HN       LEU 138  -0.298  -9.083  -0.246
 1010    HA   LEU 138           HA       LEU 138   0.617 -10.079   2.309
 1011    HB2  LEU 138           HB2      LEU 138   1.810  -9.181  -0.101
 1012    HB3  LEU 138           HB1      LEU 138   2.377  -8.149   1.203
 1013    HG   LEU 138           HG       LEU 138   3.151 -10.068   2.440
 1014   HD11  LEU 138          HD11      LEU 138   2.117 -11.684   0.129
 1015   HD12  LEU 138          HD12      LEU 138   1.441 -11.638   1.757
 1016   HD13  LEU 138          HD13      LEU 138   3.052 -12.307   1.489
 1017   HD21  LEU 138          HD21      LEU 138   4.062 -10.160  -0.428
 1018   HD22  LEU 138          HD22      LEU 138   4.938 -10.815   0.956
 1019   HD23  LEU 138          HD23      LEU 138   4.679  -9.076   0.818
 1020    H    CYS 139           HN       CYS 139   0.686  -8.929   4.169
 1021    HA   CYS 139           HA       CYS 139  -0.009  -6.081   3.955
 1022    HB2  CYS 139           HB2      CYS 139  -1.176  -6.248   6.086
 1023    HB3  CYS 139           HB1      CYS 139  -1.799  -7.415   4.937
 1024    HG   CYS 139           HG       CYS 139  -1.496  -9.501   6.334
 1025    H    LEU 140           HN       LEU 140   1.825  -5.060   4.087
 1026    HA   LEU 140           HA       LEU 140   3.814  -5.942   6.068
 1027    HB2  LEU 140           HB2      LEU 140   5.478  -4.848   4.549
 1028    HB3  LEU 140           HB1      LEU 140   4.730  -6.303   3.923
 1029    HG   LEU 140           HG       LEU 140   3.400  -3.785   3.148
 1030   HD11  LEU 140          HD11      LEU 140   6.138  -4.492   2.088
 1031   HD12  LEU 140          HD12      LEU 140   5.764  -3.106   3.115
 1032   HD13  LEU 140          HD13      LEU 140   5.087  -3.208   1.487
 1033   HD21  LEU 140          HD21      LEU 140   3.328  -4.914   0.982
 1034   HD22  LEU 140          HD22      LEU 140   2.741  -5.970   2.267
 1035   HD23  LEU 140          HD23      LEU 140   4.361  -6.198   1.612
 1036    H    GLU 141           HN       GLU 141   4.684  -4.489   7.450
 1037    HA   GLU 141           HA       GLU 141   3.681  -1.728   7.269
 1038    HB2  GLU 141           HB2      GLU 141   3.140  -2.842   9.363
 1039    HB3  GLU 141           HB1      GLU 141   4.822  -3.297   9.595
 1040    HG2  GLU 141           HG2      GLU 141   5.336  -0.819   9.660
 1041    HG3  GLU 141           HG1      GLU 141   3.592  -0.571   9.765
 1042    H    VAL 142           HN       VAL 142   5.081  -0.347   6.395
 1043    HA   VAL 142           HA       VAL 142   7.933  -1.030   6.508
 1044    HB   VAL 142           HB       VAL 142   8.055   0.513   4.440
 1045   HG11  VAL 142          HG11      VAL 142   8.491  -1.862   4.350
 1046   HG12  VAL 142          HG12      VAL 142   7.505  -1.392   2.964
 1047   HG13  VAL 142          HG13      VAL 142   6.763  -2.209   4.340
 1048   HG21  VAL 142          HG21      VAL 142   5.124  -0.207   4.421
 1049   HG22  VAL 142          HG22      VAL 142   6.013   0.497   3.069
 1050   HG23  VAL 142          HG23      VAL 142   5.800   1.414   4.562
 1051    H    THR 143           HN       THR 143   9.098   0.179   7.762
 1052    HA   THR 143           HA       THR 143   8.368   2.948   8.352
 1053    HB   THR 143           HB       THR 143  10.773   1.452   9.412
 1054    HG1  THR 143           HG1      THR 143   8.055   1.159  10.022
 1055   HG21  THR 143          HG21      THR 143  10.517   3.006  11.299
 1056   HG22  THR 143          HG22      THR 143   9.111   3.732  10.520
 1057   HG23  THR 143          HG23      THR 143  10.705   3.880   9.778
 1058    H    LEU 144           HN       LEU 144   9.053   4.395   6.882
 1059    HA   LEU 144           HA       LEU 144  11.565   4.011   5.466
 1060    HB2  LEU 144           HB2      LEU 144   9.644   5.002   4.309
 1061    HB3  LEU 144           HB1      LEU 144   9.592   6.306   5.481
 1062    HG   LEU 144           HG       LEU 144  11.802   7.080   4.701
 1063   HD11  LEU 144          HD11      LEU 144  12.699   4.953   3.945
 1064   HD12  LEU 144          HD12      LEU 144  12.754   6.151   2.650
 1065   HD13  LEU 144          HD13      LEU 144  11.512   4.898   2.642
 1066   HD21  LEU 144          HD21      LEU 144   9.805   8.049   3.745
 1067   HD22  LEU 144          HD22      LEU 144   9.712   6.753   2.554
 1068   HD23  LEU 144          HD23      LEU 144  11.050   7.900   2.508
 1069    H    LYS 145           HN       LYS 145  13.256   4.186   6.720
 1070    HA   LYS 145           HA       LYS 145  13.184   6.116   8.914
 1071    HB2  LYS 145           HB2      LYS 145  15.256   3.973   8.496
 1072    HB3  LYS 145           HB1      LYS 145  14.809   4.787   9.987
 1073    HG2  LYS 145           HG2      LYS 145  12.681   3.669  10.023
 1074    HG3  LYS 145           HG1      LYS 145  13.020   2.913   8.466
 1075    HD2  LYS 145           HD2      LYS 145  14.587   2.490  11.010
 1076    HD3  LYS 145           HD1      LYS 145  13.401   1.364  10.329
 1077    HE2  LYS 145           HE2      LYS 145  14.745   0.919   8.459
 1078    HE3  LYS 145           HE1      LYS 145  15.810   2.293   8.776
 1079    HZ1  LYS 145           HZ1      LYS 145  16.998   0.443   9.490
 1080    HZ2  LYS 145           HZ2      LYS 145  15.659  -0.289  10.218
 1081    HZ3  LYS 145           HZ3      LYS 145  16.367   1.080  10.928
 1082    H    THR 146           HN       THR 146  14.819   5.465   5.917
 1083    HA   THR 146           HA       THR 146  16.280   7.935   6.193
 1084    HB   THR 146           HB       THR 146  17.789   5.371   5.682
 1085    HG1  THR 146           HG1      THR 146  17.080   6.631   8.016
 1086   HG21  THR 146          HG21      THR 146  19.793   6.769   5.953
 1087   HG22  THR 146          HG22      THR 146  18.771   8.192   6.160
 1088   HG23  THR 146          HG23      THR 146  18.790   7.337   4.618
 1089    H    ALA 147           HN       ALA 147  16.984   8.808   4.255
 1090    HA   ALA 147           HA       ALA 147  16.787   7.221   1.815
 1091    HB1  ALA 147           HB1      ALA 147  14.626   8.376   1.993
 1092    HB2  ALA 147           HB2      ALA 147  15.573   9.008   0.646
 1093    HB3  ALA 147           HB3      ALA 147  15.463   9.919   2.152
 1094    H    VAL 148           HN       VAL 148  18.564   7.573   0.551
 1095    HA   VAL 148           HA       VAL 148  20.075  10.058   1.057
 1096    HB   VAL 148           HB       VAL 148  22.182   8.899   0.904
 1097   HG11  VAL 148          HG11      VAL 148  21.212   8.988   3.106
 1098   HG12  VAL 148          HG12      VAL 148  22.050   7.448   2.903
 1099   HG13  VAL 148          HG13      VAL 148  20.289   7.517   2.797
 1100   HG21  VAL 148          HG21      VAL 148  21.599   7.173  -0.710
 1101   HG22  VAL 148          HG22      VAL 148  20.589   6.370   0.493
 1102   HG23  VAL 148          HG23      VAL 148  22.335   6.457   0.724
 1103    H    ASP 149           HN       ASP 149  20.913  11.080  -0.719
 1104    HA   ASP 149           HA       ASP 149  19.833  10.165  -3.252
 1105    HB2  ASP 149           HB2      ASP 149  19.482  12.478  -2.861
 1106    HB3  ASP 149           HB1      ASP 149  21.167  12.739  -2.397
 1107    H    LEU 150           HN       LEU 150  20.977   9.040  -4.679
 1108    HA   LEU 150           HA       LEU 150  23.863   9.349  -4.851
 1109    HB2  LEU 150           HB2      LEU 150  23.217   7.561  -3.104
 1110    HB3  LEU 150           HB1      LEU 150  22.700   6.600  -4.473
 1111    HG   LEU 150           HG       LEU 150  25.009   6.739  -5.390
 1112   HD11  LEU 150          HD11      LEU 150  25.616   8.004  -2.720
 1113   HD12  LEU 150          HD12      LEU 150  25.670   8.814  -4.285
 1114   HD13  LEU 150          HD13      LEU 150  26.803   7.511  -3.927
 1115   HD21  LEU 150          HD21      LEU 150  25.989   5.171  -3.773
 1116   HD22  LEU 150          HD22      LEU 150  24.305   4.793  -4.133
 1117   HD23  LEU 150          HD23      LEU 150  24.723   5.591  -2.617
 1118    H    GLU 151           HN       GLU 151  21.211   9.562  -6.439
 1119    HA   GLU 151           HA       GLU 151  22.124   8.086  -8.805
 1120    HB2  GLU 151           HB2      GLU 151  20.284   6.850  -7.758
 1121    HB3  GLU 151           HB1      GLU 151  19.286   8.292  -7.781
 1122    HG2  GLU 151           HG2      GLU 151  18.631   6.786  -9.547
 1123    HG3  GLU 151           HG1      GLU 151  19.313   8.277 -10.216
 1124    H    HIS 152           HN       HIS 152  21.718   9.114 -10.779
 1125    HA   HIS 152           HA       HIS 152  21.401  11.961 -10.606
 1126    HB2  HIS 152           HB2      HIS 152  21.891  12.027 -12.955
 1127    HB3  HIS 152           HB1      HIS 152  22.974  10.865 -12.211
 1128    HD1  HIS 152           HD1      HIS 152  21.852   8.225 -12.441
 1129    HD2  HIS 152           HD2      HIS 152  20.937  11.128 -15.287
 1130    HE1  HIS 152           HE1      HIS 152  21.089   6.966 -14.479
 1131    HE2  HIS 152           HE2      HIS 152  20.433   8.738 -16.150
 1132    H    HIS 153           HN       HIS 153  19.448  12.814 -10.286
 1133    HA   HIS 153           HA       HIS 153  17.115  11.517 -11.454
 1134    HB2  HIS 153           HB2      HIS 153  16.955  12.307  -9.125
 1135    HB3  HIS 153           HB1      HIS 153  17.261  13.956  -9.664
 1136    HD1  HIS 153           HD1      HIS 153  15.157  15.250  -9.658
 1137    HD2  HIS 153           HD2      HIS 153  14.536  11.305 -10.832
 1138    HE1  HIS 153           HE1      HIS 153  12.697  15.071 -10.176
 1139    HE2  HIS 153           HE2      HIS 153  12.388  12.732 -11.082
 1140    H    HIS 154           HN       HIS 154  18.310  14.890 -11.346
 1141    HA   HIS 154           HA       HIS 154  17.931  15.087 -14.204
 1142    HB2  HIS 154           HB2      HIS 154  15.676  15.612 -13.124
 1143    HB3  HIS 154           HB1      HIS 154  16.443  17.053 -12.461
 1144    HD1  HIS 154           HD1      HIS 154  16.296  19.080 -13.890
 1145    HD2  HIS 154           HD2      HIS 154  15.883  15.576 -16.094
 1146    HE1  HIS 154           HE1      HIS 154  15.805  19.804 -16.242
 1147    HE2  HIS 154           HE2      HIS 154  15.402  17.671 -17.525
 1148    H    HIS 155           HN       HIS 155  19.737  15.991 -14.866
 1149    HA   HIS 155           HA       HIS 155  21.182  17.853 -13.153
 1150    HB2  HIS 155           HB2      HIS 155  22.476  16.094 -14.240
 1151    HB3  HIS 155           HB1      HIS 155  21.882  16.589 -15.820
 1152    HD1  HIS 155           HD1      HIS 155  24.259  17.667 -13.093
 1153    HD2  HIS 155           HD2      HIS 155  23.245  18.688 -17.000
 1154    HE1  HIS 155           HE1      HIS 155  26.045  19.265 -13.872
 1155    HE2  HIS 155           HE2      HIS 155  25.481  19.763 -16.280
 1156    H    HIS 156           HN       HIS 156  20.374  19.868 -13.213
 1157    HA   HIS 156           HA       HIS 156  19.256  21.030 -15.588
 1158    HB2  HIS 156           HB2      HIS 156  18.394  21.771 -13.472
 1159    HB3  HIS 156           HB1      HIS 156  20.002  22.194 -12.896
 1160    HD1  HIS 156           HD1      HIS 156  17.260  23.414 -15.163
 1161    HD2  HIS 156           HD2      HIS 156  20.944  24.686 -13.704
 1162    HE1  HIS 156           HE1      HIS 156  17.455  25.835 -15.817
 1163    HE2  HIS 156           HE2      HIS 156  19.804  26.477 -15.176
 1164    H    HIS 157           HN       HIS 157  20.131  22.563 -16.939
 1165    HA   HIS 157           HA       HIS 157  22.857  23.472 -16.420
 1166    HB2  HIS 157           HB2      HIS 157  22.927  21.506 -17.981
 1167    HB3  HIS 157           HB1      HIS 157  21.952  22.433 -19.117
 1168    HD1  HIS 157           HD1      HIS 157  23.370  23.391 -20.909
 1169    HD2  HIS 157           HD2      HIS 157  25.356  23.255 -17.258
 1170    HE1  HIS 157           HE1      HIS 157  25.638  24.382 -21.337
 1171    HE2  HIS 157           HE2      HIS 157  26.878  24.161 -19.143
  Start of MODEL    6
    1    H1   MET   1           HT1      MET   1 -65.766 -23.356 -37.031
    2    H2   MET   1           HT2      MET   1 -64.576 -22.790 -38.091
    3    H3   MET   1           HT3      MET   1 -66.205 -22.416 -38.378
    4    HA   MET   1           HA       MET   1 -65.209 -20.489 -37.489
    5    HB2  MET   1           HB2      MET   1 -66.661 -21.919 -35.247
    6    HB3  MET   1           HB1      MET   1 -66.449 -20.180 -35.401
    7    HG2  MET   1           HG2      MET   1 -68.018 -21.946 -37.266
    8    HG3  MET   1           HG1      MET   1 -68.690 -20.877 -36.037
    9    HE1  MET   1           HE1      MET   1 -69.653 -20.835 -39.027
   10    HE2  MET   1           HE2      MET   1 -69.689 -19.107 -39.388
   11    HE3  MET   1           HE3      MET   1 -70.271 -19.695 -37.831
   12    H    GLY   2           HN       GLY   2 -63.056 -20.286 -37.200
   13    HA2  GLY   2           HA2      GLY   2 -61.895 -21.566 -34.797
   14    HA3  GLY   2           HA1      GLY   2 -61.006 -21.315 -36.291
   15    H    GLN   3           HN       GLN   3 -59.398 -20.225 -35.069
   16    HA   GLN   3           HA       GLN   3 -60.134 -17.471 -34.328
   17    HB2  GLN   3           HB2      GLN   3 -59.556 -18.736 -32.328
   18    HB3  GLN   3           HB1      GLN   3 -58.064 -19.291 -33.068
   19    HG2  GLN   3           HG2      GLN   3 -57.543 -17.579 -31.499
   20    HG3  GLN   3           HG1      GLN   3 -57.279 -16.941 -33.118
   21   HE21  GLN   3          HE21      GLN   3 -57.434 -14.836 -32.393
   22   HE22  GLN   3          HE22      GLN   3 -58.946 -14.116 -31.950
   23    HA   PRO   4           HA       PRO   4 -57.415 -17.134 -37.977
   24    HB2  PRO   4           HB2      PRO   4 -58.405 -14.346 -37.803
   25    HB3  PRO   4           HB1      PRO   4 -58.346 -15.441 -39.189
   26    HG2  PRO   4           HG2      PRO   4 -60.656 -14.901 -37.960
   27    HG3  PRO   4           HG1      PRO   4 -60.307 -16.524 -38.582
   28    HD2  PRO   4           HD2      PRO   4 -60.213 -15.508 -35.768
   29    HD3  PRO   4           HD1      PRO   4 -60.773 -17.078 -36.382
   30    HA   PRO   5           HA       PRO   5 -54.664 -13.836 -36.041
   31    HB2  PRO   5           HB2      PRO   5 -55.472 -12.104 -34.170
   32    HB3  PRO   5           HB1      PRO   5 -55.901 -11.891 -35.869
   33    HG2  PRO   5           HG2      PRO   5 -57.555 -12.883 -33.606
   34    HG3  PRO   5           HG1      PRO   5 -58.031 -11.894 -34.999
   35    HD2  PRO   5           HD2      PRO   5 -58.403 -14.663 -34.729
   36    HD3  PRO   5           HD1      PRO   5 -58.525 -13.737 -36.235
   37    H    ALA   6           HN       ALA   6 -53.061 -14.506 -34.777
   38    HA   ALA   6           HA       ALA   6 -53.721 -15.703 -32.160
   39    HB1  ALA   6           HB1      ALA   6 -52.722 -17.292 -33.724
   40    HB2  ALA   6           HB2      ALA   6 -51.625 -16.967 -32.381
   41    HB3  ALA   6           HB3      ALA   6 -51.343 -16.217 -33.952
   42    H    GLU   7           HN       GLU   7 -52.837 -12.922 -33.379
   43    HA   GLU   7           HA       GLU   7 -50.506 -12.323 -31.775
   44    HB2  GLU   7           HB2      GLU   7 -52.235 -10.393 -33.330
   45    HB3  GLU   7           HB1      GLU   7 -50.584 -10.140 -32.792
   46    HG2  GLU   7           HG2      GLU   7 -50.359 -10.552 -35.055
   47    HG3  GLU   7           HG1      GLU   7 -50.002 -12.120 -34.332
   48    H    GLU   8           HN       GLU   8 -52.190 -13.151 -29.997
   49    HA   GLU   8           HA       GLU   8 -54.130 -11.242 -29.113
   50    HB2  GLU   8           HB2      GLU   8 -53.050 -13.738 -27.806
   51    HB3  GLU   8           HB1      GLU   8 -54.423 -12.810 -27.215
   52    HG2  GLU   8           HG2      GLU   8 -54.296 -14.086 -29.937
   53    HG3  GLU   8           HG1      GLU   8 -55.020 -14.846 -28.520
   54    H    ALA   9           HN       ALA   9 -50.829 -11.293 -28.802
   55    HA   ALA   9           HA       ALA   9 -50.831  -9.230 -26.829
   56    HB1  ALA   9           HB1      ALA   9 -49.489 -11.813 -26.035
   57    HB2  ALA   9           HB2      ALA   9 -51.024 -11.240 -25.381
   58    HB3  ALA   9           HB3      ALA   9 -49.546 -10.317 -25.103
   59    H    GLU  10           HN       GLU  10 -48.792 -11.708 -28.330
   60    HA   GLU  10           HA       GLU  10 -46.941 -11.612 -29.623
   61    HB2  GLU  10           HB2      GLU  10 -47.897  -9.644 -30.738
   62    HB3  GLU  10           HB1      GLU  10 -47.264  -8.604 -29.469
   63    HG2  GLU  10           HG2      GLU  10 -44.992  -9.197 -30.108
   64    HG3  GLU  10           HG1      GLU  10 -45.617 -10.255 -31.370
   65    H    GLN  11           HN       GLN  11 -46.831  -8.986 -27.249
   66    HA   GLN  11           HA       GLN  11 -44.610 -10.341 -25.920
   67    HB2  GLN  11           HB2      GLN  11 -43.599  -7.986 -25.589
   68    HB3  GLN  11           HB1      GLN  11 -43.379  -8.771 -27.149
   69    HG2  GLN  11           HG2      GLN  11 -45.375  -7.497 -27.966
   70    HG3  GLN  11           HG1      GLN  11 -45.315  -6.585 -26.455
   71   HE21  GLN  11          HE21      GLN  11 -44.862  -4.638 -27.461
   72   HE22  GLN  11          HE22      GLN  11 -43.329  -4.306 -28.208
   73    HA   PRO  12           HA       PRO  12 -47.800  -9.242 -22.909
   74    HB2  PRO  12           HB2      PRO  12 -46.957 -11.558 -21.424
   75    HB3  PRO  12           HB1      PRO  12 -48.448 -11.323 -22.335
   76    HG2  PRO  12           HG2      PRO  12 -46.476 -13.087 -23.052
   77    HG3  PRO  12           HG1      PRO  12 -47.610 -12.358 -24.205
   78    HD2  PRO  12           HD2      PRO  12 -44.784 -11.585 -23.564
   79    HD3  PRO  12           HD1      PRO  12 -45.599 -11.675 -25.142
   80    H    GLY  13           HN       GLY  13 -47.752  -9.207 -20.440
   81    HA2  GLY  13           HA2      GLY  13 -45.893  -9.255 -18.615
   82    HA3  GLY  13           HA1      GLY  13 -45.250  -7.949 -19.605
   83    H    ALA  14           HN       ALA  14 -45.629  -7.038 -17.267
   84    HA   ALA  14           HA       ALA  14 -48.336  -5.874 -17.172
   85    HB1  ALA  14           HB1      ALA  14 -47.685  -7.028 -15.133
   86    HB2  ALA  14           HB2      ALA  14 -47.793  -5.292 -14.829
   87    HB3  ALA  14           HB3      ALA  14 -46.216  -6.061 -15.029
   88    H    LEU  15           HN       LEU  15 -45.342  -5.247 -18.313
   89    HA   LEU  15           HA       LEU  15 -44.154  -3.424 -18.926
   90    HB2  LEU  15           HB2      LEU  15 -46.823  -2.048 -18.596
   91    HB3  LEU  15           HB1      LEU  15 -45.407  -1.314 -19.329
   92    HG   LEU  15           HG       LEU  15 -46.843  -3.754 -20.381
   93   HD11  LEU  15          HD11      LEU  15 -48.184  -1.742 -20.613
   94   HD12  LEU  15          HD12      LEU  15 -47.568  -2.263 -22.181
   95   HD13  LEU  15          HD13      LEU  15 -46.820  -0.900 -21.349
   96   HD21  LEU  15          HD21      LEU  15 -45.423  -3.407 -22.369
   97   HD22  LEU  15          HD22      LEU  15 -44.483  -3.800 -20.930
   98   HD23  LEU  15          HD23      LEU  15 -44.558  -2.135 -21.505
   99    H    ALA  16           HN       ALA  16 -43.070  -3.776 -16.879
  100    HA   ALA  16           HA       ALA  16 -43.660  -1.748 -14.836
  101    HB1  ALA  16           HB1      ALA  16 -42.248  -3.095 -13.351
  102    HB2  ALA  16           HB2      ALA  16 -41.927  -4.217 -14.674
  103    HB3  ALA  16           HB3      ALA  16 -43.562  -4.057 -14.032
  104    H    ARG  17           HN       ARG  17 -41.153  -2.986 -16.956
  105    HA   ARG  17           HA       ARG  17 -39.129  -2.214 -17.605
  106    HB2  ARG  17           HB2      ARG  17 -40.562   0.335 -16.962
  107    HB3  ARG  17           HB1      ARG  17 -38.853   0.380 -17.366
  108    HG2  ARG  17           HG2      ARG  17 -40.996  -0.815 -19.113
  109    HG3  ARG  17           HG1      ARG  17 -40.321   0.808 -19.292
  110    HD2  ARG  17           HD2      ARG  17 -38.089  -0.166 -19.599
  111    HD3  ARG  17           HD1      ARG  17 -38.777  -1.781 -19.455
  112    HE   ARG  17           HE       ARG  17 -40.164  -0.624 -21.512
  113   HH11  ARG  17          HH11      ARG  17 -36.765  -1.036 -20.806
  114   HH12  ARG  17          HH12      ARG  17 -36.303  -1.299 -22.462
  115   HH21  ARG  17          HH21      ARG  17 -39.581  -0.937 -23.716
  116   HH22  ARG  17          HH22      ARG  17 -37.914  -1.221 -24.131
  117    H    GLU  18           HN       GLU  18 -38.073  -3.382 -15.945
  118    HA   GLU  18           HA       GLU  18 -37.392  -2.075 -13.460
  119    HB2  GLU  18           HB2      GLU  18 -36.254  -4.597 -14.686
  120    HB3  GLU  18           HB1      GLU  18 -36.042  -4.070 -13.025
  121    HG2  GLU  18           HG2      GLU  18 -38.380  -4.395 -12.570
  122    HG3  GLU  18           HG1      GLU  18 -38.694  -4.774 -14.264
  123    H    PHE  19           HN       PHE  19 -36.633  -0.289 -15.185
  124    HA   PHE  19           HA       PHE  19 -34.119  -0.628 -16.425
  125    HB2  PHE  19           HB2      PHE  19 -34.165   1.741 -16.843
  126    HB3  PHE  19           HB1      PHE  19 -35.795   1.120 -17.044
  127    HD1  PHE  19           HD1      PHE  19 -37.437   1.444 -15.129
  128    HD2  PHE  19           HD2      PHE  19 -33.721   3.505 -15.393
  129    HE1  PHE  19           HE1      PHE  19 -38.273   3.139 -13.561
  130    HE2  PHE  19           HE2      PHE  19 -34.552   5.206 -13.817
  131    HZ   PHE  19           HZ       PHE  19 -36.826   5.023 -12.895
  132    H    LEU  20           HN       LEU  20 -35.074   0.589 -13.269
  133    HA   LEU  20           HA       LEU  20 -32.563   0.017 -12.097
  134    HB2  LEU  20           HB2      LEU  20 -31.998   2.077 -13.401
  135    HB3  LEU  20           HB1      LEU  20 -33.189   2.954 -12.464
  136    HG   LEU  20           HG       LEU  20 -31.893   2.581 -10.427
  137   HD11  LEU  20          HD11      LEU  20 -30.898   0.435 -10.963
  138   HD12  LEU  20          HD12      LEU  20 -29.635   1.602 -10.569
  139   HD13  LEU  20          HD13      LEU  20 -29.945   1.172 -12.251
  140   HD21  LEU  20          HD21      LEU  20 -30.021   4.042 -10.945
  141   HD22  LEU  20          HD22      LEU  20 -31.464   4.575 -11.805
  142   HD23  LEU  20          HD23      LEU  20 -30.202   3.698 -12.666
  143    H    ALA  21           HN       ALA  21 -35.089  -0.747 -11.466
  144    HA   ALA  21           HA       ALA  21 -36.313   0.880  -9.468
  145    HB1  ALA  21           HB1      ALA  21 -36.582  -2.093  -9.962
  146    HB2  ALA  21           HB2      ALA  21 -37.573  -0.835 -10.703
  147    HB3  ALA  21           HB3      ALA  21 -37.649  -1.112  -8.962
  148    H    ALA  22           HN       ALA  22 -34.343  -2.066  -9.330
  149    HA   ALA  22           HA       ALA  22 -32.780  -2.813  -7.886
  150    HB1  ALA  22           HB1      ALA  22 -31.726  -1.312  -6.293
  151    HB2  ALA  22           HB2      ALA  22 -33.010  -0.128  -6.542
  152    HB3  ALA  22           HB3      ALA  22 -31.913  -0.527  -7.862
  153    H    MET  23           HN       MET  23 -33.048  -4.287  -6.390
  154    HA   MET  23           HA       MET  23 -35.158  -3.926  -4.379
  155    HB2  MET  23           HB2      MET  23 -33.808  -6.355  -5.532
  156    HB3  MET  23           HB1      MET  23 -34.652  -6.443  -3.991
  157    HG2  MET  23           HG2      MET  23 -35.875  -5.568  -6.600
  158    HG3  MET  23           HG1      MET  23 -36.043  -7.167  -5.875
  159    HE1  MET  23           HE1      MET  23 -39.612  -5.707  -5.332
  160    HE2  MET  23           HE2      MET  23 -38.645  -7.004  -6.033
  161    HE3  MET  23           HE3      MET  23 -38.580  -5.382  -6.725
  162    H    GLU  24           HN       GLU  24 -32.282  -2.919  -4.495
  163    HA   GLU  24           HA       GLU  24 -31.263  -4.102  -2.036
  164    HB2  GLU  24           HB2      GLU  24 -29.814  -4.028  -4.122
  165    HB3  GLU  24           HB1      GLU  24 -29.784  -2.281  -3.935
  166    HG2  GLU  24           HG2      GLU  24 -28.661  -2.459  -1.836
  167    HG3  GLU  24           HG1      GLU  24 -28.851  -4.211  -1.831
  168    HA   PRO  25           HA       PRO  25 -32.769  -0.595   0.261
  169    HB2  PRO  25           HB2      PRO  25 -30.812  -0.917   2.241
  170    HB3  PRO  25           HB1      PRO  25 -32.404  -1.676   2.227
  171    HG2  PRO  25           HG2      PRO  25 -29.772  -2.783   1.368
  172    HG3  PRO  25           HG1      PRO  25 -31.111  -3.592   2.206
  173    HD2  PRO  25           HD2      PRO  25 -30.704  -3.997  -0.412
  174    HD3  PRO  25           HD1      PRO  25 -32.351  -3.830   0.236
  175    H    GLU  26           HN       GLU  26 -32.112   1.497   0.778
  176    HA   GLU  26           HA       GLU  26 -30.194   2.772  -0.750
  177    HB2  GLU  26           HB2      GLU  26 -31.333   3.573   1.932
  178    HB3  GLU  26           HB1      GLU  26 -30.337   4.632   0.943
  179    HG2  GLU  26           HG2      GLU  26 -32.998   3.468   0.159
  180    HG3  GLU  26           HG1      GLU  26 -32.708   5.116   0.713
  181    HA   PRO  27           HA       PRO  27 -26.387   1.599   1.051
  182    HB2  PRO  27           HB2      PRO  27 -25.214   4.110   0.130
  183    HB3  PRO  27           HB1      PRO  27 -24.905   2.462  -0.426
  184    HG2  PRO  27           HG2      PRO  27 -26.216   4.293  -1.936
  185    HG3  PRO  27           HG1      PRO  27 -26.550   2.554  -2.029
  186    HD2  PRO  27           HD2      PRO  27 -28.078   4.707  -0.623
  187    HD3  PRO  27           HD1      PRO  27 -28.680   3.311  -1.543
  188    H    ALA  28           HN       ALA  28 -27.202   1.902   3.206
  189    HA   ALA  28           HA       ALA  28 -26.879   4.288   4.672
  190    HB1  ALA  28           HB1      ALA  28 -26.736   1.427   5.650
  191    HB2  ALA  28           HB2      ALA  28 -28.205   2.390   5.500
  192    HB3  ALA  28           HB3      ALA  28 -26.963   2.853   6.664
  193    HA   PRO  29           HA       PRO  29 -22.523   4.862   4.488
  194    HB2  PRO  29           HB2      PRO  29 -22.917   5.825   7.285
  195    HB3  PRO  29           HB1      PRO  29 -22.061   6.591   5.940
  196    HG2  PRO  29           HG2      PRO  29 -24.477   7.431   6.656
  197    HG3  PRO  29           HG1      PRO  29 -24.020   7.335   4.946
  198    HD2  PRO  29           HD2      PRO  29 -25.810   5.557   6.532
  199    HD3  PRO  29           HD1      PRO  29 -25.889   6.004   4.815
  200    H    ALA  30           HN       ALA  30 -21.031   3.380   4.709
  201    HA   ALA  30           HA       ALA  30 -20.694   2.069   7.309
  202    HB1  ALA  30           HB1      ALA  30 -20.572   0.659   4.640
  203    HB2  ALA  30           HB2      ALA  30 -21.840   0.474   5.851
  204    HB3  ALA  30           HB3      ALA  30 -20.197  -0.060   6.208
  205    HA   PRO  31           HA       PRO  31 -16.799   4.128   5.854
  206    HB2  PRO  31           HB2      PRO  31 -16.051   4.717   8.443
  207    HB3  PRO  31           HB1      PRO  31 -16.970   5.808   7.399
  208    HG2  PRO  31           HG2      PRO  31 -17.943   3.956   9.540
  209    HG3  PRO  31           HG1      PRO  31 -18.466   5.611   9.164
  210    HD2  PRO  31           HD2      PRO  31 -19.913   3.483   8.402
  211    HD3  PRO  31           HD1      PRO  31 -19.776   4.924   7.377
  212    H    ALA  32           HN       ALA  32 -15.687   2.308   5.248
  213    HA   ALA  32           HA       ALA  32 -14.775   0.492   7.355
  214    HB1  ALA  32           HB1      ALA  32 -14.072  -0.974   5.523
  215    HB2  ALA  32           HB2      ALA  32 -14.563   0.252   4.353
  216    HB3  ALA  32           HB3      ALA  32 -15.773  -0.533   5.367
  217    HA   PRO  33           HA       PRO  33 -11.123   3.056   7.216
  218    HB2  PRO  33           HB2      PRO  33  -9.910   2.003   9.392
  219    HB3  PRO  33           HB1      PRO  33 -11.285   3.107   9.515
  220    HG2  PRO  33           HG2      PRO  33 -11.217   0.125   9.734
  221    HG3  PRO  33           HG1      PRO  33 -12.132   1.297  10.699
  222    HD2  PRO  33           HD2      PRO  33 -13.214  -0.151   8.654
  223    HD3  PRO  33           HD1      PRO  33 -13.811   1.443   9.150
  224    H    GLU  34           HN       GLU  34 -11.325  -0.315   6.723
  225    HA   GLU  34           HA       GLU  34  -8.436  -0.562   6.400
  226    HB2  GLU  34           HB2      GLU  34 -10.584  -2.672   6.317
  227    HB3  GLU  34           HB1      GLU  34  -8.863  -2.983   6.124
  228    HG2  GLU  34           HG2      GLU  34 -10.361  -2.122   8.561
  229    HG3  GLU  34           HG1      GLU  34  -9.243  -3.470   8.354
  230    H    GLU  35           HN       GLU  35 -10.844   0.496   4.524
  231    HA   GLU  35           HA       GLU  35  -9.567  -0.482   2.079
  232    HB2  GLU  35           HB2      GLU  35 -12.171   0.732   2.700
  233    HB3  GLU  35           HB1      GLU  35 -11.416   1.354   1.241
  234    HG2  GLU  35           HG2      GLU  35 -12.916  -0.479   0.728
  235    HG3  GLU  35           HG1      GLU  35 -11.251  -0.905   0.343
  236    H    TRP  36           HN       TRP  36  -7.565   0.520   2.362
  237    HA   TRP  36           HA       TRP  36  -7.451   3.344   2.970
  238    HB2  TRP  36           HB2      TRP  36  -5.025   1.836   2.121
  239    HB3  TRP  36           HB1      TRP  36  -5.196   3.051   3.379
  240    HD1  TRP  36           HD1      TRP  36  -7.419   1.579   5.169
  241    HE1  TRP  36           HE1      TRP  36  -6.762  -0.537   6.495
  242    HE3  TRP  36           HE3      TRP  36  -3.256   0.228   2.523
  243    HZ2  TRP  36           HZ2      TRP  36  -4.712  -2.497   6.423
  244    HZ3  TRP  36           HZ3      TRP  36  -2.022  -1.753   3.218
  245    HH2  TRP  36           HH2      TRP  36  -2.727  -3.100   5.106
  246    H    LEU  37           HN       LEU  37  -5.414   4.317   1.615
  247    HA   LEU  37           HA       LEU  37  -6.467   4.934  -0.945
  248    HB2  LEU  37           HB2      LEU  37  -5.155   6.510   0.400
  249    HB3  LEU  37           HB1      LEU  37  -3.752   5.480   0.257
  250    HG   LEU  37           HG       LEU  37  -3.826   5.843  -2.221
  251   HD11  LEU  37          HD11      LEU  37  -5.079   7.757  -3.050
  252   HD12  LEU  37          HD12      LEU  37  -5.833   7.949  -1.468
  253   HD13  LEU  37          HD13      LEU  37  -6.147   6.502  -2.427
  254   HD21  LEU  37          HD21      LEU  37  -2.278   7.057  -0.779
  255   HD22  LEU  37          HD22      LEU  37  -3.500   8.300  -0.512
  256   HD23  LEU  37          HD23      LEU  37  -2.828   8.058  -2.124
  257    H    ASP  38           HN       ASP  38  -6.451   3.423  -2.533
  258    HA   ASP  38           HA       ASP  38  -4.316   1.580  -2.851
  259    HB2  ASP  38           HB2      ASP  38  -6.688   1.273  -3.737
  260    HB3  ASP  38           HB1      ASP  38  -6.204   2.345  -5.050
  261    H    ILE  39           HN       ILE  39  -2.457   1.828  -3.722
  262    HA   ILE  39           HA       ILE  39  -1.356   4.251  -4.497
  263    HB   ILE  39           HB       ILE  39  -0.453   1.456  -5.198
  264   HG12  ILE  39          HG12      ILE  39  -0.113   3.195  -2.779
  265   HG13  ILE  39          HG11      ILE  39  -0.664   1.533  -2.866
  266   HG21  ILE  39          HG21      ILE  39   1.786   2.405  -5.368
  267   HG22  ILE  39          HG22      ILE  39   1.123   4.020  -5.110
  268   HG23  ILE  39          HG23      ILE  39   0.688   3.108  -6.556
  269   HD11  ILE  39          HD11      ILE  39   1.546   1.658  -1.900
  270   HD12  ILE  39          HD12      ILE  39   2.149   2.478  -3.339
  271   HD13  ILE  39          HD13      ILE  39   1.589   0.810  -3.447
  272    H    LEU  40           HN       LEU  40  -2.973   1.797  -6.395
  273    HA   LEU  40           HA       LEU  40  -2.454   3.399  -8.820
  274    HB2  LEU  40           HB2      LEU  40  -3.153   0.467  -8.632
  275    HB3  LEU  40           HB1      LEU  40  -2.820   1.353 -10.106
  276    HG   LEU  40           HG       LEU  40  -0.833   0.757  -7.905
  277   HD11  LEU  40          HD11      LEU  40  -1.418  -1.185  -9.256
  278   HD12  LEU  40          HD12      LEU  40   0.229  -0.650  -9.592
  279   HD13  LEU  40          HD13      LEU  40  -1.070  -0.275 -10.725
  280   HD21  LEU  40          HD21      LEU  40   0.821   1.743  -9.401
  281   HD22  LEU  40          HD22      LEU  40  -0.409   2.928  -8.960
  282   HD23  LEU  40          HD23      LEU  40  -0.451   2.162 -10.548
  283    H    GLY  41           HN       GLY  41  -4.690   2.890  -6.542
  284    HA2  GLY  41           HA2      GLY  41  -6.970   3.002  -6.384
  285    HA3  GLY  41           HA1      GLY  41  -6.937   3.789  -7.954
  286    H    ASN  42           HN       ASN  42  -5.592   0.640  -7.450
  287    HA   ASN  42           HA       ASN  42  -7.451  -0.424  -9.436
  288    HB2  ASN  42           HB2      ASN  42  -5.827  -1.956  -9.985
  289    HB3  ASN  42           HB1      ASN  42  -4.819  -0.662  -9.359
  290   HD21  ASN  42          HD21      ASN  42  -4.051  -0.880  -7.143
  291   HD22  ASN  42          HD22      ASN  42  -3.773  -2.453  -6.503
  292    H    GLY  43           HN       GLY  43  -6.501  -0.927  -6.072
  293    HA2  GLY  43           HA2      GLY  43  -8.390  -1.439  -4.590
  294    HA3  GLY  43           HA1      GLY  43  -8.914  -2.610  -5.790
  295    H    LEU  44           HN       LEU  44  -5.682  -2.864  -5.777
  296    HA   LEU  44           HA       LEU  44  -5.787  -5.131  -3.893
  297    HB2  LEU  44           HB2      LEU  44  -4.360  -4.733  -6.500
  298    HB3  LEU  44           HB1      LEU  44  -3.793  -5.920  -5.347
  299    HG   LEU  44           HG       LEU  44  -5.131  -6.940  -7.085
  300   HD11  LEU  44          HD11      LEU  44  -6.527  -6.952  -4.419
  301   HD12  LEU  44          HD12      LEU  44  -5.145  -7.946  -4.880
  302   HD13  LEU  44          HD13      LEU  44  -6.700  -8.174  -5.679
  303   HD21  LEU  44          HD21      LEU  44  -7.520  -6.524  -7.298
  304   HD22  LEU  44          HD22      LEU  44  -6.568  -5.085  -7.672
  305   HD23  LEU  44          HD23      LEU  44  -7.396  -5.218  -6.120
  306    H    LEU  45           HN       LEU  45  -4.117  -2.229  -4.712
  307    HA   LEU  45           HA       LEU  45  -1.888  -2.928  -2.920
  308    HB2  LEU  45           HB2      LEU  45  -0.969  -2.999  -5.056
  309    HB3  LEU  45           HB1      LEU  45  -1.902  -1.633  -5.619
  310    HG   LEU  45           HG       LEU  45  -0.492  -0.120  -4.290
  311   HD11  LEU  45          HD11      LEU  45   1.043  -2.619  -3.591
  312   HD12  LEU  45          HD12      LEU  45   0.073  -1.657  -2.478
  313   HD13  LEU  45          HD13      LEU  45   1.527  -0.967  -3.202
  314   HD21  LEU  45          HD21      LEU  45   0.123  -0.608  -6.590
  315   HD22  LEU  45          HD22      LEU  45   1.034  -2.023  -6.060
  316   HD23  LEU  45          HD23      LEU  45   1.569  -0.405  -5.597
  317    H    ARG  46           HN       ARG  46  -2.354  -1.808  -1.087
  318    HA   ARG  46           HA       ARG  46  -3.076   1.051  -1.360
  319    HB2  ARG  46           HB2      ARG  46  -4.406  -1.035   0.376
  320    HB3  ARG  46           HB1      ARG  46  -4.720   0.694   0.481
  321    HG2  ARG  46           HG2      ARG  46  -5.580   0.706  -1.752
  322    HG3  ARG  46           HG1      ARG  46  -5.152  -0.986  -1.973
  323    HD2  ARG  46           HD2      ARG  46  -7.132   0.083   0.027
  324    HD3  ARG  46           HD1      ARG  46  -7.536  -0.697  -1.500
  325    HE   ARG  46           HE       ARG  46  -5.885  -2.430  -0.056
  326   HH11  ARG  46          HH11      ARG  46  -9.115  -1.114   0.077
  327   HH12  ARG  46          HH12      ARG  46  -9.746  -2.397   1.069
  328   HH21  ARG  46          HH21      ARG  46  -6.709  -4.139   1.240
  329   HH22  ARG  46          HH22      ARG  46  -8.377  -4.120   1.719
  330    H    LYS  47           HN       LYS  47  -2.302   2.398   0.228
  331    HA   LYS  47           HA       LYS  47  -0.390   1.199   2.144
  332    HB2  LYS  47           HB2      LYS  47   0.398   2.725   0.184
  333    HB3  LYS  47           HB1      LYS  47  -0.303   4.026   1.130
  334    HG2  LYS  47           HG2      LYS  47   1.181   3.104   3.045
  335    HG3  LYS  47           HG1      LYS  47   2.067   2.323   1.734
  336    HD2  LYS  47           HD2      LYS  47   3.159   4.359   2.094
  337    HD3  LYS  47           HD1      LYS  47   2.189   4.595   0.646
  338    HE2  LYS  47           HE2      LYS  47   0.694   5.995   1.690
  339    HE3  LYS  47           HE1      LYS  47   0.998   5.306   3.284
  340    HZ1  LYS  47           HZ1      LYS  47   3.075   6.869   1.883
  341    HZ2  LYS  47           HZ2      LYS  47   2.927   6.557   3.547
  342    HZ3  LYS  47           HZ3      LYS  47   1.869   7.643   2.783
  343    H    LYS  48           HN       LYS  48  -0.990   1.425   4.266
  344    HA   LYS  48           HA       LYS  48  -2.804   3.648   4.949
  345    HB2  LYS  48           HB2      LYS  48  -3.482   1.347   5.697
  346    HB3  LYS  48           HB1      LYS  48  -2.035   1.303   6.700
  347    HG2  LYS  48           HG2      LYS  48  -2.941   3.505   7.710
  348    HG3  LYS  48           HG1      LYS  48  -4.468   3.023   6.981
  349    HD2  LYS  48           HD2      LYS  48  -2.882   1.515   9.053
  350    HD3  LYS  48           HD1      LYS  48  -4.444   2.303   9.273
  351    HE2  LYS  48           HE2      LYS  48  -5.086   0.682   7.267
  352    HE3  LYS  48           HE1      LYS  48  -3.761  -0.258   7.957
  353    HZ1  LYS  48           HZ1      LYS  48  -6.073   0.742   9.539
  354    HZ2  LYS  48           HZ2      LYS  48  -4.888  -0.363  10.042
  355    HZ3  LYS  48           HZ3      LYS  48  -6.013  -0.804   8.847
  356    H    THR  49           HN       THR  49  -1.888   5.390   5.736
  357    HA   THR  49           HA       THR  49   0.761   5.428   6.811
  358    HB   THR  49           HB       THR  49  -0.059   7.845   7.430
  359    HG1  THR  49           HG1      THR  49  -2.148   8.007   7.006
  360   HG21  THR  49          HG21      THR  49   0.232   6.918   4.569
  361   HG22  THR  49          HG22      THR  49   1.551   7.348   5.659
  362   HG23  THR  49          HG23      THR  49   0.405   8.579   5.132
  363    H    LEU  50           HN       LEU  50   0.842   4.151   8.642
  364    HA   LEU  50           HA       LEU  50  -0.952   4.328  10.831
  365    HB2  LEU  50           HB2      LEU  50   2.002   3.814  11.113
  366    HB3  LEU  50           HB1      LEU  50   0.692   3.159  12.073
  367    HG   LEU  50           HG       LEU  50   1.131   2.449   9.181
  368   HD11  LEU  50          HD11      LEU  50   3.082   1.786  10.426
  369   HD12  LEU  50          HD12      LEU  50   2.114   0.364  10.026
  370   HD13  LEU  50          HD13      LEU  50   2.075   1.024  11.660
  371   HD21  LEU  50          HD21      LEU  50  -0.302   0.546   9.731
  372   HD22  LEU  50          HD22      LEU  50  -1.121   2.085   9.996
  373   HD23  LEU  50          HD23      LEU  50  -0.498   1.170  11.369
  374    H    VAL  51           HN       VAL  51   2.241   5.627  10.267
  375    HA   VAL  51           HA       VAL  51   1.431   8.242  11.344
  376    HB   VAL  51           HB       VAL  51   4.148   6.944  11.612
  377   HG11  VAL  51          HG11      VAL  51   4.754   8.943  12.916
  378   HG12  VAL  51          HG12      VAL  51   3.182   9.647  12.537
  379   HG13  VAL  51          HG13      VAL  51   4.339   9.323  11.246
  380   HG21  VAL  51          HG21      VAL  51   2.569   6.000  13.190
  381   HG22  VAL  51          HG22      VAL  51   2.102   7.613  13.722
  382   HG23  VAL  51          HG23      VAL  51   3.732   7.016  14.041
  383    HA   PRO  52           HA       PRO  52   3.168   8.946   7.273
  384    HB2  PRO  52           HB2      PRO  52   1.602  10.948   6.609
  385    HB3  PRO  52           HB1      PRO  52   0.931   9.352   6.982
  386    HG2  PRO  52           HG2      PRO  52   0.881  11.839   8.617
  387    HG3  PRO  52           HG1      PRO  52  -0.305  10.526   8.535
  388    HD2  PRO  52           HD2      PRO  52   1.860  10.876  10.415
  389    HD3  PRO  52           HD1      PRO  52   0.641   9.581  10.368
  390    H    GLY  53           HN       GLY  53   5.010   9.772   9.117
  391    HA2  GLY  53           HA2      GLY  53   6.927  11.042   8.867
  392    HA3  GLY  53           HA1      GLY  53   6.084  12.024   7.678
  393    HA   PRO  54           HA       PRO  54   5.976  14.094  12.021
  394    HB2  PRO  54           HB2      PRO  54   8.589  14.759  12.483
  395    HB3  PRO  54           HB1      PRO  54   7.804  13.353  13.211
  396    HG2  PRO  54           HG2      PRO  54   9.626  13.497  10.841
  397    HG3  PRO  54           HG1      PRO  54   9.562  12.285  12.132
  398    HD2  PRO  54           HD2      PRO  54   8.498  11.881   9.675
  399    HD3  PRO  54           HD1      PRO  54   7.834  11.142  11.144
  400    HA   PRO  55           HA       PRO  55   5.465  17.487   9.199
  401    HB2  PRO  55           HB2      PRO  55   6.033  18.944  11.756
  402    HB3  PRO  55           HB1      PRO  55   4.803  19.276  10.527
  403    HG2  PRO  55           HG2      PRO  55   4.169  17.985  12.776
  404    HG3  PRO  55           HG1      PRO  55   3.444  17.529  11.224
  405    HD2  PRO  55           HD2      PRO  55   5.453  16.099  12.852
  406    HD3  PRO  55           HD1      PRO  55   4.324  15.468  11.636
  407    H    GLY  56           HN       GLY  56   6.970  18.065   7.812
  408    HA2  GLY  56           HA2      GLY  56   8.852  19.455   7.261
  409    HA3  GLY  56           HA1      GLY  56   9.562  19.058   8.821
  410    H    SER  57           HN       SER  57   8.061  16.462   7.224
  411    HA   SER  57           HA       SER  57  10.553  15.174   6.694
  412    HB2  SER  57           HB2      SER  57   8.808  13.495   5.702
  413    HB3  SER  57           HB1      SER  57   8.933  13.696   7.446
  414    HG   SER  57           HG       SER  57   6.898  14.394   5.692
  415    H    SER  58           HN       SER  58  10.211  13.782   4.463
  416    HA   SER  58           HA       SER  58   9.377  15.423   2.234
  417    HB2  SER  58           HB2      SER  58  12.261  14.539   2.575
  418    HB3  SER  58           HB1      SER  58  11.597  15.269   1.112
  419    HG   SER  58           HG       SER  58  11.008  16.818   3.226
  420    H    ARG  59           HN       ARG  59   8.895  14.122   0.438
  421    HA   ARG  59           HA       ARG  59   9.016  11.253   0.916
  422    HB2  ARG  59           HB2      ARG  59   7.693  12.833  -1.295
  423    HB3  ARG  59           HB1      ARG  59   7.548  11.097  -1.053
  424    HG2  ARG  59           HG2      ARG  59   6.519  11.537   1.150
  425    HG3  ARG  59           HG1      ARG  59   6.569  13.260   0.791
  426    HD2  ARG  59           HD2      ARG  59   5.198  11.243  -0.971
  427    HD3  ARG  59           HD1      ARG  59   4.376  12.114   0.321
  428    HE   ARG  59           HE       ARG  59   4.982  14.188  -0.908
  429   HH11  ARG  59          HH11      ARG  59   5.019  11.146  -2.652
  430   HH12  ARG  59          HH12      ARG  59   4.545  11.857  -4.168
  431   HH21  ARG  59          HH21      ARG  59   4.356  15.128  -2.894
  432   HH22  ARG  59          HH22      ARG  59   4.169  14.133  -4.308
  433    HA   PRO  60           HA       PRO  60  12.954  11.164  -1.248
  434    HB2  PRO  60           HB2      PRO  60  12.704   8.378  -1.616
  435    HB3  PRO  60           HB1      PRO  60  13.586   9.202  -0.330
  436    HG2  PRO  60           HG2      PRO  60  10.838   8.056  -0.313
  437    HG3  PRO  60           HG1      PRO  60  12.037   8.131   0.993
  438    HD2  PRO  60           HD2      PRO  60   9.941   9.767   1.007
  439    HD3  PRO  60           HD1      PRO  60  11.549  10.357   1.479
  440    H    VAL  61           HN       VAL  61  13.531  11.191  -3.322
  441    HA   VAL  61           HA       VAL  61  11.483  10.720  -5.336
  442    HB   VAL  61           HB       VAL  61  14.291  11.727  -5.814
  443   HG11  VAL  61          HG11      VAL  61  13.071  11.029  -7.800
  444   HG12  VAL  61          HG12      VAL  61  13.298  12.778  -7.789
  445   HG13  VAL  61          HG13      VAL  61  11.731  12.089  -7.363
  446   HG21  VAL  61          HG21      VAL  61  13.390  14.012  -5.666
  447   HG22  VAL  61          HG22      VAL  61  13.299  13.161  -4.124
  448   HG23  VAL  61          HG23      VAL  61  11.849  13.356  -5.111
  449    H    LYS  62           HN       LYS  62  11.898   9.381  -7.184
  450    HA   LYS  62           HA       LYS  62  13.117   6.925  -6.590
  451    HB2  LYS  62           HB2      LYS  62  12.152   8.029  -9.222
  452    HB3  LYS  62           HB1      LYS  62  12.761   6.392  -9.008
  453    HG2  LYS  62           HG2      LYS  62  10.958   6.335  -7.088
  454    HG3  LYS  62           HG1      LYS  62  10.225   7.612  -8.065
  455    HD2  LYS  62           HD2      LYS  62  10.206   6.175  -9.996
  456    HD3  LYS  62           HD1      LYS  62  11.058   4.913  -9.111
  457    HE2  LYS  62           HE2      LYS  62   9.063   5.004  -7.487
  458    HE3  LYS  62           HE1      LYS  62   8.236   5.868  -8.784
  459    HZ1  LYS  62           HZ1      LYS  62   9.004   3.880 -10.215
  460    HZ2  LYS  62           HZ2      LYS  62   7.670   3.695  -9.194
  461    HZ3  LYS  62           HZ3      LYS  62   9.180   3.072  -8.727
  462    H    GLY  63           HN       GLY  63  15.109   6.661  -6.258
  463    HA2  GLY  63           HA2      GLY  63  17.232   6.522  -7.742
  464    HA3  GLY  63           HA1      GLY  63  17.081   8.277  -7.693
  465    H    GLN  64           HN       GLN  64  15.935   8.194  -4.969
  466    HA   GLN  64           HA       GLN  64  18.477   8.219  -3.563
  467    HB2  GLN  64           HB2      GLN  64  15.936   8.459  -2.034
  468    HB3  GLN  64           HB1      GLN  64  17.434   9.381  -1.883
  469    HG2  GLN  64           HG2      GLN  64  15.312   9.737  -3.993
  470    HG3  GLN  64           HG1      GLN  64  15.566  10.768  -2.593
  471   HE21  GLN  64          HE21      GLN  64  18.199   9.509  -4.567
  472   HE22  GLN  64          HE22      GLN  64  18.656  11.043  -5.215
  473    H    VAL  65           HN       VAL  65  19.305   6.566  -2.427
  474    HA   VAL  65           HA       VAL  65  17.721   4.180  -2.131
  475    HB   VAL  65           HB       VAL  65  19.610   3.076  -1.262
  476   HG11  VAL  65          HG11      VAL  65  21.408   3.576  -2.855
  477   HG12  VAL  65          HG12      VAL  65  20.587   5.074  -3.286
  478   HG13  VAL  65          HG13      VAL  65  19.817   3.523  -3.619
  479   HG21  VAL  65          HG21      VAL  65  20.883   5.759  -0.776
  480   HG22  VAL  65          HG22      VAL  65  21.673   4.196  -0.558
  481   HG23  VAL  65          HG23      VAL  65  20.286   4.629   0.444
  482    H    VAL  66           HN       VAL  66  16.651   3.566  -0.380
  483    HA   VAL  66           HA       VAL  66  16.756   5.357   1.950
  484    HB   VAL  66           HB       VAL  66  14.306   5.145   2.166
  485   HG11  VAL  66          HG11      VAL  66  15.223   7.105   1.064
  486   HG12  VAL  66          HG12      VAL  66  13.702   6.639   0.304
  487   HG13  VAL  66          HG13      VAL  66  15.235   6.257  -0.480
  488   HG21  VAL  66          HG21      VAL  66  14.056   3.027   0.940
  489   HG22  VAL  66          HG22      VAL  66  14.427   3.872  -0.565
  490   HG23  VAL  66          HG23      VAL  66  12.970   4.279   0.337
  491    H    THR  67           HN       THR  67  16.387   4.436   3.929
  492    HA   THR  67           HA       THR  67  16.584   1.524   3.986
  493    HB   THR  67           HB       THR  67  16.996   1.856   6.436
  494    HG1  THR  67           HG1      THR  67  17.593   4.094   6.981
  495   HG21  THR  67          HG21      THR  67  18.874   1.580   4.937
  496   HG22  THR  67          HG22      THR  67  19.270   2.763   6.185
  497   HG23  THR  67          HG23      THR  67  18.857   3.302   4.555
  498    H    VAL  68           HN       VAL  68  14.695   0.533   3.967
  499    HA   VAL  68           HA       VAL  68  12.587   1.634   5.676
  500    HB   VAL  68           HB       VAL  68  11.049   0.037   4.421
  501   HG11  VAL  68          HG11      VAL  68  12.384   2.263   2.869
  502   HG12  VAL  68          HG12      VAL  68  11.043   2.442   4.002
  503   HG13  VAL  68          HG13      VAL  68  10.813   1.554   2.496
  504   HG21  VAL  68          HG21      VAL  68  11.790  -0.655   2.184
  505   HG22  VAL  68          HG22      VAL  68  12.732  -1.417   3.465
  506   HG23  VAL  68          HG23      VAL  68  13.414  -0.070   2.555
  507    H    HIS  69           HN       HIS  69  11.761   0.404   7.311
  508    HA   HIS  69           HA       HIS  69  12.972  -2.254   7.657
  509    HB2  HIS  69           HB2      HIS  69  13.110  -0.870   9.668
  510    HB3  HIS  69           HB1      HIS  69  11.384  -0.530   9.597
  511    HD1  HIS  69           HD1      HIS  69  12.820  -1.960  12.085
  512    HD2  HIS  69           HD2      HIS  69  10.677  -3.816   9.051
  513    HE1  HIS  69           HE1      HIS  69  12.030  -4.190  13.006
  514    HE2  HIS  69           HE2      HIS  69  10.605  -5.163  11.239
  515    H    LEU  70           HN       LEU  70  11.824  -3.866   6.825
  516    HA   LEU  70           HA       LEU  70   8.934  -3.512   6.866
  517    HB2  LEU  70           HB2      LEU  70   8.633  -4.323   4.796
  518    HB3  LEU  70           HB1      LEU  70  10.239  -3.663   4.575
  519    HG   LEU  70           HG       LEU  70   9.722  -6.541   5.262
  520   HD11  LEU  70          HD11      LEU  70  10.140  -5.285   2.546
  521   HD12  LEU  70          HD12      LEU  70   8.650  -6.026   3.130
  522   HD13  LEU  70          HD13      LEU  70  10.087  -7.018   2.880
  523   HD21  LEU  70          HD21      LEU  70  11.988  -6.874   4.434
  524   HD22  LEU  70          HD22      LEU  70  11.972  -5.711   5.760
  525   HD23  LEU  70          HD23      LEU  70  12.134  -5.150   4.096
  526    H    GLN  71           HN       GLN  71   7.765  -4.925   7.791
  527    HA   GLN  71           HA       GLN  71   8.712  -7.692   7.972
  528    HB2  GLN  71           HB2      GLN  71   6.810  -6.827  10.038
  529    HB3  GLN  71           HB1      GLN  71   8.123  -7.985  10.151
  530    HG2  GLN  71           HG2      GLN  71   8.946  -6.407  11.525
  531    HG3  GLN  71           HG1      GLN  71   9.594  -5.813  10.001
  532   HE21  GLN  71          HE21      GLN  71   6.831  -4.989   9.198
  533   HE22  GLN  71          HE22      GLN  71   6.600  -3.491  10.029
  534    H    THR  72           HN       THR  72   7.461  -8.798   6.773
  535    HA   THR  72           HA       THR  72   4.989  -7.553   5.883
  536    HB   THR  72           HB       THR  72   6.696  -9.668   4.599
  537    HG1  THR  72           HG1      THR  72   7.713  -8.032   3.652
  538   HG21  THR  72          HG21      THR  72   4.315  -8.126   3.607
  539   HG22  THR  72          HG22      THR  72   4.407  -9.864   3.896
  540   HG23  THR  72          HG23      THR  72   5.345  -9.138   2.591
  541    H    SER  73           HN       SER  73   3.116  -8.412   6.295
  542    HA   SER  73           HA       SER  73   3.005 -11.083   7.495
  543    HB2  SER  73           HB2      SER  73   2.146  -9.079   8.790
  544    HB3  SER  73           HB1      SER  73   0.920  -8.879   7.543
  545    HG   SER  73           HG       SER  73  -0.189 -10.396   8.443
  546    H    LEU  74           HN       LEU  74   1.219 -12.412   6.903
  547    HA   LEU  74           HA       LEU  74   0.452 -12.175   4.124
  548    HB2  LEU  74           HB2      LEU  74  -0.067 -14.292   6.206
  549    HB3  LEU  74           HB1      LEU  74  -0.613 -14.390   4.548
  550    HG   LEU  74           HG       LEU  74   2.170 -14.595   5.626
  551   HD11  LEU  74          HD11      LEU  74   0.647 -16.245   3.622
  552   HD12  LEU  74          HD12      LEU  74   0.793 -16.616   5.340
  553   HD13  LEU  74          HD13      LEU  74   2.227 -16.616   4.312
  554   HD21  LEU  74          HD21      LEU  74   3.030 -14.431   3.334
  555   HD22  LEU  74          HD22      LEU  74   2.300 -12.916   3.876
  556   HD23  LEU  74          HD23      LEU  74   1.421 -13.978   2.772
  557    H    GLU  75           HN       GLU  75  -1.847 -12.544   3.541
  558    HA   GLU  75           HA       GLU  75  -3.635 -10.772   4.677
  559    HB2  GLU  75           HB2      GLU  75  -5.377 -11.956   3.416
  560    HB3  GLU  75           HB1      GLU  75  -3.927 -11.722   2.448
  561    HG2  GLU  75           HG2      GLU  75  -3.254 -14.027   2.902
  562    HG3  GLU  75           HG1      GLU  75  -4.732 -14.266   3.834
  563    H    ASN  76           HN       ASN  76  -2.624 -13.818   5.798
  564    HA   ASN  76           HA       ASN  76  -5.005 -14.340   7.396
  565    HB2  ASN  76           HB2      ASN  76  -2.435 -15.935   7.198
  566    HB3  ASN  76           HB1      ASN  76  -3.923 -16.455   7.976
  567   HD21  ASN  76          HD21      ASN  76  -2.247 -16.046   4.996
  568   HD22  ASN  76          HD22      ASN  76  -3.427 -16.780   3.976
  569    H    GLY  77           HN       GLY  77  -2.172 -12.599   7.704
  570    HA2  GLY  77           HA2      GLY  77  -1.689 -11.310   9.637
  571    HA3  GLY  77           HA1      GLY  77  -2.496 -12.524  10.621
  572    H    THR  78           HN       THR  78  -0.416 -13.791   8.262
  573    HA   THR  78           HA       THR  78   1.454 -14.571  10.353
  574    HB   THR  78           HB       THR  78   1.259 -15.698   7.562
  575    HG1  THR  78           HG1      THR  78   0.075 -16.745   9.941
  576   HG21  THR  78          HG21      THR  78   3.347 -16.207   8.721
  577   HG22  THR  78          HG22      THR  78   2.357 -17.661   8.582
  578   HG23  THR  78          HG23      THR  78   2.448 -16.797  10.118
  579    H    ARG  79           HN       ARG  79   3.141 -13.277  10.579
  580    HA   ARG  79           HA       ARG  79   4.178 -11.768   8.378
  581    HB2  ARG  79           HB2      ARG  79   5.092 -12.107  11.223
  582    HB3  ARG  79           HB1      ARG  79   5.953 -11.116  10.049
  583    HG2  ARG  79           HG2      ARG  79   3.360 -10.275   9.768
  584    HG3  ARG  79           HG1      ARG  79   3.501 -10.573  11.504
  585    HD2  ARG  79           HD2      ARG  79   5.402  -9.132  11.663
  586    HD3  ARG  79           HD1      ARG  79   5.490  -8.977   9.906
  587    HE   ARG  79           HE       ARG  79   3.067  -7.963  10.427
  588   HH11  ARG  79          HH11      ARG  79   6.117  -7.419  12.035
  589   HH12  ARG  79          HH12      ARG  79   5.807  -5.736  12.340
  590   HH21  ARG  79          HH21      ARG  79   2.645  -5.715  10.843
  591   HH22  ARG  79          HH22      ARG  79   3.859  -4.756  11.643
  592    H    VAL  80           HN       VAL  80   5.517 -12.403   6.943
  593    HA   VAL  80           HA       VAL  80   6.680 -15.066   7.248
  594    HB   VAL  80           HB       VAL  80   6.686 -15.104   4.777
  595   HG11  VAL  80          HG11      VAL  80   4.031 -14.414   6.009
  596   HG12  VAL  80          HG12      VAL  80   4.816 -15.994   6.080
  597   HG13  VAL  80          HG13      VAL  80   4.287 -15.340   4.529
  598   HG21  VAL  80          HG21      VAL  80   5.264 -12.458   5.019
  599   HG22  VAL  80          HG22      VAL  80   5.497 -13.377   3.531
  600   HG23  VAL  80          HG23      VAL  80   6.888 -12.695   4.377
  601    H    GLN  81           HN       GLN  81   7.602 -11.873   7.259
  602    HA   GLN  81           HA       GLN  81  10.376 -12.557   7.043
  603    HB2  GLN  81           HB2      GLN  81  10.881 -11.005   5.187
  604    HB3  GLN  81           HB1      GLN  81   9.855 -12.335   4.670
  605    HG2  GLN  81           HG2      GLN  81   7.900 -10.893   4.787
  606    HG3  GLN  81           HG1      GLN  81   8.916  -9.547   5.311
  607   HE21  GLN  81          HE21      GLN  81   7.832 -11.475   2.704
  608   HE22  GLN  81          HE22      GLN  81   8.566 -10.548   1.438
  609    H    GLU  82           HN       GLU  82  11.573 -11.197   8.258
  610    HA   GLU  82           HA       GLU  82  10.468  -8.546   8.850
  611    HB2  GLU  82           HB2      GLU  82   9.867  -9.967  10.749
  612    HB3  GLU  82           HB1      GLU  82  11.543 -10.461  10.927
  613    HG2  GLU  82           HG2      GLU  82  12.201  -8.241  11.542
  614    HG3  GLU  82           HG1      GLU  82  10.588  -7.632  11.187
  615    H    GLU  83           HN       GLU  83  11.897  -7.159   8.123
  616    HA   GLU  83           HA       GLU  83  14.724  -7.636   8.701
  617    HB2  GLU  83           HB2      GLU  83  14.765  -8.213   6.480
  618    HB3  GLU  83           HB1      GLU  83  13.408  -7.186   6.067
  619    HG2  GLU  83           HG2      GLU  83  14.725  -5.310   5.835
  620    HG3  GLU  83           HG1      GLU  83  16.055  -5.996   6.781
  621    HA   PRO  84           HA       PRO  84  13.966  -3.763  10.614
  622    HB2  PRO  84           HB2      PRO  84  16.432  -3.444  11.697
  623    HB3  PRO  84           HB1      PRO  84  15.237  -4.574  12.342
  624    HG2  PRO  84           HG2      PRO  84  17.585  -5.103  10.573
  625    HG3  PRO  84           HG1      PRO  84  16.991  -6.041  11.955
  626    HD2  PRO  84           HD2      PRO  84  16.502  -6.728   9.366
  627    HD3  PRO  84           HD1      PRO  84  15.390  -7.106  10.696
  628    H    GLU  85           HN       GLU  85  16.200  -4.257   8.066
  629    HA   GLU  85           HA       GLU  85  16.027  -1.504   7.356
  630    HB2  GLU  85           HB2      GLU  85  17.868  -1.459   9.038
  631    HB3  GLU  85           HB1      GLU  85  18.787  -2.540   7.997
  632    HG2  GLU  85           HG2      GLU  85  19.058  -0.928   6.348
  633    HG3  GLU  85           HG1      GLU  85  17.739   0.065   6.972
  634    H    LEU  86           HN       LEU  86  15.487  -1.688   5.460
  635    HA   LEU  86           HA       LEU  86  16.984  -3.360   3.578
  636    HB2  LEU  86           HB2      LEU  86  14.781  -4.222   3.726
  637    HB3  LEU  86           HB1      LEU  86  14.078  -2.623   3.799
  638    HG   LEU  86           HG       LEU  86  14.666  -2.266   1.443
  639   HD11  LEU  86          HD11      LEU  86  16.587  -3.745   1.315
  640   HD12  LEU  86          HD12      LEU  86  15.395  -4.144   0.078
  641   HD13  LEU  86          HD13      LEU  86  15.535  -5.144   1.526
  642   HD21  LEU  86          HD21      LEU  86  12.993  -3.779   0.503
  643   HD22  LEU  86          HD22      LEU  86  12.459  -3.101   2.041
  644   HD23  LEU  86          HD23      LEU  86  13.055  -4.761   1.967
  645    H    VAL  87           HN       VAL  87  18.429  -1.855   2.819
  646    HA   VAL  87           HA       VAL  87  17.378   0.732   1.930
  647    HB   VAL  87           HB       VAL  87  19.508   0.668   3.236
  648   HG11  VAL  87          HG11      VAL  87  20.672  -0.604   0.771
  649   HG12  VAL  87          HG12      VAL  87  20.451  -1.398   2.331
  650   HG13  VAL  87          HG13      VAL  87  21.569  -0.042   2.181
  651   HG21  VAL  87          HG21      VAL  87  18.991   2.563   1.825
  652   HG22  VAL  87          HG22      VAL  87  19.704   1.747   0.433
  653   HG23  VAL  87          HG23      VAL  87  20.724   2.230   1.787
  654    H    PHE  88           HN       PHE  88  17.086   1.210  -0.184
  655    HA   PHE  88           HA       PHE  88  18.232  -0.450  -2.272
  656    HB2  PHE  88           HB2      PHE  88  16.132  -1.147  -3.224
  657    HB3  PHE  88           HB1      PHE  88  16.199  -1.690  -1.553
  658    HD1  PHE  88           HD2      PHE  88  14.918  -0.404   0.193
  659    HD2  PHE  88           HD1      PHE  88  14.415   0.243  -3.981
  660    HE1  PHE  88           HE2      PHE  88  12.755   0.677   0.627
  661    HE2  PHE  88           HE1      PHE  88  12.253   1.326  -3.557
  662    HZ   PHE  88           HZ       PHE  88  11.411   1.534  -1.262
  663    H    THR  89           HN       THR  89  17.865   0.415  -4.386
  664    HA   THR  89           HA       THR  89  17.689   3.281  -4.407
  665    HB   THR  89           HB       THR  89  17.787   1.481  -6.830
  666    HG1  THR  89           HG1      THR  89  19.620   0.790  -6.005
  667   HG21  THR  89          HG21      THR  89  18.830   4.263  -6.269
  668   HG22  THR  89          HG22      THR  89  17.436   3.856  -7.267
  669   HG23  THR  89          HG23      THR  89  19.054   3.379  -7.780
  670    H    LEU  90           HN       LEU  90  15.776   4.262  -4.344
  671    HA   LEU  90           HA       LEU  90  13.286   3.072  -4.891
  672    HB2  LEU  90           HB2      LEU  90  13.846   5.184  -3.559
  673    HB3  LEU  90           HB1      LEU  90  13.864   6.007  -5.085
  674    HG   LEU  90           HG       LEU  90  11.539   5.421  -5.486
  675   HD11  LEU  90          HD11      LEU  90  11.518   3.281  -4.323
  676   HD12  LEU  90          HD12      LEU  90  10.218   4.326  -3.751
  677   HD13  LEU  90          HD13      LEU  90  11.671   4.113  -2.775
  678   HD21  LEU  90          HD21      LEU  90  10.554   6.876  -3.848
  679   HD22  LEU  90          HD22      LEU  90  12.159   7.485  -4.250
  680   HD23  LEU  90          HD23      LEU  90  11.900   6.608  -2.742
  681    H    GLY  91           HN       GLY  91  12.229   2.715  -6.776
  682    HA2  GLY  91           HA2      GLY  91  11.528   3.140  -8.961
  683    HA3  GLY  91           HA1      GLY  91  12.713   4.432  -9.073
  684    H    ASP  92           HN       ASP  92  14.157   1.740  -7.814
  685    HA   ASP  92           HA       ASP  92  15.279   1.031 -10.427
  686    HB2  ASP  92           HB2      ASP  92  16.880   1.749  -8.695
  687    HB3  ASP  92           HB1      ASP  92  16.303   0.468  -7.636
  688    H    CYS  93           HN       CYS  93  12.942   0.119  -8.345
  689    HA   CYS  93           HA       CYS  93  11.732  -1.766  -7.973
  690    HB2  CYS  93           HB2      CYS  93  12.891  -2.636 -10.630
  691    HB3  CYS  93           HB1      CYS  93  11.414  -3.234  -9.876
  692    HG   CYS  93           HG       CYS  93  11.175  -1.313 -12.158
  693    H    ASP  94           HN       ASP  94  14.349  -1.630  -6.886
  694    HA   ASP  94           HA       ASP  94  15.678  -4.142  -7.216
  695    HB2  ASP  94           HB2      ASP  94  16.794  -1.991  -6.532
  696    HB3  ASP  94           HB1      ASP  94  15.974  -2.127  -4.980
  697    H    VAL  95           HN       VAL  95  12.947  -3.141  -5.789
  698    HA   VAL  95           HA       VAL  95  12.866  -5.308  -3.789
  699    HB   VAL  95           HB       VAL  95  11.238  -3.784  -2.577
  700   HG11  VAL  95          HG11      VAL  95  13.000  -2.476  -1.520
  701   HG12  VAL  95          HG12      VAL  95  14.075  -2.814  -2.877
  702   HG13  VAL  95          HG13      VAL  95  13.544  -4.126  -1.824
  703   HG21  VAL  95          HG21      VAL  95  12.434  -1.760  -4.473
  704   HG22  VAL  95          HG22      VAL  95  11.429  -1.377  -3.066
  705   HG23  VAL  95          HG23      VAL  95  10.747  -2.279  -4.422
  706    H    ILE  96           HN       ILE  96  10.135  -4.922  -3.139
  707    HA   ILE  96           HA       ILE  96   8.840  -5.994  -5.485
  708    HB   ILE  96           HB       ILE  96   6.835  -6.173  -4.032
  709   HG12  ILE  96          HG12      ILE  96   8.645  -5.110  -1.848
  710   HG13  ILE  96          HG11      ILE  96   7.327  -4.206  -2.589
  711   HG21  ILE  96          HG21      ILE  96   7.724  -7.894  -2.527
  712   HG22  ILE  96          HG22      ILE  96   9.362  -7.316  -2.836
  713   HG23  ILE  96          HG23      ILE  96   8.408  -8.017  -4.146
  714   HD11  ILE  96          HD11      ILE  96   7.023  -6.776  -1.050
  715   HD12  ILE  96          HD12      ILE  96   5.724  -5.807  -1.742
  716   HD13  ILE  96          HD13      ILE  96   6.700  -5.157  -0.424
  717    H    GLN  97           HN       GLN  97   7.319  -4.878  -6.668
  718    HA   GLN  97           HA       GLN  97   7.863  -2.141  -6.921
  719    HB2  GLN  97           HB2      GLN  97   6.901  -3.785  -8.680
  720    HB3  GLN  97           HB1      GLN  97   5.335  -3.316  -8.022
  721    HG2  GLN  97           HG2      GLN  97   5.624  -1.842  -9.784
  722    HG3  GLN  97           HG1      GLN  97   6.143  -0.902  -8.386
  723   HE21  GLN  97          HE21      GLN  97   8.437  -0.560  -8.067
  724   HE22  GLN  97          HE22      GLN  97   9.516  -0.680  -9.413
  725    H    ALA  98           HN       ALA  98   5.399  -3.840  -5.140
  726    HA   ALA  98           HA       ALA  98   3.634  -1.768  -4.530
  727    HB1  ALA  98           HB1      ALA  98   3.088  -3.028  -2.534
  728    HB2  ALA  98           HB2      ALA  98   4.579  -3.954  -2.683
  729    HB3  ALA  98           HB3      ALA  98   3.310  -4.127  -3.892
  730    H    LEU  99           HN       LEU  99   6.785  -2.550  -3.225
  731    HA   LEU  99           HA       LEU  99   6.612  -0.546  -1.148
  732    HB2  LEU  99           HB2      LEU  99   7.894  -2.605  -0.770
  733    HB3  LEU  99           HB1      LEU  99   8.984  -2.146  -2.069
  734    HG   LEU  99           HG       LEU  99   9.683  -0.162  -0.803
  735   HD11  LEU  99          HD11      LEU  99   7.862  -1.234   1.347
  736   HD12  LEU  99          HD12      LEU  99   7.649   0.265   0.445
  737   HD13  LEU  99          HD13      LEU  99   9.013   0.087   1.551
  738   HD21  LEU  99          HD21      LEU  99   9.882  -2.750   0.718
  739   HD22  LEU  99          HD22      LEU  99  10.875  -1.322   1.008
  740   HD23  LEU  99          HD23      LEU  99  10.979  -2.171  -0.535
  741    H    ASP 100           HN       ASP 100   8.150  -0.950  -4.258
  742    HA   ASP 100           HA       ASP 100   9.897   1.247  -4.150
  743    HB2  ASP 100           HB2      ASP 100  10.087  -0.620  -5.757
  744    HB3  ASP 100           HB1      ASP 100   8.614  -0.089  -6.544
  745    H    LEU 101           HN       LEU 101   6.537   0.917  -4.880
  746    HA   LEU 101           HA       LEU 101   6.317   3.641  -5.815
  747    HB2  LEU 101           HB2      LEU 101   4.214   1.536  -5.355
  748    HB3  LEU 101           HB1      LEU 101   3.968   3.071  -6.146
  749    HG   LEU 101           HG       LEU 101   5.637   0.774  -7.151
  750   HD11  LEU 101          HD11      LEU 101   3.213   0.495  -7.404
  751   HD12  LEU 101          HD12      LEU 101   4.025   0.679  -8.958
  752   HD13  LEU 101          HD13      LEU 101   3.133   2.032  -8.263
  753   HD21  LEU 101          HD21      LEU 101   5.253   3.524  -8.323
  754   HD22  LEU 101          HD22      LEU 101   5.987   2.161  -9.168
  755   HD23  LEU 101          HD23      LEU 101   6.758   2.827  -7.728
  756    H    SER 102           HN       SER 102   5.584   1.772  -2.905
  757    HA   SER 102           HA       SER 102   3.776   3.712  -1.874
  758    HB2  SER 102           HB2      SER 102   4.023   2.392   0.270
  759    HB3  SER 102           HB1      SER 102   3.449   1.480  -1.125
  760    HG   SER 102           HG       SER 102   5.234   0.353  -1.140
  761    H    VAL 103           HN       VAL 103   7.194   3.238  -1.741
  762    HA   VAL 103           HA       VAL 103   7.780   4.758   0.537
  763    HB   VAL 103           HB       VAL 103   9.407   4.113  -1.889
  764   HG11  VAL 103          HG11      VAL 103  10.397   5.410   0.663
  765   HG12  VAL 103          HG12      VAL 103  10.188   6.248  -0.874
  766   HG13  VAL 103          HG13      VAL 103  11.373   4.951  -0.733
  767   HG21  VAL 103          HG21      VAL 103  10.616   2.731  -0.104
  768   HG22  VAL 103          HG22      VAL 103   9.026   2.182  -0.631
  769   HG23  VAL 103          HG23      VAL 103   9.201   3.033   0.903
  770    HA   PRO 104           HA       PRO 104   8.420   8.591  -2.405
  771    HB2  PRO 104           HB2      PRO 104   7.057   8.382  -4.798
  772    HB3  PRO 104           HB1      PRO 104   8.793   8.124  -4.599
  773    HG2  PRO 104           HG2      PRO 104   6.589   6.112  -4.739
  774    HG3  PRO 104           HG1      PRO 104   8.209   6.057  -5.451
  775    HD2  PRO 104           HD2      PRO 104   7.628   4.684  -3.242
  776    HD3  PRO 104           HD1      PRO 104   9.207   5.449  -3.470
  777    H    LEU 105           HN       LEU 105   5.514   6.633  -2.387
  778    HA   LEU 105           HA       LEU 105   3.696   8.834  -2.222
  779    HB2  LEU 105           HB2      LEU 105   3.534   5.923  -1.504
  780    HB3  LEU 105           HB1      LEU 105   2.196   7.021  -1.192
  781    HG   LEU 105           HG       LEU 105   3.321   6.173  -3.847
  782   HD11  LEU 105          HD11      LEU 105   0.985   5.516  -4.244
  783   HD12  LEU 105          HD12      LEU 105   0.589   6.016  -2.600
  784   HD13  LEU 105          HD13      LEU 105   1.706   4.679  -2.870
  785   HD21  LEU 105          HD21      LEU 105   2.977   8.579  -3.966
  786   HD22  LEU 105          HD22      LEU 105   1.351   8.396  -3.303
  787   HD23  LEU 105          HD23      LEU 105   1.738   7.731  -4.891
  788    H    MET 106           HN       MET 106   5.654   7.099   0.050
  789    HA   MET 106           HA       MET 106   4.269   8.192   2.365
  790    HB2  MET 106           HB2      MET 106   4.895   6.261   3.285
  791    HB3  MET 106           HB1      MET 106   5.659   5.809   1.775
  792    HG2  MET 106           HG2      MET 106   7.687   7.121   2.668
  793    HG3  MET 106           HG1      MET 106   6.865   6.992   4.231
  794    HE1  MET 106           HE1      MET 106   6.373   4.677   5.457
  795    HE2  MET 106           HE2      MET 106   6.652   3.105   4.706
  796    HE3  MET 106           HE3      MET 106   5.440   4.199   4.038
  797    H    ASP 107           HN       ASP 107   5.345   9.407   4.003
  798    HA   ASP 107           HA       ASP 107   7.450  11.134   2.934
  799    HB2  ASP 107           HB2      ASP 107   5.519  11.330   5.202
  800    HB3  ASP 107           HB1      ASP 107   7.048  12.177   5.365
  801    H    VAL 108           HN       VAL 108   9.418  11.517   4.006
  802    HA   VAL 108           HA       VAL 108  10.697   9.278   5.095
  803    HB   VAL 108           HB       VAL 108  11.399  12.177   4.897
  804   HG11  VAL 108          HG11      VAL 108  12.142  11.590   7.160
  805   HG12  VAL 108          HG12      VAL 108  13.505  11.851   6.069
  806   HG13  VAL 108          HG13      VAL 108  13.029  10.210   6.504
  807   HG21  VAL 108          HG21      VAL 108  13.328  11.279   3.691
  808   HG22  VAL 108          HG22      VAL 108  11.812  10.674   3.025
  809   HG23  VAL 108          HG23      VAL 108  12.794   9.638   4.061
  810    H    GLY 109           HN       GLY 109  10.530   8.383   6.987
  811    HA2  GLY 109           HA2      GLY 109  10.837   8.454   9.349
  812    HA3  GLY 109           HA1      GLY 109  10.184  10.086   9.355
  813    H    GLU 110           HN       GLU 110   8.382   7.966   7.385
  814    HA   GLU 110           HA       GLU 110   6.403   7.771   9.535
  815    HB2  GLU 110           HB2      GLU 110   4.687   7.766   7.965
  816    HB3  GLU 110           HB1      GLU 110   5.822   8.960   7.345
  817    HG2  GLU 110           HG2      GLU 110   6.541   7.509   5.637
  818    HG3  GLU 110           HG1      GLU 110   5.762   6.119   6.391
  819    H    THR 111           HN       THR 111   4.937   5.873   9.374
  820    HA   THR 111           HA       THR 111   6.285   3.491   8.364
  821    HB   THR 111           HB       THR 111   4.788   3.558  10.991
  822    HG1  THR 111           HG1      THR 111   7.104   4.586  10.600
  823   HG21  THR 111          HG21      THR 111   4.824   1.384   9.836
  824   HG22  THR 111          HG22      THR 111   5.782   1.344  11.314
  825   HG23  THR 111          HG23      THR 111   6.587   1.464   9.752
  826    H    ALA 112           HN       ALA 112   5.020   2.605   6.884
  827    HA   ALA 112           HA       ALA 112   2.118   3.002   7.182
  828    HB1  ALA 112           HB1      ALA 112   1.954   3.046   4.757
  829    HB2  ALA 112           HB2      ALA 112   3.697   2.820   4.620
  830    HB3  ALA 112           HB3      ALA 112   3.054   4.305   5.324
  831    H    MET 113           HN       MET 113   0.842   1.293   6.999
  832    HA   MET 113           HA       MET 113   2.082  -1.321   6.501
  833    HB2  MET 113           HB2      MET 113   0.796  -1.278   8.542
  834    HB3  MET 113           HB1      MET 113  -0.561  -0.506   7.739
  835    HG2  MET 113           HG2      MET 113  -1.150  -2.466   6.601
  836    HG3  MET 113           HG1      MET 113   0.385  -3.250   6.969
  837    HE1  MET 113           HE1      MET 113  -2.987  -2.471  10.021
  838    HE2  MET 113           HE2      MET 113  -3.137  -2.182   8.289
  839    HE3  MET 113           HE3      MET 113  -2.055  -1.181   9.259
  840    H    VAL 114           HN       VAL 114   1.917  -2.047   4.506
  841    HA   VAL 114           HA       VAL 114  -0.169  -0.882   2.773
  842    HB   VAL 114           HB       VAL 114   2.404  -2.144   1.874
  843   HG11  VAL 114          HG11      VAL 114   0.581  -0.204   0.471
  844   HG12  VAL 114          HG12      VAL 114   0.654  -1.944   0.178
  845   HG13  VAL 114          HG13      VAL 114   2.049  -0.929  -0.192
  846   HG21  VAL 114          HG21      VAL 114   2.918  -0.292   3.362
  847   HG22  VAL 114          HG22      VAL 114   1.912   0.770   2.378
  848   HG23  VAL 114          HG23      VAL 114   3.379   0.064   1.698
  849    H    THR 115           HN       THR 115  -1.604  -2.245   1.885
  850    HA   THR 115           HA       THR 115  -0.873  -5.083   1.951
  851    HB   THR 115           HB       THR 115  -3.650  -3.897   1.783
  852    HG1  THR 115           HG1      THR 115  -2.038  -4.506   3.869
  853   HG21  THR 115          HG21      THR 115  -4.412  -6.181   1.962
  854   HG22  THR 115          HG22      THR 115  -2.746  -6.750   2.072
  855   HG23  THR 115          HG23      THR 115  -3.335  -6.037   0.570
  856    H    ALA 116           HN       ALA 116  -0.148  -5.721   0.186
  857    HA   ALA 116           HA       ALA 116  -1.184  -4.656  -2.369
  858    HB1  ALA 116           HB1      ALA 116   1.626  -5.506  -1.686
  859    HB2  ALA 116           HB2      ALA 116   1.071  -3.855  -1.966
  860    HB3  ALA 116           HB3      ALA 116   1.059  -5.026  -3.284
  861    H    ASP 117           HN       ASP 117  -1.912  -6.170  -3.741
  862    HA   ASP 117           HA       ASP 117  -2.165  -8.862  -3.167
  863    HB2  ASP 117           HB2      ASP 117  -3.200  -7.576  -5.132
  864    HB3  ASP 117           HB1      ASP 117  -1.661  -7.819  -5.928
  865    H    SER 118           HN       SER 118  -0.898 -10.687  -3.666
  866    HA   SER 118           HA       SER 118   1.840 -10.425  -3.295
  867    HB2  SER 118           HB2      SER 118   0.297 -12.500  -3.046
  868    HB3  SER 118           HB1      SER 118   0.661 -12.778  -4.750
  869    HG   SER 118           HG       SER 118   2.080 -13.843  -3.202
  870    H    LYS 119           HN       LYS 119  -0.046 -10.317  -6.215
  871    HA   LYS 119           HA       LYS 119   1.904 -10.691  -8.145
  872    HB2  LYS 119           HB2      LYS 119   0.524  -9.143  -9.535
  873    HB3  LYS 119           HB1      LYS 119  -0.381 -10.453  -8.782
  874    HG2  LYS 119           HG2      LYS 119  -1.150  -8.893  -7.068
  875    HG3  LYS 119           HG1      LYS 119  -0.221  -7.603  -7.837
  876    HD2  LYS 119           HD2      LYS 119  -2.509  -7.401  -8.528
  877    HD3  LYS 119           HD1      LYS 119  -1.566  -7.955  -9.914
  878    HE2  LYS 119           HE2      LYS 119  -2.277 -10.285  -9.362
  879    HE3  LYS 119           HE1      LYS 119  -3.335  -9.615  -8.121
  880    HZ1  LYS 119           HZ1      LYS 119  -3.538  -9.351 -11.051
  881    HZ2  LYS 119           HZ2      LYS 119  -4.287  -8.226 -10.032
  882    HZ3  LYS 119           HZ3      LYS 119  -4.717  -9.864  -9.945
  883    H    TYR 120           HN       TYR 120   1.400  -7.903  -6.033
  884    HA   TYR 120           HA       TYR 120   3.567  -6.448  -7.376
  885    HB2  TYR 120           HB2      TYR 120   1.767  -5.633  -5.084
  886    HB3  TYR 120           HB1      TYR 120   3.002  -4.609  -5.807
  887    HD1  TYR 120           HD2      TYR 120  -0.250  -6.205  -6.317
  888    HD2  TYR 120           HD1      TYR 120   2.630  -3.501  -7.876
  889    HE1  TYR 120           HE2      TYR 120  -1.897  -5.432  -7.954
  890    HE2  TYR 120           HE1      TYR 120   0.984  -2.706  -9.533
  891    HH   TYR 120           HH       TYR 120  -1.056  -3.475 -10.626
  892    H    CYS 121           HN       CYS 121   3.362  -8.856  -5.322
  893    HA   CYS 121           HA       CYS 121   5.593  -7.942  -3.634
  894    HB2  CYS 121           HB2      CYS 121   3.360  -9.826  -2.862
  895    HB3  CYS 121           HB1      CYS 121   4.710  -9.365  -1.836
  896    HG   CYS 121           HG       CYS 121   1.819  -7.901  -2.184
  897    H    TYR 122           HN       TYR 122   4.238 -11.215  -3.637
  898    HA   TYR 122           HA       TYR 122   6.453 -12.109  -5.345
  899    HB2  TYR 122           HB2      TYR 122   5.839 -13.555  -2.771
  900    HB3  TYR 122           HB1      TYR 122   7.233 -13.721  -3.818
  901    HD1  TYR 122           HD2      TYR 122   9.016 -12.000  -3.821
  902    HD2  TYR 122           HD1      TYR 122   5.778 -11.866  -1.066
  903    HE1  TYR 122           HE2      TYR 122  10.260 -10.411  -2.446
  904    HE2  TYR 122           HE1      TYR 122   7.019 -10.261   0.316
  905    HH   TYR 122           HH       TYR 122   9.396  -9.614   0.699
  906    H    GLY 123           HN       GLY 123   3.670 -11.974  -6.060
  907    HA2  GLY 123           HA2      GLY 123   2.065 -14.135  -5.667
  908    HA3  GLY 123           HA1      GLY 123   2.189 -13.322  -7.214
  909    HA   PRO 124           HA       PRO 124   4.071 -17.126  -8.620
  910    HB2  PRO 124           HB2      PRO 124   5.075 -16.182 -11.008
  911    HB3  PRO 124           HB1      PRO 124   3.393 -16.640 -10.742
  912    HG2  PRO 124           HG2      PRO 124   4.484 -14.013 -11.208
  913    HG3  PRO 124           HG1      PRO 124   2.789 -14.491 -11.055
  914    HD2  PRO 124           HD2      PRO 124   4.549 -13.241  -9.078
  915    HD3  PRO 124           HD1      PRO 124   2.780 -13.380  -9.081
  916    H    GLN 125           HN       GLN 125   5.662 -14.903  -7.138
  917    HA   GLN 125           HA       GLN 125   8.345 -15.378  -8.242
  918    HB2  GLN 125           HB2      GLN 125   7.418 -13.282  -6.264
  919    HB3  GLN 125           HB1      GLN 125   8.987 -13.356  -7.059
  920    HG2  GLN 125           HG2      GLN 125   7.995 -12.883  -9.183
  921    HG3  GLN 125           HG1      GLN 125   6.377 -13.014  -8.509
  922   HE21  GLN 125          HE21      GLN 125   5.536 -11.350  -7.335
  923   HE22  GLN 125          HE22      GLN 125   6.271  -9.794  -7.220
  924    H    GLY 126           HN       GLY 126   6.505 -15.226  -5.255
  925    HA2  GLY 126           HA2      GLY 126   6.728 -16.400  -3.307
  926    HA3  GLY 126           HA1      GLY 126   8.083 -17.272  -4.012
  927    H    SER 127           HN       SER 127   7.635 -15.933  -1.411
  928    HA   SER 127           HA       SER 127   9.460 -13.735  -1.478
  929    HB2  SER 127           HB2      SER 127   7.553 -13.295  -0.190
  930    HB3  SER 127           HB1      SER 127   7.628 -14.846   0.627
  931    HG   SER 127           HG       SER 127   8.906 -12.465   1.190
  932    H    ARG 128           HN       ARG 128  11.039 -13.510   0.388
  933    HA   ARG 128           HA       ARG 128  13.084 -15.306  -0.249
  934    HB2  ARG 128           HB2      ARG 128  14.466 -14.009   1.256
  935    HB3  ARG 128           HB1      ARG 128  13.461 -12.952   0.282
  936    HG2  ARG 128           HG2      ARG 128  11.901 -12.774   2.229
  937    HG3  ARG 128           HG1      ARG 128  13.093 -13.658   3.182
  938    HD2  ARG 128           HD2      ARG 128  13.464 -10.989   1.828
  939    HD3  ARG 128           HD1      ARG 128  13.371 -11.293   3.563
  940    HE   ARG 128           HE       ARG 128  15.507 -12.762   2.352
  941   HH11  ARG 128          HH11      ARG 128  14.613  -9.577   3.529
  942   HH12  ARG 128          HH12      ARG 128  16.248  -9.075   3.812
  943   HH21  ARG 128          HH21      ARG 128  17.658 -12.129   2.754
  944   HH22  ARG 128          HH22      ARG 128  17.988 -10.542   3.376
  945    H    SER 129           HN       SER 129  10.810 -15.362   2.384
  946    HA   SER 129           HA       SER 129  12.289 -17.646   3.468
  947    HB2  SER 129           HB2      SER 129  11.728 -15.834   5.101
  948    HB3  SER 129           HB1      SER 129  10.018 -16.166   4.821
  949    HG   SER 129           HG       SER 129  11.982 -17.856   5.974
  950    HA   PRO 130           HA       PRO 130   8.218 -19.556   2.123
  951    HB2  PRO 130           HB2      PRO 130   5.960 -17.863   2.245
  952    HB3  PRO 130           HB1      PRO 130   6.416 -19.061   3.444
  953    HG2  PRO 130           HG2      PRO 130   6.358 -16.334   3.871
  954    HG3  PRO 130           HG1      PRO 130   7.283 -17.482   4.841
  955    HD2  PRO 130           HD2      PRO 130   8.192 -15.782   2.535
  956    HD3  PRO 130           HD1      PRO 130   8.996 -16.077   4.092
  957    H    TYR 131           HN       TYR 131   8.293 -19.746  -0.152
  958    HA   TYR 131           HA       TYR 131   7.567 -17.809  -1.973
  959    HB2  TYR 131           HB2      TYR 131   8.237 -19.974  -2.778
  960    HB3  TYR 131           HB1      TYR 131   6.908 -20.766  -1.942
  961    HD1  TYR 131           HD1      TYR 131   4.617 -20.585  -2.831
  962    HD2  TYR 131           HD2      TYR 131   7.913 -18.879  -4.893
  963    HE1  TYR 131           HE1      TYR 131   3.239 -20.387  -4.859
  964    HE2  TYR 131           HE2      TYR 131   6.557 -18.686  -6.925
  965    HH   TYR 131           HH       TYR 131   3.163 -19.116  -6.922
  966    H    ILE 132           HN       ILE 132   6.039 -16.394  -1.270
  967    HA   ILE 132           HA       ILE 132   3.622 -17.082   0.008
  968    HB   ILE 132           HB       ILE 132   4.403 -14.630  -1.600
  969   HG12  ILE 132          HG12      ILE 132   5.020 -13.637   0.325
  970   HG13  ILE 132          HG11      ILE 132   3.548 -14.144   1.128
  971   HG21  ILE 132          HG21      ILE 132   1.998 -15.043  -1.800
  972   HG22  ILE 132          HG22      ILE 132   2.335 -13.597  -0.847
  973   HG23  ILE 132          HG23      ILE 132   1.878 -15.098  -0.039
  974   HD11  ILE 132          HD11      ILE 132   6.105 -15.681   0.916
  975   HD12  ILE 132          HD12      ILE 132   4.609 -16.309   1.617
  976   HD13  ILE 132          HD13      ILE 132   5.417 -14.919   2.349
  977    HA   PRO 133           HA       PRO 133   1.438 -18.946  -3.468
  978    HB2  PRO 133           HB2      PRO 133  -1.101 -18.216  -2.540
  979    HB3  PRO 133           HB1      PRO 133  -0.256 -19.722  -2.191
  980    HG2  PRO 133           HG2      PRO 133  -0.496 -17.260  -0.537
  981    HG3  PRO 133           HG1      PRO 133  -0.425 -18.958  -0.031
  982    HD2  PRO 133           HD2      PRO 133   1.691 -17.322   0.234
  983    HD3  PRO 133           HD1      PRO 133   1.885 -19.038  -0.187
  984    HA   PRO 134           HA       PRO 134   0.853 -15.601  -6.280
  985    HB2  PRO 134           HB2      PRO 134  -1.304 -17.260  -7.474
  986    HB3  PRO 134           HB1      PRO 134   0.117 -16.530  -8.234
  987    HG2  PRO 134           HG2      PRO 134   0.033 -19.152  -7.740
  988    HG3  PRO 134           HG1      PRO 134   1.532 -18.230  -7.506
  989    HD2  PRO 134           HD2      PRO 134  -0.428 -19.221  -5.470
  990    HD3  PRO 134           HD1      PRO 134   1.347 -19.160  -5.392
  991    H    HIS 135           HN       HIS 135  -0.263 -13.837  -6.354
  992    HA   HIS 135           HA       HIS 135  -1.692 -12.213  -5.800
  993    HB2  HIS 135           HB2      HIS 135  -3.839 -12.322  -6.697
  994    HB3  HIS 135           HB1      HIS 135  -2.896 -13.431  -7.676
  995    HD1  HIS 135           HD1      HIS 135  -5.652 -13.313  -5.160
  996    HD2  HIS 135           HD2      HIS 135  -3.783 -16.091  -7.625
  997    HE1  HIS 135           HE1      HIS 135  -7.117 -15.357  -5.111
  998    HE2  HIS 135           HE2      HIS 135  -6.107 -16.908  -6.819
  999    H    ALA 136           HN       ALA 136  -1.035 -14.231  -3.621
 1000    HA   ALA 136           HA       ALA 136  -3.240 -13.938  -1.802
 1001    HB1  ALA 136           HB1      ALA 136  -1.688 -14.738  -0.098
 1002    HB2  ALA 136           HB2      ALA 136  -0.344 -14.567  -1.228
 1003    HB3  ALA 136           HB3      ALA 136  -1.613 -15.751  -1.538
 1004    H    ALA 137           HN       ALA 137  -3.580 -12.305  -0.344
 1005    HA   ALA 137           HA       ALA 137  -2.391  -9.815  -1.138
 1006    HB1  ALA 137           HB1      ALA 137  -4.784  -9.987  -0.629
 1007    HB2  ALA 137           HB2      ALA 137  -3.986  -8.785   0.390
 1008    HB3  ALA 137           HB3      ALA 137  -4.400 -10.366   1.049
 1009    H    LEU 138           HN       LEU 138  -0.519  -9.151  -0.391
 1010    HA   LEU 138           HA       LEU 138   0.490 -10.121   2.154
 1011    HB2  LEU 138           HB2      LEU 138   1.644  -9.450  -0.328
 1012    HB3  LEU 138           HB1      LEU 138   2.250  -8.282   0.830
 1013    HG   LEU 138           HG       LEU 138   3.131 -10.040   2.229
 1014   HD11  LEU 138          HD11      LEU 138   1.387 -11.669   1.916
 1015   HD12  LEU 138          HD12      LEU 138   2.957 -12.387   1.548
 1016   HD13  LEU 138          HD13      LEU 138   1.875 -11.907   0.240
 1017   HD21  LEU 138          HD21      LEU 138   3.825 -10.582  -0.646
 1018   HD22  LEU 138          HD22      LEU 138   4.817 -10.953   0.765
 1019   HD23  LEU 138          HD23      LEU 138   4.490  -9.275   0.330
 1020    H    CYS 139           HN       CYS 139   0.686  -8.896   3.936
 1021    HA   CYS 139           HA       CYS 139   0.034  -6.030   3.704
 1022    HB2  CYS 139           HB2      CYS 139  -1.634  -7.595   4.887
 1023    HB3  CYS 139           HB1      CYS 139  -0.416  -7.706   6.152
 1024    HG   CYS 139           HG       CYS 139  -2.664  -5.356   5.635
 1025    H    LEU 140           HN       LEU 140   1.959  -5.067   3.783
 1026    HA   LEU 140           HA       LEU 140   3.975  -6.097   5.664
 1027    HB2  LEU 140           HB2      LEU 140   5.631  -5.081   4.116
 1028    HB3  LEU 140           HB1      LEU 140   4.715  -6.409   3.423
 1029    HG   LEU 140           HG       LEU 140   3.238  -4.184   2.739
 1030   HD11  LEU 140          HD11      LEU 140   4.835  -2.614   1.776
 1031   HD12  LEU 140          HD12      LEU 140   6.175  -3.554   2.438
 1032   HD13  LEU 140          HD13      LEU 140   5.050  -2.737   3.523
 1033   HD21  LEU 140          HD21      LEU 140   4.050  -4.617   0.480
 1034   HD22  LEU 140          HD22      LEU 140   3.702  -6.122   1.332
 1035   HD23  LEU 140          HD23      LEU 140   5.371  -5.588   1.131
 1036    H    GLU 141           HN       GLU 141   4.955  -4.745   7.069
 1037    HA   GLU 141           HA       GLU 141   3.924  -1.994   7.166
 1038    HB2  GLU 141           HB2      GLU 141   3.386  -3.373   9.092
 1039    HB3  GLU 141           HB1      GLU 141   5.074  -3.800   9.299
 1040    HG2  GLU 141           HG2      GLU 141   5.615  -1.538   9.937
 1041    HG3  GLU 141           HG1      GLU 141   3.951  -1.028   9.611
 1042    H    VAL 142           HN       VAL 142   5.325  -0.496   6.423
 1043    HA   VAL 142           HA       VAL 142   8.188  -1.128   6.612
 1044    HB   VAL 142           HB       VAL 142   8.423   0.454   4.611
 1045   HG11  VAL 142          HG11      VAL 142   7.049  -2.212   4.293
 1046   HG12  VAL 142          HG12      VAL 142   8.781  -1.946   4.504
 1047   HG13  VAL 142          HG13      VAL 142   7.974  -1.372   3.046
 1048   HG21  VAL 142          HG21      VAL 142   6.159   1.387   4.679
 1049   HG22  VAL 142          HG22      VAL 142   5.487  -0.212   4.361
 1050   HG23  VAL 142          HG23      VAL 142   6.475   0.589   3.139
 1051    H    THR 143           HN       THR 143   9.243   0.057   8.002
 1052    HA   THR 143           HA       THR 143   8.524   2.820   8.605
 1053    HB   THR 143           HB       THR 143  11.029   1.400   9.531
 1054    HG1  THR 143           HG1      THR 143   8.340   1.087  10.438
 1055   HG21  THR 143          HG21      THR 143  10.733   2.839  11.501
 1056   HG22  THR 143          HG22      THR 143   9.271   3.524  10.789
 1057   HG23  THR 143          HG23      THR 143  10.835   3.788  10.018
 1058    H    LEU 144           HN       LEU 144   9.116   4.300   7.085
 1059    HA   LEU 144           HA       LEU 144  11.657   4.036   5.701
 1060    HB2  LEU 144           HB2      LEU 144   9.682   5.001   4.551
 1061    HB3  LEU 144           HB1      LEU 144   9.666   6.314   5.711
 1062    HG   LEU 144           HG       LEU 144  11.834   7.089   4.902
 1063   HD11  LEU 144          HD11      LEU 144  12.812   6.089   2.879
 1064   HD12  LEU 144          HD12      LEU 144  11.629   4.784   2.972
 1065   HD13  LEU 144          HD13      LEU 144  12.822   4.988   4.255
 1066   HD21  LEU 144          HD21      LEU 144   9.886   6.630   2.648
 1067   HD22  LEU 144          HD22      LEU 144  11.115   7.893   2.735
 1068   HD23  LEU 144          HD23      LEU 144   9.759   7.903   3.861
 1069    H    LYS 145           HN       LYS 145  13.243   4.172   7.118
 1070    HA   LYS 145           HA       LYS 145  13.085   6.053   9.318
 1071    HB2  LYS 145           HB2      LYS 145  15.350   4.154   8.724
 1072    HB3  LYS 145           HB1      LYS 145  14.874   4.832  10.275
 1073    HG2  LYS 145           HG2      LYS 145  12.884   3.485  10.326
 1074    HG3  LYS 145           HG1      LYS 145  13.209   2.895   8.695
 1075    HD2  LYS 145           HD2      LYS 145  14.954   2.397  11.111
 1076    HD3  LYS 145           HD1      LYS 145  13.819   1.239  10.399
 1077    HE2  LYS 145           HE2      LYS 145  15.054   1.051   8.438
 1078    HE3  LYS 145           HE1      LYS 145  16.018   2.491   8.775
 1079    HZ1  LYS 145           HZ1      LYS 145  17.453   0.760   9.279
 1080    HZ2  LYS 145           HZ2      LYS 145  16.231  -0.203   9.961
 1081    HZ3  LYS 145           HZ3      LYS 145  16.818   1.145  10.807
 1082    H    THR 146           HN       THR 146  14.867   5.556   6.340
 1083    HA   THR 146           HA       THR 146  16.090   8.175   6.632
 1084    HB   THR 146           HB       THR 146  17.817   5.793   5.996
 1085    HG1  THR 146           HG1      THR 146  17.044   6.842   8.480
 1086   HG21  THR 146          HG21      THR 146  19.659   7.331   6.517
 1087   HG22  THR 146          HG22      THR 146  18.493   8.607   6.872
 1088   HG23  THR 146          HG23      THR 146  18.635   7.974   5.233
 1089    H    ALA 147           HN       ALA 147  16.870   9.053   4.677
 1090    HA   ALA 147           HA       ALA 147  16.648   7.420   2.257
 1091    HB1  ALA 147           HB1      ALA 147  15.587   9.251   1.045
 1092    HB2  ALA 147           HB2      ALA 147  15.583  10.239   2.505
 1093    HB3  ALA 147           HB3      ALA 147  14.592   8.784   2.425
 1094    H    VAL 148           HN       VAL 148  18.487   7.581   1.063
 1095    HA   VAL 148           HA       VAL 148  20.247   9.874   1.615
 1096    HB   VAL 148           HB       VAL 148  21.279   7.406   0.322
 1097   HG11  VAL 148          HG11      VAL 148  22.647   9.398   0.529
 1098   HG12  VAL 148          HG12      VAL 148  23.324   8.051   1.443
 1099   HG13  VAL 148          HG13      VAL 148  22.465   9.343   2.281
 1100   HG21  VAL 148          HG21      VAL 148  21.836   6.434   2.544
 1101   HG22  VAL 148          HG22      VAL 148  20.104   6.449   2.207
 1102   HG23  VAL 148          HG23      VAL 148  20.801   7.650   3.294
 1103    H    ASP 149           HN       ASP 149  20.089  11.284  -0.002
 1104    HA   ASP 149           HA       ASP 149  19.437  10.303  -2.644
 1105    HB2  ASP 149           HB2      ASP 149  19.157  12.649  -3.233
 1106    HB3  ASP 149           HB1      ASP 149  18.282  12.263  -1.762
 1107    H    LEU 150           HN       LEU 150  20.981   9.608  -3.895
 1108    HA   LEU 150           HA       LEU 150  23.457  11.100  -4.067
 1109    HB2  LEU 150           HB2      LEU 150  24.859   9.244  -3.770
 1110    HB3  LEU 150           HB1      LEU 150  23.682   9.179  -2.486
 1111    HG   LEU 150           HG       LEU 150  23.984   6.959  -3.105
 1112   HD11  LEU 150          HD11      LEU 150  21.608   7.558  -2.955
 1113   HD12  LEU 150          HD12      LEU 150  21.922   6.165  -3.988
 1114   HD13  LEU 150          HD13      LEU 150  21.572   7.734  -4.711
 1115   HD21  LEU 150          HD21      LEU 150  25.261   7.255  -5.117
 1116   HD22  LEU 150          HD22      LEU 150  23.823   7.779  -5.995
 1117   HD23  LEU 150          HD23      LEU 150  23.943   6.120  -5.412
 1118    H    GLU 151           HN       GLU 151  20.929   9.690  -5.542
 1119    HA   GLU 151           HA       GLU 151  22.266   9.113  -8.075
 1120    HB2  GLU 151           HB2      GLU 151  20.727   7.422  -7.343
 1121    HB3  GLU 151           HB1      GLU 151  19.479   8.614  -7.022
 1122    HG2  GLU 151           HG2      GLU 151  18.798   7.541  -8.970
 1123    HG3  GLU 151           HG1      GLU 151  19.494   9.077  -9.515
 1124    H    HIS 152           HN       HIS 152  19.372  10.823  -6.942
 1125    HA   HIS 152           HA       HIS 152  18.375  12.770  -7.510
 1126    HB2  HIS 152           HB2      HIS 152  21.023  13.422  -8.823
 1127    HB3  HIS 152           HB1      HIS 152  19.698  14.557  -8.630
 1128    HD1  HIS 152           HD1      HIS 152  19.194  15.382  -6.193
 1129    HD2  HIS 152           HD2      HIS 152  22.637  13.084  -6.597
 1130    HE1  HIS 152           HE1      HIS 152  20.512  15.760  -4.091
 1131    HE2  HIS 152           HE2      HIS 152  22.646  14.450  -4.397
 1132    H    HIS 153           HN       HIS 153  20.327  12.957 -10.386
 1133    HA   HIS 153           HA       HIS 153  18.738  11.501 -12.164
 1134    HB2  HIS 153           HB2      HIS 153  17.133  13.407 -11.432
 1135    HB3  HIS 153           HB1      HIS 153  18.165  14.450 -12.402
 1136    HD1  HIS 153           HD1      HIS 153  17.431  14.707 -14.755
 1137    HD2  HIS 153           HD2      HIS 153  16.124  11.128 -13.082
 1138    HE1  HIS 153           HE1      HIS 153  16.004  13.612 -16.513
 1139    HE2  HIS 153           HE2      HIS 153  15.413  11.356 -15.557
 1140    H    HIS 154           HN       HIS 154  20.233  11.061 -13.656
 1141    HA   HIS 154           HA       HIS 154  22.315  13.083 -14.121
 1142    HB2  HIS 154           HB2      HIS 154  22.325  10.087 -14.506
 1143    HB3  HIS 154           HB1      HIS 154  23.616  11.132 -15.090
 1144    HD1  HIS 154           HD1      HIS 154  22.653   9.183 -12.212
 1145    HD2  HIS 154           HD2      HIS 154  24.829  12.673 -12.851
 1146    HE1  HIS 154           HE1      HIS 154  23.975   9.557 -10.098
 1147    HE2  HIS 154           HE2      HIS 154  25.390  11.590 -10.565
 1148    H    HIS 155           HN       HIS 155  21.838  14.330 -15.759
 1149    HA   HIS 155           HA       HIS 155  20.286  13.429 -18.006
 1150    HB2  HIS 155           HB2      HIS 155  19.772  15.612 -17.394
 1151    HB3  HIS 155           HB1      HIS 155  21.450  16.033 -17.088
 1152    HD1  HIS 155           HD1      HIS 155  19.244  15.247 -20.120
 1153    HD2  HIS 155           HD2      HIS 155  22.540  17.541 -19.022
 1154    HE1  HIS 155           HE1      HIS 155  19.828  16.622 -22.144
 1155    HE2  HIS 155           HE2      HIS 155  21.680  18.153 -21.378
 1156    H    HIS 156           HN       HIS 156  21.135  12.334 -19.621
 1157    HA   HIS 156           HA       HIS 156  23.642  13.286 -20.804
 1158    HB2  HIS 156           HB2      HIS 156  22.998  10.451 -20.032
 1159    HB3  HIS 156           HB1      HIS 156  24.062  10.776 -21.397
 1160    HD1  HIS 156           HD1      HIS 156  24.228  10.063 -17.927
 1161    HD2  HIS 156           HD2      HIS 156  26.277  12.634 -20.482
 1162    HE1  HIS 156           HE1      HIS 156  26.375  10.640 -16.750
 1163    HE2  HIS 156           HE2      HIS 156  27.682  11.997 -18.411
 1164    H    HIS 157           HN       HIS 157  23.686  13.273 -23.013
 1165    HA   HIS 157           HA       HIS 157  21.798  11.850 -24.600
 1166    HB2  HIS 157           HB2      HIS 157  20.367  13.715 -23.709
 1167    HB3  HIS 157           HB1      HIS 157  21.445  14.854 -24.508
 1168    HD1  HIS 157           HD1      HIS 157  21.144  15.207 -27.004
 1169    HD2  HIS 157           HD2      HIS 157  18.776  12.146 -25.473
 1170    HE1  HIS 157           HE1      HIS 157  19.548  14.596 -28.854
 1171    HE2  HIS 157           HE2      HIS 157  18.302  12.580 -27.979
  Start of MODEL    7
    1    H1   MET   1           HT1      MET   1 -38.687  45.160 -36.927
    2    H2   MET   1           HT2      MET   1 -38.036  44.197 -38.164
    3    H3   MET   1           HT3      MET   1 -37.068  44.668 -36.864
    4    HA   MET   1           HA       MET   1 -38.305  43.360 -35.344
    5    HB2  MET   1           HB2      MET   1 -40.124  41.876 -36.187
    6    HB3  MET   1           HB1      MET   1 -40.514  43.587 -36.282
    7    HG2  MET   1           HG2      MET   1 -39.923  43.546 -38.683
    8    HG3  MET   1           HG1      MET   1 -39.652  41.811 -38.554
    9    HE1  MET   1           HE1      MET   1 -43.282  40.606 -37.530
   10    HE2  MET   1           HE2      MET   1 -41.995  41.121 -36.436
   11    HE3  MET   1           HE3      MET   1 -41.621  40.091 -37.816
   12    H    GLY   2           HN       GLY   2 -36.856  41.869 -34.871
   13    HA2  GLY   2           HA2      GLY   2 -36.172  39.820 -36.799
   14    HA3  GLY   2           HA1      GLY   2 -34.873  40.945 -36.444
   15    H    GLN   3           HN       GLN   3 -33.486  39.737 -35.352
   16    HA   GLN   3           HA       GLN   3 -32.531  38.481 -33.735
   17    HB2  GLN   3           HB2      GLN   3 -33.482  40.065 -32.138
   18    HB3  GLN   3           HB1      GLN   3 -35.007  39.191 -32.144
   19    HG2  GLN   3           HG2      GLN   3 -33.765  38.679 -30.145
   20    HG3  GLN   3           HG1      GLN   3 -33.889  37.244 -31.160
   21   HE21  GLN   3          HE21      GLN   3 -32.051  36.370 -32.062
   22   HE22  GLN   3          HE22      GLN   3 -30.456  36.880 -31.618
   23    HA   PRO   4           HA       PRO   4 -34.779  34.723 -34.925
   24    HB2  PRO   4           HB2      PRO   4 -32.612  33.350 -35.704
   25    HB3  PRO   4           HB1      PRO   4 -33.318  34.607 -36.726
   26    HG2  PRO   4           HG2      PRO   4 -30.937  34.753 -34.912
   27    HG3  PRO   4           HG1      PRO   4 -31.123  35.377 -36.562
   28    HD2  PRO   4           HD2      PRO   4 -31.376  36.917 -34.314
   29    HD3  PRO   4           HD1      PRO   4 -32.196  37.272 -35.848
   30    HA   PRO   5           HA       PRO   5 -34.231  32.020 -31.397
   31    HB2  PRO   5           HB2      PRO   5 -33.258  29.939 -33.304
   32    HB3  PRO   5           HB1      PRO   5 -34.488  29.816 -32.041
   33    HG2  PRO   5           HG2      PRO   5 -35.196  30.004 -34.594
   34    HG3  PRO   5           HG1      PRO   5 -36.110  30.857 -33.334
   35    HD2  PRO   5           HD2      PRO   5 -34.175  31.928 -35.332
   36    HD3  PRO   5           HD1      PRO   5 -35.626  32.685 -34.640
   37    H    ALA   6           HN       ALA   6 -32.613  31.954 -29.981
   38    HA   ALA   6           HA       ALA   6 -29.860  32.093 -30.985
   39    HB1  ALA   6           HB1      ALA   6 -30.625  33.931 -29.539
   40    HB2  ALA   6           HB2      ALA   6 -29.285  33.037 -28.817
   41    HB3  ALA   6           HB3      ALA   6 -30.935  32.773 -28.245
   42    H    GLU   7           HN       GLU   7 -28.206  31.053 -29.574
   43    HA   GLU   7           HA       GLU   7 -27.242  29.236 -28.667
   44    HB2  GLU   7           HB2      GLU   7 -29.996  28.943 -27.514
   45    HB3  GLU   7           HB1      GLU   7 -28.754  27.726 -27.226
   46    HG2  GLU   7           HG2      GLU   7 -27.480  29.116 -25.950
   47    HG3  GLU   7           HG1      GLU   7 -28.064  30.570 -26.751
   48    H    GLU   8           HN       GLU   8 -26.504  27.615 -29.751
   49    HA   GLU   8           HA       GLU   8 -27.815  26.713 -32.086
   50    HB2  GLU   8           HB2      GLU   8 -25.380  25.508 -30.767
   51    HB3  GLU   8           HB1      GLU   8 -25.846  25.368 -32.456
   52    HG2  GLU   8           HG2      GLU   8 -24.957  27.866 -31.035
   53    HG3  GLU   8           HG1      GLU   8 -24.042  26.946 -32.227
   54    H    ALA   9           HN       ALA   9 -27.913  25.632 -28.866
   55    HA   ALA   9           HA       ALA   9 -28.827  23.849 -27.802
   56    HB1  ALA   9           HB1      ALA   9 -30.829  24.439 -29.062
   57    HB2  ALA   9           HB2      ALA   9 -30.695  22.686 -28.908
   58    HB3  ALA   9           HB3      ALA   9 -30.273  23.476 -30.427
   59    H    GLU  10           HN       GLU  10 -26.329  23.503 -28.805
   60    HA   GLU  10           HA       GLU  10 -25.896  21.248 -30.402
   61    HB2  GLU  10           HB2      GLU  10 -23.627  21.240 -29.524
   62    HB3  GLU  10           HB1      GLU  10 -24.136  22.882 -29.876
   63    HG2  GLU  10           HG2      GLU  10 -24.004  21.611 -27.150
   64    HG3  GLU  10           HG1      GLU  10 -22.858  22.773 -27.813
   65    H    GLN  11           HN       GLN  11 -26.335  21.568 -26.913
   66    HA   GLN  11           HA       GLN  11 -26.520  18.629 -26.742
   67    HB2  GLN  11           HB2      GLN  11 -26.127  20.608 -24.490
   68    HB3  GLN  11           HB1      GLN  11 -26.129  18.855 -24.348
   69    HG2  GLN  11           HG2      GLN  11 -24.127  18.793 -25.804
   70    HG3  GLN  11           HG1      GLN  11 -24.106  20.557 -25.781
   71   HE21  GLN  11          HE21      GLN  11 -22.111  18.657 -24.816
   72   HE22  GLN  11          HE22      GLN  11 -21.875  19.024 -23.145
   73    HA   PRO  12           HA       PRO  12 -30.891  19.922 -26.420
   74    HB2  PRO  12           HB2      PRO  12 -31.388  17.152 -27.242
   75    HB3  PRO  12           HB1      PRO  12 -31.886  18.657 -28.024
   76    HG2  PRO  12           HG2      PRO  12 -30.006  17.043 -29.083
   77    HG3  PRO  12           HG1      PRO  12 -29.952  18.808 -29.264
   78    HD2  PRO  12           HD2      PRO  12 -28.419  17.045 -27.379
   79    HD3  PRO  12           HD1      PRO  12 -27.856  18.442 -28.322
   80    H    GLY  13           HN       GLY  13 -29.227  17.083 -25.220
   81    HA2  GLY  13           HA2      GLY  13 -29.338  16.056 -23.163
   82    HA3  GLY  13           HA1      GLY  13 -30.482  17.287 -22.655
   83    H    ALA  14           HN       ALA  14 -32.697  17.026 -23.247
   84    HA   ALA  14           HA       ALA  14 -33.825  14.798 -24.501
   85    HB1  ALA  14           HB1      ALA  14 -33.839  14.547 -21.487
   86    HB2  ALA  14           HB2      ALA  14 -32.888  13.543 -22.578
   87    HB3  ALA  14           HB3      ALA  14 -34.650  13.474 -22.632
   88    H    LEU  15           HN       LEU  15 -34.480  16.509 -21.449
   89    HA   LEU  15           HA       LEU  15 -36.449  18.218 -22.627
   90    HB2  LEU  15           HB2      LEU  15 -37.644  15.992 -22.441
   91    HB3  LEU  15           HB1      LEU  15 -37.470  16.124 -20.703
   92    HG   LEU  15           HG       LEU  15 -38.859  18.296 -22.237
   93   HD11  LEU  15          HD11      LEU  15 -40.985  17.117 -21.830
   94   HD12  LEU  15          HD12      LEU  15 -40.079  15.704 -21.290
   95   HD13  LEU  15          HD13      LEU  15 -39.940  16.254 -22.958
   96   HD21  LEU  15          HD21      LEU  15 -38.338  18.718 -19.894
   97   HD22  LEU  15          HD22      LEU  15 -39.146  17.218 -19.433
   98   HD23  LEU  15          HD23      LEU  15 -40.077  18.545 -20.127
   99    H    ALA  16           HN       ALA  16 -35.579  16.639 -19.555
  100    HA   ALA  16           HA       ALA  16 -35.065  19.297 -18.441
  101    HB1  ALA  16           HB1      ALA  16 -36.221  18.721 -16.350
  102    HB2  ALA  16           HB2      ALA  16 -36.719  17.180 -17.050
  103    HB3  ALA  16           HB3      ALA  16 -37.328  18.691 -17.725
  104    H    ARG  17           HN       ARG  17 -35.199  16.405 -16.501
  105    HA   ARG  17           HA       ARG  17 -33.643  15.251 -15.330
  106    HB2  ARG  17           HB2      ARG  17 -32.023  15.744 -17.831
  107    HB3  ARG  17           HB1      ARG  17 -31.510  14.679 -16.526
  108    HG2  ARG  17           HG2      ARG  17 -33.917  14.364 -18.306
  109    HG3  ARG  17           HG1      ARG  17 -32.470  13.354 -18.260
  110    HD2  ARG  17           HD2      ARG  17 -34.493  13.668 -16.044
  111    HD3  ARG  17           HD1      ARG  17 -34.337  12.277 -17.115
  112    HE   ARG  17           HE       ARG  17 -31.903  12.832 -15.719
  113   HH11  ARG  17          HH11      ARG  17 -35.022  11.257 -15.490
  114   HH12  ARG  17          HH12      ARG  17 -34.552  10.224 -14.171
  115   HH21  ARG  17          HH21      ARG  17 -31.279  11.482 -13.980
  116   HH22  ARG  17          HH22      ARG  17 -32.413  10.330 -13.335
  117    H    GLU  18           HN       GLU  18 -33.708  18.272 -15.260
  118    HA   GLU  18           HA       GLU  18 -31.013  18.988 -14.500
  119    HB2  GLU  18           HB2      GLU  18 -32.028  21.201 -14.034
  120    HB3  GLU  18           HB1      GLU  18 -32.391  20.619 -15.657
  121    HG2  GLU  18           HG2      GLU  18 -34.555  19.698 -14.473
  122    HG3  GLU  18           HG1      GLU  18 -34.185  20.967 -13.308
  123    H    PHE  19           HN       PHE  19 -33.823  17.730 -13.081
  124    HA   PHE  19           HA       PHE  19 -34.348  16.981 -11.015
  125    HB2  PHE  19           HB2      PHE  19 -31.798  16.491 -10.956
  126    HB3  PHE  19           HB1      PHE  19 -31.696  17.924  -9.943
  127    HD1  PHE  19           HD2      PHE  19 -33.193  14.556 -10.193
  128    HD2  PHE  19           HD1      PHE  19 -32.242  17.836  -7.654
  129    HE1  PHE  19           HE2      PHE  19 -33.736  13.186  -8.224
  130    HE2  PHE  19           HE1      PHE  19 -32.786  16.475  -5.679
  131    HZ   PHE  19           HZ       PHE  19 -33.536  14.142  -5.963
  132    H    LEU  20           HN       LEU  20 -34.636  17.840  -8.687
  133    HA   LEU  20           HA       LEU  20 -35.585  20.563  -8.913
  134    HB2  LEU  20           HB2      LEU  20 -35.737  18.629  -6.590
  135    HB3  LEU  20           HB1      LEU  20 -36.563  20.174  -6.688
  136    HG   LEU  20           HG       LEU  20 -37.065  17.756  -8.421
  137   HD11  LEU  20          HD11      LEU  20 -39.265  17.773  -7.316
  138   HD12  LEU  20          HD12      LEU  20 -38.724  19.099  -6.286
  139   HD13  LEU  20          HD13      LEU  20 -37.945  17.521  -6.177
  140   HD21  LEU  20          HD21      LEU  20 -38.893  19.067  -9.391
  141   HD22  LEU  20          HD22      LEU  20 -37.324  19.805  -9.711
  142   HD23  LEU  20          HD23      LEU  20 -38.376  20.477  -8.464
  143    H    ALA  21           HN       ALA  21 -33.909  21.933  -8.905
  144    HA   ALA  21           HA       ALA  21 -32.252  23.263  -8.144
  145    HB1  ALA  21           HB1      ALA  21 -31.804  23.462  -5.756
  146    HB2  ALA  21           HB2      ALA  21 -32.717  21.985  -5.445
  147    HB3  ALA  21           HB3      ALA  21 -33.546  23.418  -6.053
  148    H    ALA  22           HN       ALA  22 -31.342  20.865  -5.768
  149    HA   ALA  22           HA       ALA  22 -29.429  19.651  -5.488
  150    HB1  ALA  22           HB1      ALA  22 -30.668  18.267  -7.126
  151    HB2  ALA  22           HB2      ALA  22 -28.918  18.092  -7.266
  152    HB3  ALA  22           HB3      ALA  22 -29.802  19.081  -8.429
  153    H    MET  23           HN       MET  23 -27.551  19.138  -7.781
  154    HA   MET  23           HA       MET  23 -25.761  19.976  -8.882
  155    HB2  MET  23           HB2      MET  23 -27.088  22.647  -8.420
  156    HB3  MET  23           HB1      MET  23 -25.637  22.416  -9.382
  157    HG2  MET  23           HG2      MET  23 -26.899  20.914 -10.875
  158    HG3  MET  23           HG1      MET  23 -28.354  21.249  -9.937
  159    HE1  MET  23           HE1      MET  23 -28.214  21.620 -13.075
  160    HE2  MET  23           HE2      MET  23 -29.007  23.179 -13.287
  161    HE3  MET  23           HE3      MET  23 -29.656  22.010 -12.136
  162    H    GLU  24           HN       GLU  24 -26.549  21.125  -5.739
  163    HA   GLU  24           HA       GLU  24 -23.822  21.976  -5.195
  164    HB2  GLU  24           HB2      GLU  24 -26.233  21.780  -3.369
  165    HB3  GLU  24           HB1      GLU  24 -24.667  22.436  -2.911
  166    HG2  GLU  24           HG2      GLU  24 -26.540  23.553  -4.986
  167    HG3  GLU  24           HG1      GLU  24 -26.230  24.216  -3.382
  168    HA   PRO  25           HA       PRO  25 -23.108  17.788  -3.673
  169    HB2  PRO  25           HB2      PRO  25 -20.548  17.639  -4.598
  170    HB3  PRO  25           HB1      PRO  25 -21.960  17.349  -5.617
  171    HG2  PRO  25           HG2      PRO  25 -20.075  19.560  -5.692
  172    HG3  PRO  25           HG1      PRO  25 -21.347  19.150  -6.852
  173    HD2  PRO  25           HD2      PRO  25 -21.370  21.131  -4.687
  174    HD3  PRO  25           HD1      PRO  25 -22.466  20.969  -6.074
  175    H    GLU  26           HN       GLU  26 -23.053  18.202  -1.445
  176    HA   GLU  26           HA       GLU  26 -20.817  19.612  -0.293
  177    HB2  GLU  26           HB2      GLU  26 -21.862  19.140   1.861
  178    HB3  GLU  26           HB1      GLU  26 -23.040  19.793   0.732
  179    HG2  GLU  26           HG2      GLU  26 -23.829  17.476   0.307
  180    HG3  GLU  26           HG1      GLU  26 -22.725  16.921   1.564
  181    HA   PRO  27           HA       PRO  27 -18.331  15.935  -0.030
  182    HB2  PRO  27           HB2      PRO  27 -16.425  17.505   1.491
  183    HB3  PRO  27           HB1      PRO  27 -16.285  16.893  -0.158
  184    HG2  PRO  27           HG2      PRO  27 -16.531  19.542   0.445
  185    HG3  PRO  27           HG1      PRO  27 -17.086  18.831  -1.081
  186    HD2  PRO  27           HD2      PRO  27 -18.665  19.565   1.356
  187    HD3  PRO  27           HD1      PRO  27 -19.078  19.775  -0.361
  188    H    ALA  28           HN       ALA  28 -19.584  14.731   1.417
  189    HA   ALA  28           HA       ALA  28 -19.171  15.178   4.276
  190    HB1  ALA  28           HB1      ALA  28 -20.819  13.387   4.585
  191    HB2  ALA  28           HB2      ALA  28 -20.896  13.157   2.839
  192    HB3  ALA  28           HB3      ALA  28 -21.446  14.673   3.555
  193    HA   PRO  29           HA       PRO  29 -15.579  12.491   3.919
  194    HB2  PRO  29           HB2      PRO  29 -15.856  12.711   6.873
  195    HB3  PRO  29           HB1      PRO  29 -14.425  12.940   5.860
  196    HG2  PRO  29           HG2      PRO  29 -15.663  15.044   6.884
  197    HG3  PRO  29           HG1      PRO  29 -15.084  15.085   5.206
  198    HD2  PRO  29           HD2      PRO  29 -17.868  14.674   6.240
  199    HD3  PRO  29           HD1      PRO  29 -17.313  15.630   4.847
  200    H    ALA  30           HN       ALA  30 -15.703  10.412   3.613
  201    HA   ALA  30           HA       ALA  30 -16.952   8.716   5.626
  202    HB1  ALA  30           HB1      ALA  30 -18.673   9.071   3.903
  203    HB2  ALA  30           HB2      ALA  30 -18.134   7.393   3.952
  204    HB3  ALA  30           HB3      ALA  30 -17.562   8.467   2.676
  205    HA   PRO  31           HA       PRO  31 -12.736   7.341   4.264
  206    HB2  PRO  31           HB2      PRO  31 -11.972   6.643   6.795
  207    HB3  PRO  31           HB1      PRO  31 -11.741   8.258   6.114
  208    HG2  PRO  31           HG2      PRO  31 -13.896   7.257   7.931
  209    HG3  PRO  31           HG1      PRO  31 -12.996   8.785   7.996
  210    HD2  PRO  31           HD2      PRO  31 -15.484   8.662   6.982
  211    HD3  PRO  31           HD1      PRO  31 -14.252   9.745   6.307
  212    H    ALA  32           HN       ALA  32 -12.531   5.314   3.544
  213    HA   ALA  32           HA       ALA  32 -14.226   3.228   4.596
  214    HB1  ALA  32           HB1      ALA  32 -12.177   3.200   2.376
  215    HB2  ALA  32           HB2      ALA  32 -13.928   3.334   2.197
  216    HB3  ALA  32           HB3      ALA  32 -13.215   1.842   2.807
  217    HA   PRO  33           HA       PRO  33 -11.246   2.129   7.658
  218    HB2  PRO  33           HB2      PRO  33 -12.298  -0.337   8.269
  219    HB3  PRO  33           HB1      PRO  33 -12.910   1.193   8.902
  220    HG2  PRO  33           HG2      PRO  33 -13.934  -0.464   6.637
  221    HG3  PRO  33           HG1      PRO  33 -14.837   0.416   7.884
  222    HD2  PRO  33           HD2      PRO  33 -14.549   1.377   5.384
  223    HD3  PRO  33           HD1      PRO  33 -14.599   2.445   6.802
  224    H    GLU  34           HN       GLU  34 -12.084  -0.113   5.055
  225    HA   GLU  34           HA       GLU  34  -9.581  -1.589   5.528
  226    HB2  GLU  34           HB2      GLU  34 -11.936  -2.393   3.812
  227    HB3  GLU  34           HB1      GLU  34 -10.576  -3.404   4.283
  228    HG2  GLU  34           HG2      GLU  34 -12.547  -2.220   6.223
  229    HG3  GLU  34           HG1      GLU  34 -12.677  -3.840   5.541
  230    H    GLU  35           HN       GLU  35 -11.294   0.334   3.191
  231    HA   GLU  35           HA       GLU  35  -9.341  -0.221   1.112
  232    HB2  GLU  35           HB2      GLU  35 -11.717   1.646   1.087
  233    HB3  GLU  35           HB1      GLU  35 -10.729   1.208  -0.299
  234    HG2  GLU  35           HG2      GLU  35 -11.462  -1.107  -0.109
  235    HG3  GLU  35           HG1      GLU  35 -12.441  -0.685   1.299
  236    H    TRP  36           HN       TRP  36  -7.437   0.689   1.784
  237    HA   TRP  36           HA       TRP  36  -7.351   3.468   2.566
  238    HB2  TRP  36           HB2      TRP  36  -4.903   1.953   1.749
  239    HB3  TRP  36           HB1      TRP  36  -5.086   3.175   2.993
  240    HD1  TRP  36           HD1      TRP  36  -7.422   1.711   4.682
  241    HE1  TRP  36           HE1      TRP  36  -6.805  -0.377   6.070
  242    HE3  TRP  36           HE3      TRP  36  -3.106   0.352   2.268
  243    HZ2  TRP  36           HZ2      TRP  36  -4.749  -2.322   6.130
  244    HZ3  TRP  36           HZ3      TRP  36  -1.908  -1.609   3.055
  245    HH2  TRP  36           HH2      TRP  36  -2.697  -2.932   4.927
  246    H    LEU  37           HN       LEU  37  -5.083   4.336   1.234
  247    HA   LEU  37           HA       LEU  37  -6.152   5.074  -1.310
  248    HB2  LEU  37           HB2      LEU  37  -4.734   6.593   0.002
  249    HB3  LEU  37           HB1      LEU  37  -3.397   5.472  -0.136
  250    HG   LEU  37           HG       LEU  37  -3.429   5.810  -2.602
  251   HD11  LEU  37          HD11      LEU  37  -5.384   8.013  -1.966
  252   HD12  LEU  37          HD12      LEU  37  -5.762   6.521  -2.823
  253   HD13  LEU  37          HD13      LEU  37  -4.651   7.691  -3.537
  254   HD21  LEU  37          HD21      LEU  37  -3.069   8.301  -0.947
  255   HD22  LEU  37          HD22      LEU  37  -2.388   8.016  -2.548
  256   HD23  LEU  37          HD23      LEU  37  -1.870   7.028  -1.180
  257    H    ASP  38           HN       ASP  38  -6.222   3.561  -2.906
  258    HA   ASP  38           HA       ASP  38  -4.195   1.556  -3.131
  259    HB2  ASP  38           HB2      ASP  38  -6.613   1.313  -3.994
  260    HB3  ASP  38           HB1      ASP  38  -6.066   2.256  -5.382
  261    H    ILE  39           HN       ILE  39  -2.362   1.666  -4.075
  262    HA   ILE  39           HA       ILE  39  -1.214   4.100  -4.813
  263    HB   ILE  39           HB       ILE  39  -0.301   1.287  -5.422
  264   HG12  ILE  39          HG12      ILE  39   0.068   3.099  -3.048
  265   HG13  ILE  39          HG11      ILE  39  -0.611   1.483  -3.089
  266   HG21  ILE  39          HG21      ILE  39   1.943   2.210  -5.580
  267   HG22  ILE  39          HG22      ILE  39   1.302   3.838  -5.355
  268   HG23  ILE  39          HG23      ILE  39   0.878   2.912  -6.796
  269   HD11  ILE  39          HD11      ILE  39   2.271   2.145  -3.617
  270   HD12  ILE  39          HD12      ILE  39   1.555   0.537  -3.544
  271   HD13  ILE  39          HD13      ILE  39   1.621   1.536  -2.093
  272    H    LEU  40           HN       LEU  40  -2.807   1.615  -6.656
  273    HA   LEU  40           HA       LEU  40  -2.292   3.164  -9.111
  274    HB2  LEU  40           HB2      LEU  40  -2.899   0.213  -8.910
  275    HB3  LEU  40           HB1      LEU  40  -2.576   1.108 -10.384
  276    HG   LEU  40           HG       LEU  40  -0.609   0.594  -8.150
  277   HD11  LEU  40          HD11      LEU  40   0.550  -0.733  -9.869
  278   HD12  LEU  40          HD12      LEU  40  -0.803  -0.460 -10.966
  279   HD13  LEU  40          HD13      LEU  40  -1.044  -1.377  -9.479
  280   HD21  LEU  40          HD21      LEU  40  -0.229   2.785  -9.169
  281   HD22  LEU  40          HD22      LEU  40  -0.240   2.049 -10.772
  282   HD23  LEU  40          HD23      LEU  40   1.040   1.646  -9.628
  283    H    GLY  41           HN       GLY  41  -4.536   2.518  -6.853
  284    HA2  GLY  41           HA2      GLY  41  -6.810   2.744  -6.722
  285    HA3  GLY  41           HA1      GLY  41  -6.763   3.446  -8.331
  286    H    ASN  42           HN       ASN  42  -5.394   0.337  -7.747
  287    HA   ASN  42           HA       ASN  42  -7.378  -0.744  -9.596
  288    HB2  ASN  42           HB2      ASN  42  -5.832  -2.371 -10.239
  289    HB3  ASN  42           HB1      ASN  42  -4.930  -0.880 -10.120
  290   HD21  ASN  42          HD21      ASN  42  -4.714  -1.086  -7.148
  291   HD22  ASN  42          HD22      ASN  42  -3.546  -2.328  -6.891
  292    H    GLY  43           HN       GLY  43  -6.489  -1.053  -6.253
  293    HA2  GLY  43           HA2      GLY  43  -8.509  -1.612  -4.979
  294    HA3  GLY  43           HA1      GLY  43  -8.762  -2.938  -6.097
  295    H    LEU  44           HN       LEU  44  -5.591  -3.156  -5.741
  296    HA   LEU  44           HA       LEU  44  -5.833  -4.777  -3.305
  297    HB2  LEU  44           HB2      LEU  44  -4.290  -6.432  -4.631
  298    HB3  LEU  44           HB1      LEU  44  -6.022  -6.484  -4.766
  299    HG   LEU  44           HG       LEU  44  -5.744  -5.022  -6.840
  300   HD11  LEU  44          HD11      LEU  44  -3.622  -5.244  -7.972
  301   HD12  LEU  44          HD12      LEU  44  -2.952  -6.079  -6.566
  302   HD13  LEU  44          HD13      LEU  44  -3.443  -4.388  -6.440
  303   HD21  LEU  44          HD21      LEU  44  -6.444  -7.339  -6.938
  304   HD22  LEU  44          HD22      LEU  44  -4.768  -7.872  -6.813
  305   HD23  LEU  44          HD23      LEU  44  -5.309  -6.990  -8.241
  306    H    LEU  45           HN       LEU  45  -4.146  -2.342  -4.709
  307    HA   LEU  45           HA       LEU  45  -1.777  -3.002  -3.087
  308    HB2  LEU  45           HB2      LEU  45  -1.033  -3.136  -5.313
  309    HB3  LEU  45           HB1      LEU  45  -1.934  -1.717  -5.792
  310    HG   LEU  45           HG       LEU  45  -0.382  -0.290  -4.554
  311   HD11  LEU  45          HD11      LEU  45   0.176  -1.813  -2.749
  312   HD12  LEU  45          HD12      LEU  45   1.635  -1.238  -3.554
  313   HD13  LEU  45          HD13      LEU  45   1.030  -2.862  -3.878
  314   HD21  LEU  45          HD21      LEU  45   1.604  -0.669  -5.927
  315   HD22  LEU  45          HD22      LEU  45   0.121  -0.830  -6.870
  316   HD23  LEU  45          HD23      LEU  45   0.999  -2.271  -6.352
  317    H    ARG  46           HN       ARG  46  -2.116  -1.824  -1.267
  318    HA   ARG  46           HA       ARG  46  -2.865   1.015  -1.588
  319    HB2  ARG  46           HB2      ARG  46  -4.239  -1.103   0.041
  320    HB3  ARG  46           HB1      ARG  46  -4.381   0.600   0.444
  321    HG2  ARG  46           HG2      ARG  46  -5.567   1.085  -1.443
  322    HG3  ARG  46           HG1      ARG  46  -4.947  -0.298  -2.332
  323    HD2  ARG  46           HD2      ARG  46  -6.780  -0.533   0.048
  324    HD3  ARG  46           HD1      ARG  46  -7.367  -0.423  -1.613
  325    HE   ARG  46           HE       ARG  46  -6.031  -2.482  -2.030
  326   HH11  ARG  46          HH11      ARG  46  -7.157  -1.740   1.204
  327   HH12  ARG  46          HH12      ARG  46  -7.188  -3.393   1.710
  328   HH21  ARG  46          HH21      ARG  46  -6.046  -4.654  -1.351
  329   HH22  ARG  46          HH22      ARG  46  -6.518  -5.055   0.271
  330    H    LYS  47           HN       LYS  47  -1.979   2.403  -0.137
  331    HA   LYS  47           HA       LYS  47  -0.161   1.266   1.907
  332    HB2  LYS  47           HB2      LYS  47   0.732   2.688  -0.053
  333    HB3  LYS  47           HB1      LYS  47  -0.034   4.049   0.754
  334    HG2  LYS  47           HG2      LYS  47   1.331   3.177   2.819
  335    HG3  LYS  47           HG1      LYS  47   2.327   2.442   1.561
  336    HD2  LYS  47           HD2      LYS  47   3.330   4.500   1.927
  337    HD3  LYS  47           HD1      LYS  47   2.342   4.773   0.498
  338    HE2  LYS  47           HE2      LYS  47   0.817   6.075   1.604
  339    HE3  LYS  47           HE1      LYS  47   1.113   5.292   3.155
  340    HZ1  LYS  47           HZ1      LYS  47   3.147   6.498   3.403
  341    HZ2  LYS  47           HZ2      LYS  47   1.919   7.605   3.037
  342    HZ3  LYS  47           HZ3      LYS  47   3.022   7.153   1.840
  343    H    LYS  48           HN       LYS  48  -0.778   1.563   3.970
  344    HA   LYS  48           HA       LYS  48  -2.668   3.742   4.558
  345    HB2  LYS  48           HB2      LYS  48  -3.470   1.481   5.130
  346    HB3  LYS  48           HB1      LYS  48  -2.066   1.249   6.161
  347    HG2  LYS  48           HG2      LYS  48  -2.806   3.055   7.613
  348    HG3  LYS  48           HG1      LYS  48  -4.192   3.344   6.561
  349    HD2  LYS  48           HD2      LYS  48  -4.848   2.035   8.508
  350    HD3  LYS  48           HD1      LYS  48  -5.016   1.083   7.031
  351    HE2  LYS  48           HE2      LYS  48  -2.975  -0.095   7.488
  352    HE3  LYS  48           HE1      LYS  48  -2.625   0.958   8.862
  353    HZ1  LYS  48           HZ1      LYS  48  -3.488  -1.011   9.755
  354    HZ2  LYS  48           HZ2      LYS  48  -4.745  -1.099   8.620
  355    HZ3  LYS  48           HZ3      LYS  48  -4.773   0.091   9.827
  356    H    THR  49           HN       THR  49  -1.967   5.424   5.700
  357    HA   THR  49           HA       THR  49   0.707   5.423   6.808
  358    HB   THR  49           HB       THR  49  -0.028   7.813   7.495
  359    HG1  THR  49           HG1      THR  49  -1.829   8.603   6.404
  360   HG21  THR  49          HG21      THR  49   0.367   8.633   5.204
  361   HG22  THR  49          HG22      THR  49   0.136   6.993   4.594
  362   HG23  THR  49          HG23      THR  49   1.495   7.359   5.658
  363    H    LEU  50           HN       LEU  50   0.867   4.231   8.632
  364    HA   LEU  50           HA       LEU  50  -0.991   4.342  10.804
  365    HB2  LEU  50           HB2      LEU  50   1.954   3.804  11.114
  366    HB3  LEU  50           HB1      LEU  50   0.618   3.103  12.005
  367    HG   LEU  50           HG       LEU  50   1.127   2.517   9.098
  368   HD11  LEU  50          HD11      LEU  50   2.163   0.444   9.848
  369   HD12  LEU  50          HD12      LEU  50   1.999   0.963  11.526
  370   HD13  LEU  50          HD13      LEU  50   3.054   1.854  10.427
  371   HD21  LEU  50          HD21      LEU  50  -1.142   2.106   9.856
  372   HD22  LEU  50          HD22      LEU  50  -0.537   1.158  11.213
  373   HD23  LEU  50          HD23      LEU  50  -0.306   0.581   9.563
  374    H    VAL  51           HN       VAL  51   2.157   5.670  10.132
  375    HA   VAL  51           HA       VAL  51   1.418   8.252  11.308
  376    HB   VAL  51           HB       VAL  51   4.098   6.904  11.666
  377   HG11  VAL  51          HG11      VAL  51   4.600   8.835  13.143
  378   HG12  VAL  51          HG12      VAL  51   3.074   9.566  12.640
  379   HG13  VAL  51          HG13      VAL  51   4.350   9.280  11.455
  380   HG21  VAL  51          HG21      VAL  51   2.471   5.867  13.120
  381   HG22  VAL  51          HG22      VAL  51   1.927   7.446  13.685
  382   HG23  VAL  51          HG23      VAL  51   3.551   6.878  14.083
  383    HA   PRO  52           HA       PRO  52   3.461   9.042   7.398
  384    HB2  PRO  52           HB2      PRO  52   1.979  11.093   6.681
  385    HB3  PRO  52           HB1      PRO  52   1.271   9.483   6.896
  386    HG2  PRO  52           HG2      PRO  52   1.035  11.887   8.636
  387    HG3  PRO  52           HG1      PRO  52  -0.115  10.563   8.387
  388    HD2  PRO  52           HD2      PRO  52   1.877  10.858  10.465
  389    HD3  PRO  52           HD1      PRO  52   0.664   9.572  10.269
  390    H    GLY  53           HN       GLY  53   5.183   9.690   9.329
  391    HA2  GLY  53           HA2      GLY  53   7.029  11.044   9.578
  392    HA3  GLY  53           HA1      GLY  53   6.371  12.081   8.324
  393    HA   PRO  54           HA       PRO  54   5.752  14.201  12.530
  394    HB2  PRO  54           HB2      PRO  54   7.972  15.787  12.485
  395    HB3  PRO  54           HB1      PRO  54   7.907  14.249  13.356
  396    HG2  PRO  54           HG2      PRO  54   9.087  14.868  10.678
  397    HG3  PRO  54           HG1      PRO  54   9.714  13.825  11.967
  398    HD2  PRO  54           HD2      PRO  54   8.465  12.848   9.773
  399    HD3  PRO  54           HD1      PRO  54   8.388  12.055  11.357
  400    HA   PRO  55           HA       PRO  55   4.451  17.750  10.124
  401    HB2  PRO  55           HB2      PRO  55   5.333  19.668  12.160
  402    HB3  PRO  55           HB1      PRO  55   3.697  19.284  11.618
  403    HG2  PRO  55           HG2      PRO  55   4.606  18.562  14.050
  404    HG3  PRO  55           HG1      PRO  55   3.456  17.567  13.137
  405    HD2  PRO  55           HD2      PRO  55   6.417  17.227  13.465
  406    HD3  PRO  55           HD1      PRO  55   5.133  15.998  13.493
  407    H    GLY  56           HN       GLY  56   6.435  17.202   8.779
  408    HA2  GLY  56           HA2      GLY  56   7.496  19.169   7.455
  409    HA3  GLY  56           HA1      GLY  56   8.457  19.334   8.915
  410    H    SER  57           HN       SER  57   7.406  16.461   7.086
  411    HA   SER  57           HA       SER  57  10.176  15.538   7.070
  412    HB2  SER  57           HB2      SER  57   8.043  13.844   5.897
  413    HB3  SER  57           HB1      SER  57   9.334  13.424   7.017
  414    HG   SER  57           HG       SER  57   6.861  13.698   7.642
  415    H    SER  58           HN       SER  58  10.117  13.941   4.792
  416    HA   SER  58           HA       SER  58   9.227  15.531   2.530
  417    HB2  SER  58           HB2      SER  58  12.126  14.734   2.925
  418    HB3  SER  58           HB1      SER  58  11.463  15.466   1.465
  419    HG   SER  58           HG       SER  58  10.784  16.969   3.565
  420    H    ARG  59           HN       ARG  59   8.790  14.205   0.741
  421    HA   ARG  59           HA       ARG  59   8.974  11.350   1.286
  422    HB2  ARG  59           HB2      ARG  59   7.709  12.693  -1.107
  423    HB3  ARG  59           HB1      ARG  59   7.500  11.020  -0.591
  424    HG2  ARG  59           HG2      ARG  59   6.609  12.114   1.598
  425    HG3  ARG  59           HG1      ARG  59   6.369  13.521   0.567
  426    HD2  ARG  59           HD2      ARG  59   5.271  10.764   0.041
  427    HD3  ARG  59           HD1      ARG  59   4.364  12.102   0.739
  428    HE   ARG  59           HE       ARG  59   5.434  12.936  -1.716
  429   HH11  ARG  59          HH11      ARG  59   3.072  10.684  -0.470
  430   HH12  ARG  59          HH12      ARG  59   2.058  10.746  -1.881
  431   HH21  ARG  59          HH21      ARG  59   4.107  13.044  -3.591
  432   HH22  ARG  59          HH22      ARG  59   2.660  12.082  -3.669
  433    HA   PRO  60           HA       PRO  60  12.930  11.139  -0.779
  434    HB2  PRO  60           HB2      PRO  60  12.689   8.380  -1.197
  435    HB3  PRO  60           HB1      PRO  60  13.430   9.159   0.206
  436    HG2  PRO  60           HG2      PRO  60  10.660   8.093  -0.133
  437    HG3  PRO  60           HG1      PRO  60  11.723   8.011   1.285
  438    HD2  PRO  60           HD2      PRO  60   9.717   9.738   1.228
  439    HD3  PRO  60           HD1      PRO  60  11.299  10.241   1.865
  440    H    VAL  61           HN       VAL  61  13.680  10.927  -2.861
  441    HA   VAL  61           HA       VAL  61  11.579  10.752  -4.894
  442    HB   VAL  61           HB       VAL  61  14.433  11.629  -5.322
  443   HG11  VAL  61          HG11      VAL  61  13.532  12.785  -7.265
  444   HG12  VAL  61          HG12      VAL  61  11.911  12.225  -6.855
  445   HG13  VAL  61          HG13      VAL  61  13.152  11.063  -7.327
  446   HG21  VAL  61          HG21      VAL  61  13.670  13.944  -5.073
  447   HG22  VAL  61          HG22      VAL  61  13.480  13.033  -3.575
  448   HG23  VAL  61          HG23      VAL  61  12.077  13.361  -4.591
  449    H    LYS  62           HN       LYS  62  11.846   9.423  -6.729
  450    HA   LYS  62           HA       LYS  62  13.115   6.939  -6.351
  451    HB2  LYS  62           HB2      LYS  62  12.090   8.281  -8.856
  452    HB3  LYS  62           HB1      LYS  62  12.714   6.638  -8.824
  453    HG2  LYS  62           HG2      LYS  62  10.951   6.066  -7.159
  454    HG3  LYS  62           HG1      LYS  62  10.288   7.688  -7.389
  455    HD2  LYS  62           HD2      LYS  62   9.971   7.236  -9.762
  456    HD3  LYS  62           HD1      LYS  62  10.671   5.631  -9.554
  457    HE2  LYS  62           HE2      LYS  62   8.843   5.032  -8.038
  458    HE3  LYS  62           HE1      LYS  62   8.130   6.634  -8.270
  459    HZ1  LYS  62           HZ1      LYS  62   7.002   5.258  -9.765
  460    HZ2  LYS  62           HZ2      LYS  62   8.414   4.438 -10.230
  461    HZ3  LYS  62           HZ3      LYS  62   8.158   6.039 -10.733
  462    H    GLY  63           HN       GLY  63  15.097   6.380  -6.535
  463    HA2  GLY  63           HA2      GLY  63  17.180   6.533  -7.876
  464    HA3  GLY  63           HA1      GLY  63  16.971   8.278  -7.782
  465    H    GLN  64           HN       GLN  64  15.953   8.001  -4.988
  466    HA   GLN  64           HA       GLN  64  18.577   8.021  -3.745
  467    HB2  GLN  64           HB2      GLN  64  16.051   8.290  -2.158
  468    HB3  GLN  64           HB1      GLN  64  17.622   9.047  -1.901
  469    HG2  GLN  64           HG2      GLN  64  15.551   9.816  -3.947
  470    HG3  GLN  64           HG1      GLN  64  15.989  10.696  -2.489
  471   HE21  GLN  64          HE21      GLN  64  18.250   9.236  -4.785
  472   HE22  GLN  64          HE22      GLN  64  18.980  10.735  -5.267
  473    H    VAL  65           HN       VAL  65  19.401   6.398  -2.502
  474    HA   VAL  65           HA       VAL  65  17.772   4.030  -2.184
  475    HB   VAL  65           HB       VAL  65  19.632   2.870  -1.336
  476   HG11  VAL  65          HG11      VAL  65  21.394   3.248  -3.001
  477   HG12  VAL  65          HG12      VAL  65  20.626   4.776  -3.438
  478   HG13  VAL  65          HG13      VAL  65  19.776   3.253  -3.699
  479   HG21  VAL  65          HG21      VAL  65  21.784   3.969  -0.756
  480   HG22  VAL  65          HG22      VAL  65  20.452   4.344   0.336
  481   HG23  VAL  65          HG23      VAL  65  20.966   5.529  -0.870
  482    H    VAL  66           HN       VAL  66  16.789   3.424  -0.406
  483    HA   VAL  66           HA       VAL  66  16.872   5.265   1.880
  484    HB   VAL  66           HB       VAL  66  14.402   5.061   2.020
  485   HG11  VAL  66          HG11      VAL  66  15.644   6.244  -0.446
  486   HG12  VAL  66          HG12      VAL  66  15.096   7.066   1.013
  487   HG13  VAL  66          HG13      VAL  66  13.922   6.409  -0.118
  488   HG21  VAL  66          HG21      VAL  66  13.262   4.330  -0.123
  489   HG22  VAL  66          HG22      VAL  66  13.949   3.044   0.872
  490   HG23  VAL  66          HG23      VAL  66  14.798   3.598  -0.575
  491    H    THR  67           HN       THR  67  16.411   4.371   3.889
  492    HA   THR  67           HA       THR  67  16.621   1.457   3.953
  493    HB   THR  67           HB       THR  67  17.023   1.795   6.402
  494    HG1  THR  67           HG1      THR  67  17.502   3.919   7.088
  495   HG21  THR  67          HG21      THR  67  18.885   1.488   4.872
  496   HG22  THR  67          HG22      THR  67  19.308   2.625   6.150
  497   HG23  THR  67          HG23      THR  67  18.912   3.217   4.535
  498    H    VAL  68           HN       VAL  68  14.725   0.450   3.960
  499    HA   VAL  68           HA       VAL  68  12.610   1.592   5.629
  500    HB   VAL  68           HB       VAL  68  11.095  -0.059   4.403
  501   HG11  VAL  68          HG11      VAL  68  12.374   2.158   2.794
  502   HG12  VAL  68          HG12      VAL  68  11.089   2.365   3.984
  503   HG13  VAL  68          HG13      VAL  68  10.785   1.449   2.509
  504   HG21  VAL  68          HG21      VAL  68  13.416  -0.112   2.475
  505   HG22  VAL  68          HG22      VAL  68  11.827  -0.830   2.225
  506   HG23  VAL  68          HG23      VAL  68  12.889  -1.459   3.483
  507    H    HIS  69           HN       HIS  69  11.704   0.389   7.244
  508    HA   HIS  69           HA       HIS  69  12.917  -2.256   7.701
  509    HB2  HIS  69           HB2      HIS  69  12.947  -0.791   9.684
  510    HB3  HIS  69           HB1      HIS  69  11.209  -0.545   9.550
  511    HD1  HIS  69           HD1      HIS  69  12.600  -1.838  12.111
  512    HD2  HIS  69           HD2      HIS  69  10.717  -3.897   9.038
  513    HE1  HIS  69           HE1      HIS  69  11.943  -4.098  13.048
  514    HE2  HIS  69           HE2      HIS  69  10.682  -5.221  11.243
  515    H    LEU  70           HN       LEU  70  11.795  -3.925   6.900
  516    HA   LEU  70           HA       LEU  70   8.898  -3.545   6.814
  517    HB2  LEU  70           HB2      LEU  70   8.645  -4.541   4.793
  518    HB3  LEU  70           HB1      LEU  70  10.202  -3.768   4.562
  519    HG   LEU  70           HG       LEU  70   9.981  -6.618   5.468
  520   HD11  LEU  70          HD11      LEU  70   8.724  -6.467   3.402
  521   HD12  LEU  70          HD12      LEU  70  10.266  -7.271   3.108
  522   HD13  LEU  70          HD13      LEU  70  10.044  -5.586   2.632
  523   HD21  LEU  70          HD21      LEU  70  12.127  -5.064   4.017
  524   HD22  LEU  70          HD22      LEU  70  12.217  -6.768   4.468
  525   HD23  LEU  70          HD23      LEU  70  12.149  -5.529   5.720
  526    H    GLN  71           HN       GLN  71   7.693  -4.934   7.740
  527    HA   GLN  71           HA       GLN  71   8.599  -7.695   8.053
  528    HB2  GLN  71           HB2      GLN  71   6.716  -6.720  10.106
  529    HB3  GLN  71           HB1      GLN  71   7.988  -7.919  10.249
  530    HG2  GLN  71           HG2      GLN  71   8.841  -6.332  11.597
  531    HG3  GLN  71           HG1      GLN  71   9.544  -5.822  10.069
  532   HE21  GLN  71          HE21      GLN  71   6.823  -4.922   9.196
  533   HE22  GLN  71          HE22      GLN  71   6.652  -3.372   9.953
  534    H    THR  72           HN       THR  72   7.298  -8.833   6.940
  535    HA   THR  72           HA       THR  72   4.892  -7.519   5.953
  536    HB   THR  72           HB       THR  72   6.606  -9.672   4.747
  537    HG1  THR  72           HG1      THR  72   7.484  -8.051   3.561
  538   HG21  THR  72          HG21      THR  72   4.301  -9.852   4.041
  539   HG22  THR  72          HG22      THR  72   5.303  -9.254   2.716
  540   HG23  THR  72          HG23      THR  72   4.280  -8.138   3.628
  541    H    SER  73           HN       SER  73   2.990  -8.373   6.313
  542    HA   SER  73           HA       SER  73   2.852 -10.990   7.614
  543    HB2  SER  73           HB2      SER  73   1.979  -8.778   8.714
  544    HB3  SER  73           HB1      SER  73   0.645  -8.929   7.576
  545    HG   SER  73           HG       SER  73   0.250  -9.921   9.637
  546    H    LEU  74           HN       LEU  74   1.056 -12.312   7.050
  547    HA   LEU  74           HA       LEU  74   0.357 -12.192   4.246
  548    HB2  LEU  74           HB2      LEU  74  -0.216 -14.175   6.444
  549    HB3  LEU  74           HB1      LEU  74  -0.817 -14.357   4.813
  550    HG   LEU  74           HG       LEU  74   1.998 -14.548   5.811
  551   HD11  LEU  74          HD11      LEU  74   1.973 -16.633   4.530
  552   HD12  LEU  74          HD12      LEU  74   0.312 -16.304   4.031
  553   HD13  LEU  74          HD13      LEU  74   0.683 -16.587   5.731
  554   HD21  LEU  74          HD21      LEU  74   2.098 -12.986   3.985
  555   HD22  LEU  74          HD22      LEU  74   1.123 -14.060   2.972
  556   HD23  LEU  74          HD23      LEU  74   2.748 -14.546   3.466
  557    H    GLU  75           HN       GLU  75  -1.956 -12.477   3.614
  558    HA   GLU  75           HA       GLU  75  -3.632 -10.564   4.711
  559    HB2  GLU  75           HB2      GLU  75  -5.455 -11.652   3.460
  560    HB3  GLU  75           HB1      GLU  75  -4.006 -11.430   2.497
  561    HG2  GLU  75           HG2      GLU  75  -3.430 -13.774   2.790
  562    HG3  GLU  75           HG1      GLU  75  -4.873 -14.008   3.778
  563    H    ASN  76           HN       ASN  76  -2.958 -13.789   5.703
  564    HA   ASN  76           HA       ASN  76  -5.258 -14.023   7.440
  565    HB2  ASN  76           HB2      ASN  76  -4.231 -16.197   8.094
  566    HB3  ASN  76           HB1      ASN  76  -4.474 -16.024   6.365
  567   HD21  ASN  76          HD21      ASN  76  -2.853 -16.344   5.047
  568   HD22  ASN  76          HD22      ASN  76  -1.206 -16.547   5.524
  569    H    GLY  77           HN       GLY  77  -2.352 -12.429   7.645
  570    HA2  GLY  77           HA2      GLY  77  -1.887 -11.058   9.511
  571    HA3  GLY  77           HA1      GLY  77  -2.730 -12.205  10.539
  572    H    THR  78           HN       THR  78  -0.679 -13.902   8.489
  573    HA   THR  78           HA       THR  78   1.229 -14.217  10.657
  574    HB   THR  78           HB       THR  78   1.013 -15.735   8.064
  575    HG1  THR  78           HG1      THR  78  -0.684 -16.435   9.199
  576   HG21  THR  78          HG21      THR  78   2.673 -16.253  10.534
  577   HG22  THR  78          HG22      THR  78   3.277 -15.825   8.932
  578   HG23  THR  78          HG23      THR  78   2.481 -17.378   9.193
  579    H    ARG  79           HN       ARG  79   2.907 -12.883  10.762
  580    HA   ARG  79           HA       ARG  79   3.972 -11.604   8.433
  581    HB2  ARG  79           HB2      ARG  79   4.958 -11.672  11.285
  582    HB3  ARG  79           HB1      ARG  79   5.712 -10.733   9.999
  583    HG2  ARG  79           HG2      ARG  79   3.190  -9.917   9.704
  584    HG3  ARG  79           HG1      ARG  79   3.173 -10.282  11.429
  585    HD2  ARG  79           HD2      ARG  79   5.069  -8.803  11.782
  586    HD3  ARG  79           HD1      ARG  79   5.169  -8.486  10.042
  587    HE   ARG  79           HE       ARG  79   2.590  -7.820  10.828
  588   HH11  ARG  79          HH11      ARG  79   5.808  -6.734  11.663
  589   HH12  ARG  79          HH12      ARG  79   5.327  -5.094  11.960
  590   HH21  ARG  79          HH21      ARG  79   1.946  -5.657  11.242
  591   HH22  ARG  79          HH22      ARG  79   3.132  -4.472  11.708
  592    H    VAL  80           HN       VAL  80   5.326 -12.344   7.078
  593    HA   VAL  80           HA       VAL  80   6.492 -14.975   7.607
  594    HB   VAL  80           HB       VAL  80   6.535 -15.210   5.157
  595   HG11  VAL  80          HG11      VAL  80   4.126 -15.414   4.853
  596   HG12  VAL  80          HG12      VAL  80   3.862 -14.421   6.288
  597   HG13  VAL  80          HG13      VAL  80   4.632 -16.004   6.437
  598   HG21  VAL  80          HG21      VAL  80   6.769 -12.854   4.547
  599   HG22  VAL  80          HG22      VAL  80   5.139 -12.534   5.144
  600   HG23  VAL  80          HG23      VAL  80   5.379 -13.583   3.746
  601    H    GLN  81           HN       GLN  81   7.443 -11.781   7.342
  602    HA   GLN  81           HA       GLN  81  10.211 -12.534   7.161
  603    HB2  GLN  81           HB2      GLN  81  10.695 -10.976   5.260
  604    HB3  GLN  81           HB1      GLN  81   9.783 -12.408   4.812
  605    HG2  GLN  81           HG2      GLN  81   7.705 -11.007   4.927
  606    HG3  GLN  81           HG1      GLN  81   8.752  -9.604   5.119
  607   HE21  GLN  81          HE21      GLN  81   7.644 -12.087   2.993
  608   HE22  GLN  81          HE22      GLN  81   8.255 -11.408   1.530
  609    H    GLU  82           HN       GLU  82  11.319 -11.331   8.539
  610    HA   GLU  82           HA       GLU  82  10.398  -8.579   9.060
  611    HB2  GLU  82           HB2      GLU  82   9.994  -9.966  11.041
  612    HB3  GLU  82           HB1      GLU  82  11.669 -10.506  11.024
  613    HG2  GLU  82           HG2      GLU  82  12.313  -8.062  11.285
  614    HG3  GLU  82           HG1      GLU  82  10.611  -7.757  11.624
  615    H    GLU  83           HN       GLU  83  11.808  -7.119   8.431
  616    HA   GLU  83           HA       GLU  83  14.647  -7.631   8.773
  617    HB2  GLU  83           HB2      GLU  83  14.511  -8.282   6.547
  618    HB3  GLU  83           HB1      GLU  83  13.237  -7.132   6.181
  619    HG2  GLU  83           HG2      GLU  83  14.706  -5.383   5.906
  620    HG3  GLU  83           HG1      GLU  83  15.985  -6.171   6.840
  621    HA   PRO  84           HA       PRO  84  13.933  -3.717  10.642
  622    HB2  PRO  84           HB2      PRO  84  16.798  -3.748  11.251
  623    HB3  PRO  84           HB1      PRO  84  15.422  -3.836  12.355
  624    HG2  PRO  84           HG2      PRO  84  17.038  -5.943  11.897
  625    HG3  PRO  84           HG1      PRO  84  15.306  -6.133  12.234
  626    HD2  PRO  84           HD2      PRO  84  16.748  -6.219   9.604
  627    HD3  PRO  84           HD1      PRO  84  15.443  -7.264  10.210
  628    H    GLU  85           HN       GLU  85  16.184  -4.274   8.075
  629    HA   GLU  85           HA       GLU  85  16.024  -1.525   7.315
  630    HB2  GLU  85           HB2      GLU  85  17.856  -1.484   9.007
  631    HB3  GLU  85           HB1      GLU  85  18.767  -2.598   7.995
  632    HG2  GLU  85           HG2      GLU  85  19.184  -1.015   6.386
  633    HG3  GLU  85           HG1      GLU  85  17.778  -0.045   6.822
  634    H    LEU  86           HN       LEU  86  15.452  -1.790   5.412
  635    HA   LEU  86           HA       LEU  86  16.977  -3.488   3.577
  636    HB2  LEU  86           HB2      LEU  86  14.759  -4.327   3.711
  637    HB3  LEU  86           HB1      LEU  86  14.065  -2.721   3.730
  638    HG   LEU  86           HG       LEU  86  14.751  -2.434   1.382
  639   HD11  LEU  86          HD11      LEU  86  15.528  -5.324   1.633
  640   HD12  LEU  86          HD12      LEU  86  16.605  -3.963   1.315
  641   HD13  LEU  86          HD13      LEU  86  15.404  -4.439   0.112
  642   HD21  LEU  86          HD21      LEU  86  13.039  -3.899   0.435
  643   HD22  LEU  86          HD22      LEU  86  12.495  -3.173   1.948
  644   HD23  LEU  86          HD23      LEU  86  13.034  -4.851   1.922
  645    H    VAL  87           HN       VAL  87  18.377  -2.108   2.592
  646    HA   VAL  87           HA       VAL  87  17.397   0.562   1.857
  647    HB   VAL  87           HB       VAL  87  19.513   0.470   3.118
  648   HG11  VAL  87          HG11      VAL  87  20.587  -1.008   0.726
  649   HG12  VAL  87          HG12      VAL  87  20.391  -1.652   2.358
  650   HG13  VAL  87          HG13      VAL  87  21.559  -0.365   2.050
  651   HG21  VAL  87          HG21      VAL  87  19.796   1.438   0.278
  652   HG22  VAL  87          HG22      VAL  87  20.831   1.915   1.625
  653   HG23  VAL  87          HG23      VAL  87  19.119   2.336   1.636
  654    H    PHE  88           HN       PHE  88  17.097   1.128  -0.226
  655    HA   PHE  88           HA       PHE  88  18.158  -0.433  -2.431
  656    HB2  PHE  88           HB2      PHE  88  16.042  -1.138  -3.317
  657    HB3  PHE  88           HB1      PHE  88  16.166  -1.727  -1.665
  658    HD1  PHE  88           HD2      PHE  88  14.981  -0.462   0.150
  659    HD2  PHE  88           HD1      PHE  88  14.251   0.205  -3.984
  660    HE1  PHE  88           HE2      PHE  88  12.850   0.617   0.709
  661    HE2  PHE  88           HE1      PHE  88  12.106   1.278  -3.443
  662    HZ   PHE  88           HZ       PHE  88  11.371   1.444  -1.146
  663    H    THR  89           HN       THR  89  17.514   0.483  -4.522
  664    HA   THR  89           HA       THR  89  17.340   3.377  -4.348
  665    HB   THR  89           HB       THR  89  17.607   1.722  -6.861
  666    HG1  THR  89           HG1      THR  89  19.490   1.166  -6.086
  667   HG21  THR  89          HG21      THR  89  18.443   4.542  -6.183
  668   HG22  THR  89          HG22      THR  89  17.071   4.081  -7.191
  669   HG23  THR  89          HG23      THR  89  18.716   3.731  -7.725
  670    H    LEU  90           HN       LEU  90  15.412   4.320  -4.372
  671    HA   LEU  90           HA       LEU  90  12.983   3.128  -5.087
  672    HB2  LEU  90           HB2      LEU  90  13.828   5.997  -4.844
  673    HB3  LEU  90           HB1      LEU  90  12.192   5.550  -5.293
  674    HG   LEU  90           HG       LEU  90  13.585   4.851  -2.727
  675   HD11  LEU  90          HD11      LEU  90  11.312   6.733  -3.325
  676   HD12  LEU  90          HD12      LEU  90  12.947   7.183  -2.839
  677   HD13  LEU  90          HD13      LEU  90  11.899   6.318  -1.714
  678   HD21  LEU  90          HD21      LEU  90  11.433   3.916  -2.048
  679   HD22  LEU  90          HD22      LEU  90  12.084   3.068  -3.452
  680   HD23  LEU  90          HD23      LEU  90  10.783   4.243  -3.655
  681    H    GLY  91           HN       GLY  91  11.885   2.903  -6.955
  682    HA2  GLY  91           HA2      GLY  91  11.209   3.316  -9.128
  683    HA3  GLY  91           HA1      GLY  91  12.307   4.689  -9.177
  684    H    ASP  92           HN       ASP  92  13.750   1.860  -8.081
  685    HA   ASP  92           HA       ASP  92  14.950   1.413 -10.729
  686    HB2  ASP  92           HB2      ASP  92  16.382   2.299  -8.742
  687    HB3  ASP  92           HB1      ASP  92  16.275   0.643  -8.152
  688    H    CYS  93           HN       CYS  93  12.838   0.253  -8.556
  689    HA   CYS  93           HA       CYS  93  11.765  -1.723  -8.272
  690    HB2  CYS  93           HB2      CYS  93  13.068  -2.535 -10.877
  691    HB3  CYS  93           HB1      CYS  93  11.596  -3.200 -10.170
  692    HG   CYS  93           HG       CYS  93  11.432   0.098 -10.696
  693    H    ASP  94           HN       ASP  94  14.305  -1.354  -7.104
  694    HA   ASP  94           HA       ASP  94  15.860  -3.721  -7.399
  695    HB2  ASP  94           HB2      ASP  94  16.822  -1.547  -6.654
  696    HB3  ASP  94           HB1      ASP  94  15.885  -1.673  -5.168
  697    H    VAL  95           HN       VAL  95  12.967  -3.011  -6.085
  698    HA   VAL  95           HA       VAL  95  12.986  -5.287  -4.209
  699    HB   VAL  95           HB       VAL  95  11.348  -3.940  -2.830
  700   HG11  VAL  95          HG11      VAL  95  13.083  -2.645  -1.709
  701   HG12  VAL  95          HG12      VAL  95  14.122  -2.804  -3.123
  702   HG13  VAL  95          HG13      VAL  95  13.696  -4.232  -2.180
  703   HG21  VAL  95          HG21      VAL  95  12.378  -1.714  -4.595
  704   HG22  VAL  95          HG22      VAL  95  11.430  -1.487  -3.121
  705   HG23  VAL  95          HG23      VAL  95  10.718  -2.306  -4.509
  706    H    ILE  96           HN       ILE  96  10.235  -5.000  -3.510
  707    HA   ILE  96           HA       ILE  96   8.945  -5.973  -5.895
  708    HB   ILE  96           HB       ILE  96   6.953  -6.222  -4.427
  709   HG12  ILE  96          HG12      ILE  96   8.813  -5.289  -2.232
  710   HG13  ILE  96          HG11      ILE  96   7.477  -4.348  -2.888
  711   HG21  ILE  96          HG21      ILE  96   8.501  -8.063  -4.689
  712   HG22  ILE  96          HG22      ILE  96   7.884  -8.028  -3.036
  713   HG23  ILE  96          HG23      ILE  96   9.511  -7.435  -3.385
  714   HD11  ILE  96          HD11      ILE  96   6.880  -5.389  -0.777
  715   HD12  ILE  96          HD12      ILE  96   7.242  -6.981  -1.445
  716   HD13  ILE  96          HD13      ILE  96   5.904  -6.033  -2.096
  717    H    GLN  97           HN       GLN  97   7.387  -4.858  -7.019
  718    HA   GLN  97           HA       GLN  97   7.881  -2.111  -7.222
  719    HB2  GLN  97           HB2      GLN  97   6.900  -3.729  -8.983
  720    HB3  GLN  97           HB1      GLN  97   5.343  -3.319  -8.269
  721    HG2  GLN  97           HG2      GLN  97   5.521  -1.794  -9.994
  722    HG3  GLN  97           HG1      GLN  97   6.090  -0.878  -8.603
  723   HE21  GLN  97          HE21      GLN  97   8.390  -0.541  -8.363
  724   HE22  GLN  97          HE22      GLN  97   9.401  -0.575  -9.764
  725    H    ALA  98           HN       ALA  98   5.433  -3.865  -5.443
  726    HA   ALA  98           HA       ALA  98   3.676  -1.814  -4.759
  727    HB1  ALA  98           HB1      ALA  98   3.277  -4.146  -4.165
  728    HB2  ALA  98           HB2      ALA  98   3.200  -3.117  -2.737
  729    HB3  ALA  98           HB3      ALA  98   4.630  -4.104  -3.036
  730    H    LEU  99           HN       LEU  99   6.805  -2.683  -3.432
  731    HA   LEU  99           HA       LEU  99   6.658  -0.730  -1.325
  732    HB2  LEU  99           HB2      LEU  99   7.963  -2.826  -1.084
  733    HB3  LEU  99           HB1      LEU  99   9.059  -2.228  -2.327
  734    HG   LEU  99           HG       LEU  99   9.620  -0.302  -0.887
  735   HD11  LEU  99          HD11      LEU  99   7.569  -0.139   0.382
  736   HD12  LEU  99          HD12      LEU  99   8.938  -0.338   1.474
  737   HD13  LEU  99          HD13      LEU  99   7.878  -1.704   1.133
  738   HD21  LEU  99          HD21      LEU  99  10.018  -3.009   0.370
  739   HD22  LEU  99          HD22      LEU  99  10.898  -1.544   0.806
  740   HD23  LEU  99          HD23      LEU  99  11.063  -2.222  -0.813
  741    H    ASP 100           HN       ASP 100   8.181  -1.051  -4.444
  742    HA   ASP 100           HA       ASP 100   9.997   1.072  -4.271
  743    HB2  ASP 100           HB2      ASP 100  10.127  -0.730  -5.929
  744    HB3  ASP 100           HB1      ASP 100   8.650  -0.163  -6.679
  745    H    LEU 101           HN       LEU 101   6.630   0.902  -5.075
  746    HA   LEU 101           HA       LEU 101   6.521   3.679  -5.852
  747    HB2  LEU 101           HB2      LEU 101   4.374   1.584  -5.598
  748    HB3  LEU 101           HB1      LEU 101   4.141   3.187  -6.243
  749    HG   LEU 101           HG       LEU 101   5.869   1.033  -7.444
  750   HD11  LEU 101          HD11      LEU 101   4.207   1.081  -9.260
  751   HD12  LEU 101          HD12      LEU 101   3.228   2.196  -8.307
  752   HD13  LEU 101          HD13      LEU 101   3.524   0.562  -7.720
  753   HD21  LEU 101          HD21      LEU 101   6.807   3.251  -7.830
  754   HD22  LEU 101          HD22      LEU 101   5.255   3.808  -8.456
  755   HD23  LEU 101          HD23      LEU 101   6.162   2.564  -9.320
  756    H    SER 102           HN       SER 102   5.664   1.711  -3.040
  757    HA   SER 102           HA       SER 102   3.795   3.599  -2.005
  758    HB2  SER 102           HB2      SER 102   3.949   2.184   0.070
  759    HB3  SER 102           HB1      SER 102   3.531   1.299  -1.391
  760    HG   SER 102           HG       SER 102   5.342   0.242  -1.287
  761    H    VAL 103           HN       VAL 103   7.199   3.092  -1.710
  762    HA   VAL 103           HA       VAL 103   7.690   4.529   0.641
  763    HB   VAL 103           HB       VAL 103   9.467   3.977  -1.699
  764   HG11  VAL 103          HG11      VAL 103  10.284   5.921  -0.453
  765   HG12  VAL 103          HG12      VAL 103  11.327   4.531  -0.179
  766   HG13  VAL 103          HG13      VAL 103  10.174   5.020   1.060
  767   HG21  VAL 103          HG21      VAL 103   8.954   1.930  -0.740
  768   HG22  VAL 103          HG22      VAL 103   8.845   2.599   0.886
  769   HG23  VAL 103          HG23      VAL 103  10.423   2.381   0.133
  770    HA   PRO 104           HA       PRO 104   8.617   8.418  -2.100
  771    HB2  PRO 104           HB2      PRO 104   7.472   8.364  -4.599
  772    HB3  PRO 104           HB1      PRO 104   9.170   8.004  -4.270
  773    HG2  PRO 104           HG2      PRO 104   6.885   6.133  -4.700
  774    HG3  PRO 104           HG1      PRO 104   8.560   6.014  -5.257
  775    HD2  PRO 104           HD2      PRO 104   7.657   4.598  -3.160
  776    HD3  PRO 104           HD1      PRO 104   9.323   5.212  -3.241
  777    H    LEU 105           HN       LEU 105   5.708   6.514  -2.296
  778    HA   LEU 105           HA       LEU 105   3.915   8.759  -2.188
  779    HB2  LEU 105           HB2      LEU 105   3.594   5.818  -1.644
  780    HB3  LEU 105           HB1      LEU 105   2.267   6.959  -1.468
  781    HG   LEU 105           HG       LEU 105   3.704   6.162  -3.993
  782   HD11  LEU 105          HD11      LEU 105   1.479   5.507  -4.716
  783   HD12  LEU 105          HD12      LEU 105   0.807   6.054  -3.181
  784   HD13  LEU 105          HD13      LEU 105   1.917   4.684  -3.219
  785   HD21  LEU 105          HD21      LEU 105   1.697   8.380  -3.630
  786   HD22  LEU 105          HD22      LEU 105   2.317   7.800  -5.176
  787   HD23  LEU 105          HD23      LEU 105   3.400   8.586  -4.025
  788    H    MET 106           HN       MET 106   5.903   7.147   0.044
  789    HA   MET 106           HA       MET 106   4.346   8.042   2.356
  790    HB2  MET 106           HB2      MET 106   5.071   6.174   3.352
  791    HB3  MET 106           HB1      MET 106   5.738   5.688   1.805
  792    HG2  MET 106           HG2      MET 106   7.828   6.987   2.515
  793    HG3  MET 106           HG1      MET 106   7.109   6.963   4.132
  794    HE1  MET 106           HE1      MET 106   6.835   3.095   4.797
  795    HE2  MET 106           HE2      MET 106   5.617   4.206   4.167
  796    HE3  MET 106           HE3      MET 106   6.648   4.696   5.512
  797    H    ASP 107           HN       ASP 107   5.454   9.178   4.112
  798    HA   ASP 107           HA       ASP 107   7.446  11.051   3.048
  799    HB2  ASP 107           HB2      ASP 107   5.281  11.228   4.962
  800    HB3  ASP 107           HB1      ASP 107   6.786  11.800   5.669
  801    H    VAL 108           HN       VAL 108   9.350  11.581   4.237
  802    HA   VAL 108           HA       VAL 108  10.724   9.363   5.286
  803    HB   VAL 108           HB       VAL 108  11.322  12.282   5.106
  804   HG11  VAL 108          HG11      VAL 108  13.451  11.975   6.304
  805   HG12  VAL 108          HG12      VAL 108  12.927  10.366   6.801
  806   HG13  VAL 108          HG13      VAL 108  12.058  11.793   7.369
  807   HG21  VAL 108          HG21      VAL 108  13.314  11.452   3.951
  808   HG22  VAL 108          HG22      VAL 108  11.836  10.796   3.244
  809   HG23  VAL 108          HG23      VAL 108  12.826   9.794   4.306
  810    H    GLY 109           HN       GLY 109  10.617   8.462   7.146
  811    HA2  GLY 109           HA2      GLY 109  10.770   8.404   9.494
  812    HA3  GLY 109           HA1      GLY 109  10.158  10.049   9.551
  813    H    GLU 110           HN       GLU 110   8.408   7.935   7.481
  814    HA   GLU 110           HA       GLU 110   6.333   7.795   9.534
  815    HB2  GLU 110           HB2      GLU 110   4.696   7.800   7.899
  816    HB3  GLU 110           HB1      GLU 110   5.883   8.929   7.268
  817    HG2  GLU 110           HG2      GLU 110   6.585   7.409   5.624
  818    HG3  GLU 110           HG1      GLU 110   5.790   6.053   6.424
  819    H    THR 111           HN       THR 111   4.879   5.902   9.368
  820    HA   THR 111           HA       THR 111   6.275   3.490   8.485
  821    HB   THR 111           HB       THR 111   4.591   3.602  10.996
  822    HG1  THR 111           HG1      THR 111   7.058   4.538  10.641
  823   HG21  THR 111          HG21      THR 111   4.806   1.406   9.872
  824   HG22  THR 111          HG22      THR 111   5.581   1.426  11.453
  825   HG23  THR 111          HG23      THR 111   6.558   1.533   9.988
  826    H    ALA 112           HN       ALA 112   5.101   2.570   6.954
  827    HA   ALA 112           HA       ALA 112   2.199   3.058   7.009
  828    HB1  ALA 112           HB1      ALA 112   2.227   3.034   4.579
  829    HB2  ALA 112           HB2      ALA 112   3.968   2.760   4.585
  830    HB3  ALA 112           HB3      ALA 112   3.313   4.279   5.199
  831    H    MET 113           HN       MET 113   0.888   1.387   6.827
  832    HA   MET 113           HA       MET 113   2.082  -1.262   6.426
  833    HB2  MET 113           HB2      MET 113   0.714  -1.312   8.353
  834    HB3  MET 113           HB1      MET 113  -0.535  -0.321   7.604
  835    HG2  MET 113           HG2      MET 113  -1.143  -2.168   6.143
  836    HG3  MET 113           HG1      MET 113   0.141  -3.154   6.834
  837    HE1  MET 113           HE1      MET 113  -1.074  -4.113  10.289
  838    HE2  MET 113           HE2      MET 113   0.232  -3.091   9.686
  839    HE3  MET 113           HE3      MET 113  -0.130  -4.624   8.888
  840    H    VAL 114           HN       VAL 114   2.003  -2.006   4.420
  841    HA   VAL 114           HA       VAL 114  -0.017  -0.844   2.610
  842    HB   VAL 114           HB       VAL 114   2.571  -2.124   1.786
  843   HG11  VAL 114          HG11      VAL 114   2.281  -0.854  -0.279
  844   HG12  VAL 114          HG12      VAL 114   0.752  -0.223   0.332
  845   HG13  VAL 114          HG13      VAL 114   0.929  -1.950   0.016
  846   HG21  VAL 114          HG21      VAL 114   2.083   0.790   2.292
  847   HG22  VAL 114          HG22      VAL 114   3.546   0.097   1.589
  848   HG23  VAL 114          HG23      VAL 114   3.101  -0.278   3.255
  849    H    THR 115           HN       THR 115  -1.486  -2.205   1.772
  850    HA   THR 115           HA       THR 115  -0.763  -5.043   1.857
  851    HB   THR 115           HB       THR 115  -3.545  -3.874   1.636
  852    HG1  THR 115           HG1      THR 115  -2.049  -4.041   3.735
  853   HG21  THR 115          HG21      THR 115  -2.574  -6.699   2.014
  854   HG22  THR 115          HG22      THR 115  -3.257  -6.040   0.523
  855   HG23  THR 115          HG23      THR 115  -4.257  -6.174   1.974
  856    H    ALA 116           HN       ALA 116  -0.031  -5.712   0.120
  857    HA   ALA 116           HA       ALA 116  -1.067  -4.706  -2.460
  858    HB1  ALA 116           HB1      ALA 116   1.739  -5.589  -1.797
  859    HB2  ALA 116           HB2      ALA 116   1.208  -3.926  -2.061
  860    HB3  ALA 116           HB3      ALA 116   1.153  -5.092  -3.385
  861    H    ASP 117           HN       ASP 117  -1.855  -6.239  -3.770
  862    HA   ASP 117           HA       ASP 117  -2.115  -8.913  -3.150
  863    HB2  ASP 117           HB2      ASP 117  -3.178  -7.660  -5.108
  864    HB3  ASP 117           HB1      ASP 117  -1.663  -7.932  -5.939
  865    H    SER 118           HN       SER 118  -0.909 -10.731  -3.585
  866    HA   SER 118           HA       SER 118   1.820 -10.621  -3.273
  867    HB2  SER 118           HB2      SER 118   0.084 -12.588  -3.134
  868    HB3  SER 118           HB1      SER 118   0.577 -12.871  -4.808
  869    HG   SER 118           HG       SER 118   1.772 -13.982  -3.030
  870    H    LYS 119           HN       LYS 119  -0.061 -10.356  -6.191
  871    HA   LYS 119           HA       LYS 119   1.845 -10.835  -8.142
  872    HB2  LYS 119           HB2      LYS 119   0.550  -9.156  -9.496
  873    HB3  LYS 119           HB1      LYS 119  -0.407 -10.463  -8.795
  874    HG2  LYS 119           HG2      LYS 119  -1.184  -8.982  -7.055
  875    HG3  LYS 119           HG1      LYS 119  -0.114  -7.703  -7.632
  876    HD2  LYS 119           HD2      LYS 119  -2.385  -7.308  -8.372
  877    HD3  LYS 119           HD1      LYS 119  -1.342  -7.647  -9.757
  878    HE2  LYS 119           HE2      LYS 119  -2.142 -10.079  -9.476
  879    HE3  LYS 119           HE1      LYS 119  -3.425  -9.388  -8.483
  880    HZ1  LYS 119           HZ1      LYS 119  -4.063  -9.665 -10.835
  881    HZ2  LYS 119           HZ2      LYS 119  -2.851  -8.567 -11.277
  882    HZ3  LYS 119           HZ3      LYS 119  -4.152  -8.050 -10.321
  883    H    TYR 120           HN       TYR 120   1.451  -7.930  -6.117
  884    HA   TYR 120           HA       TYR 120   3.729  -6.676  -7.475
  885    HB2  TYR 120           HB2      TYR 120   1.968  -5.618  -5.253
  886    HB3  TYR 120           HB1      TYR 120   3.245  -4.717  -6.064
  887    HD1  TYR 120           HD2      TYR 120  -0.138  -6.066  -6.346
  888    HD2  TYR 120           HD1      TYR 120   2.944  -3.877  -8.294
  889    HE1  TYR 120           HE2      TYR 120  -1.759  -5.276  -8.028
  890    HE2  TYR 120           HE1      TYR 120   1.354  -3.098  -9.972
  891    HH   TYR 120           HH       TYR 120  -0.785  -3.697 -10.925
  892    H    CYS 121           HN       CYS 121   3.331  -8.922  -5.258
  893    HA   CYS 121           HA       CYS 121   5.616  -8.034  -3.637
  894    HB2  CYS 121           HB2      CYS 121   3.341  -9.852  -2.823
  895    HB3  CYS 121           HB1      CYS 121   4.724  -9.438  -1.814
  896    HG   CYS 121           HG       CYS 121   1.883  -7.897  -2.058
  897    H    TYR 122           HN       TYR 122   4.233 -11.297  -3.572
  898    HA   TYR 122           HA       TYR 122   6.395 -12.224  -5.315
  899    HB2  TYR 122           HB2      TYR 122   5.985 -13.577  -2.658
  900    HB3  TYR 122           HB1      TYR 122   7.316 -13.743  -3.785
  901    HD1  TYR 122           HD2      TYR 122   9.029 -11.960  -3.977
  902    HD2  TYR 122           HD1      TYR 122   5.990 -11.834  -0.997
  903    HE1  TYR 122           HE2      TYR 122  10.317 -10.293  -2.741
  904    HE2  TYR 122           HE1      TYR 122   7.269 -10.143   0.241
  905    HH   TYR 122           HH       TYR 122  10.006  -8.552  -1.104
  906    H    GLY 123           HN       GLY 123   3.548 -12.195  -5.838
  907    HA2  GLY 123           HA2      GLY 123   2.205 -14.553  -5.304
  908    HA3  GLY 123           HA1      GLY 123   1.999 -13.613  -6.769
  909    HA   PRO 124           HA       PRO 124   3.889 -17.036  -8.916
  910    HB2  PRO 124           HB2      PRO 124   4.807 -15.346 -11.070
  911    HB3  PRO 124           HB1      PRO 124   3.403 -16.414 -11.042
  912    HG2  PRO 124           HG2      PRO 124   3.259 -13.675 -11.150
  913    HG3  PRO 124           HG1      PRO 124   1.973 -14.718 -10.521
  914    HD2  PRO 124           HD2      PRO 124   4.041 -13.145  -9.029
  915    HD3  PRO 124           HD1      PRO 124   2.325 -13.401  -8.642
  916    H    GLN 125           HN       GLN 125   5.518 -14.858  -7.261
  917    HA   GLN 125           HA       GLN 125   8.141 -15.295  -8.518
  918    HB2  GLN 125           HB2      GLN 125   7.339 -13.276  -6.420
  919    HB3  GLN 125           HB1      GLN 125   8.866 -13.333  -7.291
  920    HG2  GLN 125           HG2      GLN 125   7.797 -12.759  -9.342
  921    HG3  GLN 125           HG1      GLN 125   6.203 -12.926  -8.620
  922   HE21  GLN 125          HE21      GLN 125   5.394 -11.310  -7.347
  923   HE22  GLN 125          HE22      GLN 125   6.139  -9.762  -7.185
  924    H    GLY 126           HN       GLY 126   6.478 -15.192  -5.412
  925    HA2  GLY 126           HA2      GLY 126   6.794 -16.378  -3.495
  926    HA3  GLY 126           HA1      GLY 126   8.082 -17.280  -4.275
  927    H    SER 127           HN       SER 127   7.838 -15.960  -1.658
  928    HA   SER 127           HA       SER 127   9.706 -13.801  -1.831
  929    HB2  SER 127           HB2      SER 127   7.898 -13.317  -0.409
  930    HB3  SER 127           HB1      SER 127   7.968 -14.895   0.348
  931    HG   SER 127           HG       SER 127  10.001 -14.214   1.262
  932    H    ARG 128           HN       ARG 128  11.551 -13.590  -0.505
  933    HA   ARG 128           HA       ARG 128  13.493 -15.438  -0.784
  934    HB2  ARG 128           HB2      ARG 128  14.546 -14.341   1.326
  935    HB3  ARG 128           HB1      ARG 128  14.259 -13.358  -0.101
  936    HG2  ARG 128           HG2      ARG 128  12.259 -12.431   0.891
  937    HG3  ARG 128           HG1      ARG 128  12.422 -13.497   2.285
  938    HD2  ARG 128           HD2      ARG 128  14.562 -11.532   1.516
  939    HD3  ARG 128           HD1      ARG 128  13.204 -11.080   2.544
  940    HE   ARG 128           HE       ARG 128  14.694 -13.422   3.412
  941   HH11  ARG 128          HH11      ARG 128  14.340  -9.935   3.643
  942   HH12  ARG 128          HH12      ARG 128  15.098  -9.836   5.197
  943   HH21  ARG 128          HH21      ARG 128  15.689 -13.282   5.480
  944   HH22  ARG 128          HH22      ARG 128  15.849 -11.726   6.249
  945    H    SER 129           HN       SER 129  11.881 -14.998   2.393
  946    HA   SER 129           HA       SER 129  12.876 -17.489   3.327
  947    HB2  SER 129           HB2      SER 129  10.673 -15.791   4.510
  948    HB3  SER 129           HB1      SER 129  11.582 -17.058   5.335
  949    HG   SER 129           HG       SER 129  13.451 -15.553   4.493
  950    HA   PRO 130           HA       PRO 130   8.768 -19.351   2.184
  951    HB2  PRO 130           HB2      PRO 130   6.462 -17.866   2.479
  952    HB3  PRO 130           HB1      PRO 130   7.249 -18.730   3.792
  953    HG2  PRO 130           HG2      PRO 130   6.955 -15.922   3.538
  954    HG3  PRO 130           HG1      PRO 130   7.913 -16.784   4.751
  955    HD2  PRO 130           HD2      PRO 130   8.786 -15.573   2.156
  956    HD3  PRO 130           HD1      PRO 130   9.642 -15.657   3.708
  957    H    TYR 131           HN       TYR 131   8.590 -19.719  -0.046
  958    HA   TYR 131           HA       TYR 131   7.932 -17.861  -1.987
  959    HB2  TYR 131           HB2      TYR 131   8.568 -20.151  -2.576
  960    HB3  TYR 131           HB1      TYR 131   7.102 -20.776  -1.831
  961    HD1  TYR 131           HD1      TYR 131   4.891 -20.340  -2.908
  962    HD2  TYR 131           HD2      TYR 131   8.549 -19.254  -4.797
  963    HE1  TYR 131           HE1      TYR 131   3.726 -20.165  -5.068
  964    HE2  TYR 131           HE2      TYR 131   7.391 -19.087  -6.959
  965    HH   TYR 131           HH       TYR 131   5.357 -19.994  -8.020
  966    H    ILE 132           HN       ILE 132   6.409 -16.379  -1.452
  967    HA   ILE 132           HA       ILE 132   4.038 -16.952  -0.035
  968    HB   ILE 132           HB       ILE 132   4.531 -14.603  -1.869
  969   HG12  ILE 132          HG12      ILE 132   6.373 -14.622  -0.370
  970   HG13  ILE 132          HG11      ILE 132   5.242 -13.395   0.196
  971   HG21  ILE 132          HG21      ILE 132   2.953 -13.459  -0.378
  972   HG22  ILE 132          HG22      ILE 132   2.744 -14.959   0.527
  973   HG23  ILE 132          HG23      ILE 132   2.224 -14.863  -1.159
  974   HD11  ILE 132          HD11      ILE 132   5.444 -16.161   1.333
  975   HD12  ILE 132          HD12      ILE 132   4.499 -14.807   1.962
  976   HD13  ILE 132          HD13      ILE 132   6.264 -14.736   1.973
  977    HA   PRO 133           HA       PRO 133   1.685 -18.862  -3.329
  978    HB2  PRO 133           HB2      PRO 133  -0.805 -18.248  -2.248
  979    HB3  PRO 133           HB1      PRO 133   0.147 -19.686  -1.880
  980    HG2  PRO 133           HG2      PRO 133  -0.135 -17.151  -0.345
  981    HG3  PRO 133           HG1      PRO 133   0.034 -18.812   0.250
  982    HD2  PRO 133           HD2      PRO 133   2.073 -17.059   0.301
  983    HD3  PRO 133           HD1      PRO 133   2.332 -18.793   0.011
  984    HA   PRO 134           HA       PRO 134   0.798 -15.529  -6.078
  985    HB2  PRO 134           HB2      PRO 134  -1.252 -17.345  -7.227
  986    HB3  PRO 134           HB1      PRO 134   0.101 -16.518  -8.016
  987    HG2  PRO 134           HG2      PRO 134   0.203 -19.139  -7.519
  988    HG3  PRO 134           HG1      PRO 134   1.640 -18.118  -7.327
  989    HD2  PRO 134           HD2      PRO 134  -0.190 -19.222  -5.233
  990    HD3  PRO 134           HD1      PRO 134   1.577 -19.051  -5.207
  991    H    HIS 135           HN       HIS 135  -0.416 -13.830  -5.943
  992    HA   HIS 135           HA       HIS 135  -2.145 -12.403  -5.629
  993    HB2  HIS 135           HB2      HIS 135  -3.805 -14.909  -5.927
  994    HB3  HIS 135           HB1      HIS 135  -4.507 -13.309  -5.726
  995    HD1  HIS 135           HD1      HIS 135  -4.417 -15.443  -8.255
  996    HD2  HIS 135           HD2      HIS 135  -2.670 -11.687  -7.910
  997    HE1  HIS 135           HE1      HIS 135  -4.085 -14.631 -10.616
  998    HE2  HIS 135           HE2      HIS 135  -2.879 -12.426 -10.383
  999    H    ALA 136           HN       ALA 136  -1.048 -14.338  -3.343
 1000    HA   ALA 136           HA       ALA 136  -3.062 -14.041  -1.333
 1001    HB1  ALA 136           HB1      ALA 136  -0.086 -14.482  -1.049
 1002    HB2  ALA 136           HB2      ALA 136  -1.326 -15.734  -1.075
 1003    HB3  ALA 136           HB3      ALA 136  -1.262 -14.587   0.261
 1004    H    ALA 137           HN       ALA 137  -3.541 -12.228  -0.185
 1005    HA   ALA 137           HA       ALA 137  -2.306  -9.804  -1.115
 1006    HB1  ALA 137           HB1      ALA 137  -4.446 -10.260   0.966
 1007    HB2  ALA 137           HB2      ALA 137  -4.680  -9.795  -0.715
 1008    HB3  ALA 137           HB3      ALA 137  -3.916  -8.674   0.411
 1009    H    LEU 138           HN       LEU 138  -0.462  -9.118  -0.361
 1010    HA   LEU 138           HA       LEU 138   0.524 -10.058   2.195
 1011    HB2  LEU 138           HB2      LEU 138   1.687  -9.513  -0.289
 1012    HB3  LEU 138           HB1      LEU 138   2.300  -8.270   0.783
 1013    HG   LEU 138           HG       LEU 138   3.186  -9.936   2.292
 1014   HD11  LEU 138          HD11      LEU 138   2.028 -11.972   0.404
 1015   HD12  LEU 138          HD12      LEU 138   1.416 -11.598   2.015
 1016   HD13  LEU 138          HD13      LEU 138   3.019 -12.310   1.825
 1017   HD21  LEU 138          HD21      LEU 138   4.589  -9.283   0.420
 1018   HD22  LEU 138          HD22      LEU 138   3.879 -10.560  -0.570
 1019   HD23  LEU 138          HD23      LEU 138   4.854 -10.974   0.842
 1020    H    CYS 139           HN       CYS 139   0.695  -8.812   3.976
 1021    HA   CYS 139           HA       CYS 139   0.083  -5.941   3.674
 1022    HB2  CYS 139           HB2      CYS 139  -1.551  -7.566   4.920
 1023    HB3  CYS 139           HB1      CYS 139  -0.354  -7.478   6.206
 1024    HG   CYS 139           HG       CYS 139  -2.511  -5.128   5.116
 1025    H    LEU 140           HN       LEU 140   2.044  -5.017   3.714
 1026    HA   LEU 140           HA       LEU 140   4.003  -6.055   5.645
 1027    HB2  LEU 140           HB2      LEU 140   5.707  -5.065   4.122
 1028    HB3  LEU 140           HB1      LEU 140   4.794  -6.397   3.438
 1029    HG   LEU 140           HG       LEU 140   3.359  -4.167   2.669
 1030   HD11  LEU 140          HD11      LEU 140   6.320  -3.617   2.444
 1031   HD12  LEU 140          HD12      LEU 140   5.168  -2.724   3.434
 1032   HD13  LEU 140          HD13      LEU 140   5.041  -2.677   1.674
 1033   HD21  LEU 140          HD21      LEU 140   3.768  -6.114   1.297
 1034   HD22  LEU 140          HD22      LEU 140   5.484  -5.719   1.189
 1035   HD23  LEU 140          HD23      LEU 140   4.288  -4.663   0.435
 1036    H    GLU 141           HN       GLU 141   4.966  -4.724   7.053
 1037    HA   GLU 141           HA       GLU 141   3.940  -1.975   7.159
 1038    HB2  GLU 141           HB2      GLU 141   3.419  -3.410   9.072
 1039    HB3  GLU 141           HB1      GLU 141   5.121  -3.789   9.275
 1040    HG2  GLU 141           HG2      GLU 141   5.550  -1.418   9.798
 1041    HG3  GLU 141           HG1      GLU 141   3.808  -1.120   9.711
 1042    H    VAL 142           HN       VAL 142   5.345  -0.496   6.391
 1043    HA   VAL 142           HA       VAL 142   8.203  -1.115   6.605
 1044    HB   VAL 142           HB       VAL 142   8.448   0.470   4.613
 1045   HG11  VAL 142          HG11      VAL 142   7.065  -2.188   4.259
 1046   HG12  VAL 142          HG12      VAL 142   8.793  -1.940   4.502
 1047   HG13  VAL 142          HG13      VAL 142   8.016  -1.346   3.036
 1048   HG21  VAL 142          HG21      VAL 142   6.213   1.437   4.651
 1049   HG22  VAL 142          HG22      VAL 142   5.503  -0.154   4.372
 1050   HG23  VAL 142          HG23      VAL 142   6.497   0.601   3.125
 1051    H    THR 143           HN       THR 143   9.265   0.049   7.956
 1052    HA   THR 143           HA       THR 143   8.505   2.783   8.647
 1053    HB   THR 143           HB       THR 143  11.013   1.344   9.557
 1054    HG1  THR 143           HG1      THR 143   8.362   0.773  10.161
 1055   HG21  THR 143          HG21      THR 143  10.884   3.694  10.127
 1056   HG22  THR 143          HG22      THR 143  10.647   2.735  11.585
 1057   HG23  THR 143          HG23      THR 143   9.264   3.483  10.793
 1058    H    LEU 144           HN       LEU 144   9.117   4.328   7.200
 1059    HA   LEU 144           HA       LEU 144  11.637   4.074   5.776
 1060    HB2  LEU 144           HB2      LEU 144   9.665   5.094   4.680
 1061    HB3  LEU 144           HB1      LEU 144   9.690   6.382   5.872
 1062    HG   LEU 144           HG       LEU 144  11.878   7.114   5.049
 1063   HD11  LEU 144          HD11      LEU 144  11.547   4.910   3.021
 1064   HD12  LEU 144          HD12      LEU 144  12.758   4.985   4.300
 1065   HD13  LEU 144          HD13      LEU 144  12.793   6.160   2.985
 1066   HD21  LEU 144          HD21      LEU 144   9.888   6.792   2.813
 1067   HD22  LEU 144          HD22      LEU 144  11.148   8.020   2.941
 1068   HD23  LEU 144          HD23      LEU 144   9.801   8.017   4.077
 1069    H    LYS 145           HN       LYS 145  13.306   4.228   7.060
 1070    HA   LYS 145           HA       LYS 145  13.199   6.060   9.328
 1071    HB2  LYS 145           HB2      LYS 145  15.379   4.069   8.727
 1072    HB3  LYS 145           HB1      LYS 145  14.929   4.771  10.277
 1073    HG2  LYS 145           HG2      LYS 145  12.896   3.508  10.337
 1074    HG3  LYS 145           HG1      LYS 145  13.183   2.894   8.705
 1075    HD2  LYS 145           HD2      LYS 145  14.917   2.363  11.126
 1076    HD3  LYS 145           HD1      LYS 145  13.757   1.228  10.413
 1077    HE2  LYS 145           HE2      LYS 145  15.000   1.049   8.428
 1078    HE3  LYS 145           HE1      LYS 145  16.038   2.419   8.842
 1079    HZ1  LYS 145           HZ1      LYS 145  16.687   0.957  10.850
 1080    HZ2  LYS 145           HZ2      LYS 145  17.357   0.598   9.337
 1081    HZ3  LYS 145           HZ3      LYS 145  16.064  -0.326   9.932
 1082    H    THR 146           HN       THR 146  14.833   5.570   6.292
 1083    HA   THR 146           HA       THR 146  16.116   8.156   6.544
 1084    HB   THR 146           HB       THR 146  17.774   5.708   5.953
 1085    HG1  THR 146           HG1      THR 146  16.965   6.620   8.312
 1086   HG21  THR 146          HG21      THR 146  19.682   7.234   6.147
 1087   HG22  THR 146          HG22      THR 146  18.584   8.578   6.452
 1088   HG23  THR 146          HG23      THR 146  18.573   7.770   4.886
 1089    H    ALA 147           HN       ALA 147  16.582   9.111   4.573
 1090    HA   ALA 147           HA       ALA 147  16.479   7.418   2.178
 1091    HB1  ALA 147           HB1      ALA 147  14.280   8.526   2.416
 1092    HB2  ALA 147           HB2      ALA 147  15.152   9.058   0.979
 1093    HB3  ALA 147           HB3      ALA 147  15.095  10.090   2.407
 1094    H    VAL 148           HN       VAL 148  18.210   7.784   0.851
 1095    HA   VAL 148           HA       VAL 148  19.555  10.393   1.075
 1096    HB   VAL 148           HB       VAL 148  21.768   9.394   1.259
 1097   HG11  VAL 148          HG11      VAL 148  20.660  10.021   3.317
 1098   HG12  VAL 148          HG12      VAL 148  21.614   8.561   3.581
 1099   HG13  VAL 148          HG13      VAL 148  19.861   8.450   3.397
 1100   HG21  VAL 148          HG21      VAL 148  20.335   6.753   1.508
 1101   HG22  VAL 148          HG22      VAL 148  22.061   7.010   1.765
 1102   HG23  VAL 148          HG23      VAL 148  21.359   7.262   0.166
 1103    H    ASP 149           HN       ASP 149  20.595  11.072  -0.773
 1104    HA   ASP 149           HA       ASP 149  19.696   9.833  -3.182
 1105    HB2  ASP 149           HB2      ASP 149  19.746  12.193  -3.222
 1106    HB3  ASP 149           HB1      ASP 149  21.402  12.261  -2.614
 1107    H    LEU 150           HN       LEU 150  20.678   8.249  -4.244
 1108    HA   LEU 150           HA       LEU 150  23.566   8.043  -4.347
 1109    HB2  LEU 150           HB2      LEU 150  22.330   6.761  -2.289
 1110    HB3  LEU 150           HB1      LEU 150  22.233   5.527  -3.524
 1111    HG   LEU 150           HG       LEU 150  24.170   5.218  -2.052
 1112   HD11  LEU 150          HD11      LEU 150  25.895   4.976  -3.775
 1113   HD12  LEU 150          HD12      LEU 150  24.918   5.948  -4.875
 1114   HD13  LEU 150          HD13      LEU 150  24.325   4.382  -4.320
 1115   HD21  LEU 150          HD21      LEU 150  26.039   6.779  -2.097
 1116   HD22  LEU 150          HD22      LEU 150  24.572   7.558  -1.498
 1117   HD23  LEU 150          HD23      LEU 150  25.120   7.856  -3.147
 1118    H    GLU 151           HN       GLU 151  21.556   8.605  -6.265
 1119    HA   GLU 151           HA       GLU 151  20.871   6.214  -7.683
 1120    HB2  GLU 151           HB2      GLU 151  19.797   8.663  -7.678
 1121    HB3  GLU 151           HB1      GLU 151  20.836   8.836  -9.086
 1122    HG2  GLU 151           HG2      GLU 151  19.066   6.448  -8.889
 1123    HG3  GLU 151           HG1      GLU 151  18.351   8.000  -9.316
 1124    H    HIS 152           HN       HIS 152  21.544   5.832  -9.983
 1125    HA   HIS 152           HA       HIS 152  24.476   6.108 -10.025
 1126    HB2  HIS 152           HB2      HIS 152  24.149   3.834 -11.423
 1127    HB3  HIS 152           HB1      HIS 152  24.378   3.874  -9.679
 1128    HD1  HIS 152           HD1      HIS 152  22.655   2.737  -8.327
 1129    HD2  HIS 152           HD2      HIS 152  21.273   3.606 -12.153
 1130    HE1  HIS 152           HE1      HIS 152  20.393   1.657  -8.486
 1131    HE2  HIS 152           HE2      HIS 152  19.492   2.342 -10.739
 1132    H    HIS 153           HN       HIS 153  21.597   5.916 -12.094
 1133    HA   HIS 153           HA       HIS 153  23.026   7.347 -14.171
 1134    HB2  HIS 153           HB2      HIS 153  22.074   4.514 -14.575
 1135    HB3  HIS 153           HB1      HIS 153  22.248   5.630 -15.924
 1136    HD1  HIS 153           HD1      HIS 153  24.050   3.091 -14.201
 1137    HD2  HIS 153           HD2      HIS 153  25.072   6.731 -15.938
 1138    HE1  HIS 153           HE1      HIS 153  26.533   2.993 -14.580
 1139    HE2  HIS 153           HE2      HIS 153  27.086   5.119 -15.825
 1140    H    HIS 154           HN       HIS 154  21.661   8.967 -14.388
 1141    HA   HIS 154           HA       HIS 154  18.876   8.796 -13.905
 1142    HB2  HIS 154           HB2      HIS 154  20.286  10.950 -15.490
 1143    HB3  HIS 154           HB1      HIS 154  18.753  11.089 -14.638
 1144    HD1  HIS 154           HD1      HIS 154  19.965   9.644 -11.978
 1145    HD2  HIS 154           HD2      HIS 154  21.494  12.950 -14.001
 1146    HE1  HIS 154           HE1      HIS 154  21.365  10.890 -10.300
 1147    HE2  HIS 154           HE2      HIS 154  22.487  12.717 -11.629
 1148    H    HIS 155           HN       HIS 155  17.765   7.374 -15.193
 1149    HA   HIS 155           HA       HIS 155  17.860   7.906 -18.089
 1150    HB2  HIS 155           HB2      HIS 155  17.463   5.346 -16.581
 1151    HB3  HIS 155           HB1      HIS 155  16.808   5.526 -18.204
 1152    HD1  HIS 155           HD1      HIS 155  18.710   6.236 -20.071
 1153    HD2  HIS 155           HD2      HIS 155  20.054   4.528 -16.517
 1154    HE1  HIS 155           HE1      HIS 155  21.040   5.409 -20.546
 1155    HE2  HIS 155           HE2      HIS 155  21.745   4.196 -18.455
 1156    H    HIS 156           HN       HIS 156  16.070   8.714 -15.563
 1157    HA   HIS 156           HA       HIS 156  13.673   8.975 -17.173
 1158    HB2  HIS 156           HB2      HIS 156  13.826   7.183 -14.817
 1159    HB3  HIS 156           HB1      HIS 156  12.427   8.245 -14.889
 1160    HD1  HIS 156           HD1      HIS 156  12.468   5.056 -15.222
 1161    HD2  HIS 156           HD2      HIS 156  12.058   7.902 -18.232
 1162    HE1  HIS 156           HE1      HIS 156  11.259   3.890 -17.099
 1163    HE2  HIS 156           HE2      HIS 156  10.890   5.673 -18.848
 1164    H    HIS 157           HN       HIS 157  12.279  10.609 -16.472
 1165    HA   HIS 157           HA       HIS 157  12.671  11.950 -13.980
 1166    HB2  HIS 157           HB2      HIS 157  13.051  14.224 -15.100
 1167    HB3  HIS 157           HB1      HIS 157  14.434  13.150 -14.969
 1168    HD1  HIS 157           HD1      HIS 157  11.753  13.669 -17.646
 1169    HD2  HIS 157           HD2      HIS 157  15.873  13.327 -17.223
 1170    HE1  HIS 157           HE1      HIS 157  12.693  13.905 -19.967
 1171    HE2  HIS 157           HE2      HIS 157  15.192  13.941 -19.642
  Start of MODEL    8
    1    H1   MET   1           HT1      MET   1 -31.935  31.444 -32.014
    2    H2   MET   1           HT2      MET   1 -31.330  32.823 -32.784
    3    H3   MET   1           HT3      MET   1 -32.504  31.869 -33.552
    4    HA   MET   1           HA       MET   1 -33.473  33.891 -32.686
    5    HB2  MET   1           HB2      MET   1 -34.832  31.828 -32.781
    6    HB3  MET   1           HB1      MET   1 -34.312  31.418 -31.154
    7    HG2  MET   1           HG2      MET   1 -36.546  32.355 -31.135
    8    HG3  MET   1           HG1      MET   1 -35.416  33.411 -30.287
    9    HE1  MET   1           HE1      MET   1 -35.835  32.987 -34.184
   10    HE2  MET   1           HE2      MET   1 -37.024  34.239 -34.535
   11    HE3  MET   1           HE3      MET   1 -37.479  32.832 -33.568
   12    H    GLY   2           HN       GLY   2 -32.300  31.804 -30.038
   13    HA2  GLY   2           HA2      GLY   2 -30.930  32.931 -28.302
   14    HA3  GLY   2           HA1      GLY   2 -32.102  34.241 -28.371
   15    H    GLN   3           HN       GLN   3 -32.637  30.747 -28.364
   16    HA   GLN   3           HA       GLN   3 -34.732  31.048 -26.401
   17    HB2  GLN   3           HB2      GLN   3 -33.612  28.530 -27.655
   18    HB3  GLN   3           HB1      GLN   3 -35.117  28.662 -26.754
   19    HG2  GLN   3           HG2      GLN   3 -35.974  30.200 -28.478
   20    HG3  GLN   3           HG1      GLN   3 -34.491  29.953 -29.397
   21   HE21  GLN   3          HE21      GLN   3 -34.345  27.128 -28.620
   22   HE22  GLN   3          HE22      GLN   3 -35.540  26.321 -29.576
   23    HA   PRO   4           HA       PRO   4 -32.398  29.929 -22.782
   24    HB2  PRO   4           HB2      PRO   4 -34.769  28.485 -21.811
   25    HB3  PRO   4           HB1      PRO   4 -33.994  29.930 -21.155
   26    HG2  PRO   4           HG2      PRO   4 -36.392  30.036 -22.363
   27    HG3  PRO   4           HG1      PRO   4 -35.213  31.355 -22.501
   28    HD2  PRO   4           HD2      PRO   4 -35.848  29.172 -24.459
   29    HD3  PRO   4           HD1      PRO   4 -35.591  30.906 -24.751
   30    HA   PRO   5           HA       PRO   5 -31.100  25.722 -23.403
   31    HB2  PRO   5           HB2      PRO   5 -29.868  25.290 -21.022
   32    HB3  PRO   5           HB1      PRO   5 -29.161  26.273 -22.307
   33    HG2  PRO   5           HG2      PRO   5 -30.622  27.138 -19.844
   34    HG3  PRO   5           HG1      PRO   5 -29.157  27.818 -20.577
   35    HD2  PRO   5           HD2      PRO   5 -31.606  28.933 -20.908
   36    HD3  PRO   5           HD1      PRO   5 -30.339  29.008 -22.150
   37    H    ALA   6           HN       ALA   6 -31.637  23.624 -22.804
   38    HA   ALA   6           HA       ALA   6 -32.760  21.897 -21.866
   39    HB1  ALA   6           HB1      ALA   6 -31.840  22.720 -19.729
   40    HB2  ALA   6           HB2      ALA   6 -33.427  21.972 -19.541
   41    HB3  ALA   6           HB3      ALA   6 -33.272  23.730 -19.521
   42    H    GLU   7           HN       GLU   7 -35.092  21.684 -20.431
   43    HA   GLU   7           HA       GLU   7 -37.085  23.156 -22.000
   44    HB2  GLU   7           HB2      GLU   7 -36.781  21.088 -23.195
   45    HB3  GLU   7           HB1      GLU   7 -36.859  20.155 -21.709
   46    HG2  GLU   7           HG2      GLU   7 -38.899  19.892 -22.942
   47    HG3  GLU   7           HG1      GLU   7 -39.220  20.794 -21.462
   48    H    GLU   8           HN       GLU   8 -39.001  23.533 -20.924
   49    HA   GLU   8           HA       GLU   8 -38.984  22.802 -18.065
   50    HB2  GLU   8           HB2      GLU   8 -39.968  25.310 -19.415
   51    HB3  GLU   8           HB1      GLU   8 -40.329  24.910 -17.742
   52    HG2  GLU   8           HG2      GLU   8 -37.889  24.835 -17.292
   53    HG3  GLU   8           HG1      GLU   8 -37.608  25.393 -18.940
   54    H    ALA   9           HN       ALA   9 -40.239  21.646 -20.591
   55    HA   ALA   9           HA       ALA   9 -41.901  20.104 -20.813
   56    HB1  ALA   9           HB1      ALA   9 -43.577  19.714 -19.092
   57    HB2  ALA   9           HB2      ALA   9 -43.091  21.190 -18.259
   58    HB3  ALA   9           HB3      ALA   9 -41.970  19.834 -18.369
   59    H    GLU  10           HN       GLU  10 -44.224  19.995 -21.324
   60    HA   GLU  10           HA       GLU  10 -45.220  22.567 -22.334
   61    HB2  GLU  10           HB2      GLU  10 -44.109  21.585 -24.197
   62    HB3  GLU  10           HB1      GLU  10 -44.729  19.986 -23.815
   63    HG2  GLU  10           HG2      GLU  10 -45.868  20.756 -25.738
   64    HG3  GLU  10           HG1      GLU  10 -47.010  20.820 -24.398
   65    H    GLN  11           HN       GLN  11 -46.159  19.138 -22.461
   66    HA   GLN  11           HA       GLN  11 -48.898  19.918 -21.824
   67    HB2  GLN  11           HB2      GLN  11 -49.460  17.625 -22.651
   68    HB3  GLN  11           HB1      GLN  11 -48.697  18.653 -23.855
   69    HG2  GLN  11           HG2      GLN  11 -46.549  17.541 -23.413
   70    HG3  GLN  11           HG1      GLN  11 -47.358  16.477 -22.265
   71   HE21  GLN  11          HE21      GLN  11 -48.805  17.545 -25.265
   72   HE22  GLN  11          HE22      GLN  11 -48.783  16.000 -26.039
   73    HA   PRO  12           HA       PRO  12 -48.296  18.154 -17.745
   74    HB2  PRO  12           HB2      PRO  12 -51.101  18.835 -17.324
   75    HB3  PRO  12           HB1      PRO  12 -49.669  19.506 -16.541
   76    HG2  PRO  12           HG2      PRO  12 -51.201  20.925 -18.281
   77    HG3  PRO  12           HG1      PRO  12 -49.464  21.200 -18.076
   78    HD2  PRO  12           HD2      PRO  12 -50.901  19.697 -20.228
   79    HD3  PRO  12           HD1      PRO  12 -49.506  20.790 -20.354
   80    H    GLY  13           HN       GLY  13 -48.448  16.031 -17.360
   81    HA2  GLY  13           HA2      GLY  13 -50.186  14.265 -16.871
   82    HA3  GLY  13           HA1      GLY  13 -50.742  14.569 -18.512
   83    H    ALA  14           HN       ALA  14 -47.371  14.497 -17.516
   84    HA   ALA  14           HA       ALA  14 -47.047  11.942 -18.942
   85    HB1  ALA  14           HB1      ALA  14 -45.347  14.414 -19.311
   86    HB2  ALA  14           HB2      ALA  14 -46.427  13.695 -20.506
   87    HB3  ALA  14           HB3      ALA  14 -44.982  12.825 -19.986
   88    H    LEU  15           HN       LEU  15 -45.547  10.567 -18.087
   89    HA   LEU  15           HA       LEU  15 -43.931  11.516 -15.817
   90    HB2  LEU  15           HB2      LEU  15 -45.602   8.999 -15.909
   91    HB3  LEU  15           HB1      LEU  15 -44.426   9.360 -14.661
   92    HG   LEU  15           HG       LEU  15 -46.936  10.947 -15.222
   93   HD11  LEU  15          HD11      LEU  15 -47.730  10.037 -13.120
   94   HD12  LEU  15          HD12      LEU  15 -46.231   9.130 -12.922
   95   HD13  LEU  15          HD13      LEU  15 -47.337   8.728 -14.236
   96   HD21  LEU  15          HD21      LEU  15 -46.383  12.187 -13.225
   97   HD22  LEU  15          HD22      LEU  15 -45.054  12.309 -14.378
   98   HD23  LEU  15          HD23      LEU  15 -44.923  11.226 -12.991
   99    H    ALA  16           HN       ALA  16 -41.855  10.790 -15.855
  100    HA   ALA  16           HA       ALA  16 -40.997   8.424 -17.174
  101    HB1  ALA  16           HB1      ALA  16 -40.477  11.010 -18.656
  102    HB2  ALA  16           HB2      ALA  16 -41.538   9.707 -19.191
  103    HB3  ALA  16           HB3      ALA  16 -39.799   9.432 -19.068
  104    H    ARG  17           HN       ARG  17 -40.591  10.147 -14.718
  105    HA   ARG  17           HA       ARG  17 -37.651  10.078 -14.770
  106    HB2  ARG  17           HB2      ARG  17 -37.495  12.273 -13.677
  107    HB3  ARG  17           HB1      ARG  17 -38.259  12.400 -15.252
  108    HG2  ARG  17           HG2      ARG  17 -39.561  13.788 -13.939
  109    HG3  ARG  17           HG1      ARG  17 -40.482  12.283 -13.944
  110    HD2  ARG  17           HD2      ARG  17 -39.361  11.707 -11.765
  111    HD3  ARG  17           HD1      ARG  17 -38.698  13.345 -11.759
  112    HE   ARG  17           HE       ARG  17 -41.198  14.002 -11.940
  113   HH11  ARG  17          HH11      ARG  17 -39.900  11.289 -10.130
  114   HH12  ARG  17          HH12      ARG  17 -41.182  11.279  -8.962
  115   HH21  ARG  17          HH21      ARG  17 -42.878  14.018 -10.376
  116   HH22  ARG  17          HH22      ARG  17 -42.871  12.850  -9.090
  117    H    GLU  18           HN       GLU  18 -40.226   8.846 -13.454
  118    HA   GLU  18           HA       GLU  18 -40.428   9.549 -10.807
  119    HB2  GLU  18           HB2      GLU  18 -40.970   6.879 -12.102
  120    HB3  GLU  18           HB1      GLU  18 -41.459   7.299 -10.469
  121    HG2  GLU  18           HG2      GLU  18 -43.342   7.570 -11.840
  122    HG3  GLU  18           HG1      GLU  18 -42.778   9.192 -11.442
  123    H    PHE  19           HN       PHE  19 -38.667   6.682 -12.040
  124    HA   PHE  19           HA       PHE  19 -37.651   6.375  -9.311
  125    HB2  PHE  19           HB2      PHE  19 -39.066   4.562 -10.550
  126    HB3  PHE  19           HB1      PHE  19 -37.551   4.191 -11.370
  127    HD1  PHE  19           HD1      PHE  19 -39.210   4.338  -8.075
  128    HD2  PHE  19           HD2      PHE  19 -35.839   3.006 -10.309
  129    HE1  PHE  19           HE1      PHE  19 -38.514   2.945  -6.172
  130    HE2  PHE  19           HE2      PHE  19 -35.141   1.597  -8.410
  131    HZ   PHE  19           HZ       PHE  19 -36.512   1.601  -6.302
  132    H    LEU  20           HN       LEU  20 -35.534   5.975  -8.878
  133    HA   LEU  20           HA       LEU  20 -33.650   6.982 -10.804
  134    HB2  LEU  20           HB2      LEU  20 -31.991   6.758  -8.998
  135    HB3  LEU  20           HB1      LEU  20 -33.384   7.700  -8.521
  136    HG   LEU  20           HG       LEU  20 -33.127   4.787  -7.788
  137   HD11  LEU  20          HD11      LEU  20 -31.137   5.908  -6.963
  138   HD12  LEU  20          HD12      LEU  20 -32.223   5.517  -5.630
  139   HD13  LEU  20          HD13      LEU  20 -32.129   7.172  -6.234
  140   HD21  LEU  20          HD21      LEU  20 -34.673   7.083  -6.571
  141   HD22  LEU  20          HD22      LEU  20 -34.647   5.426  -5.968
  142   HD23  LEU  20          HD23      LEU  20 -35.347   5.777  -7.546
  143    H    ALA  21           HN       ALA  21 -33.825   5.339 -12.387
  144    HA   ALA  21           HA       ALA  21 -32.068   3.072 -11.798
  145    HB1  ALA  21           HB1      ALA  21 -34.705   2.782 -13.244
  146    HB2  ALA  21           HB2      ALA  21 -34.368   2.213 -11.609
  147    HB3  ALA  21           HB3      ALA  21 -33.519   1.502 -12.985
  148    H    ALA  22           HN       ALA  22 -30.600   4.524 -12.897
  149    HA   ALA  22           HA       ALA  22 -30.976   4.516 -15.821
  150    HB1  ALA  22           HB1      ALA  22 -29.345   6.429 -14.147
  151    HB2  ALA  22           HB2      ALA  22 -30.915   6.774 -14.868
  152    HB3  ALA  22           HB3      ALA  22 -29.517   6.482 -15.902
  153    H    MET  23           HN       MET  23 -28.463   4.445 -13.311
  154    HA   MET  23           HA       MET  23 -27.198   2.193 -14.566
  155    HB2  MET  23           HB2      MET  23 -26.294   4.095 -15.897
  156    HB3  MET  23           HB1      MET  23 -25.647   4.790 -14.418
  157    HG2  MET  23           HG2      MET  23 -24.207   2.852 -14.117
  158    HG3  MET  23           HG1      MET  23 -24.874   2.117 -15.574
  159    HE1  MET  23           HE1      MET  23 -24.439   3.036 -18.040
  160    HE2  MET  23           HE2      MET  23 -23.589   4.545 -18.373
  161    HE3  MET  23           HE3      MET  23 -25.146   4.574 -17.545
  162    H    GLU  24           HN       GLU  24 -28.133   1.779 -12.342
  163    HA   GLU  24           HA       GLU  24 -26.141   2.394 -10.258
  164    HB2  GLU  24           HB2      GLU  24 -28.599   2.944  -9.884
  165    HB3  GLU  24           HB1      GLU  24 -28.895   1.212  -9.862
  166    HG2  GLU  24           HG2      GLU  24 -28.749   2.085  -7.615
  167    HG3  GLU  24           HG1      GLU  24 -27.408   0.986  -7.939
  168    HA   PRO  25           HA       PRO  25 -24.990  -1.821 -11.258
  169    HB2  PRO  25           HB2      PRO  25 -22.539  -1.771 -10.172
  170    HB3  PRO  25           HB1      PRO  25 -22.909  -0.916 -11.673
  171    HG2  PRO  25           HG2      PRO  25 -22.659   0.151  -8.896
  172    HG3  PRO  25           HG1      PRO  25 -22.093   0.855 -10.420
  173    HD2  PRO  25           HD2      PRO  25 -24.405   1.600  -9.117
  174    HD3  PRO  25           HD1      PRO  25 -24.116   1.822 -10.854
  175    H    GLU  26           HN       GLU  26 -23.791  -3.599  -9.922
  176    HA   GLU  26           HA       GLU  26 -25.250  -3.884  -7.411
  177    HB2  GLU  26           HB2      GLU  26 -23.637  -5.885  -9.000
  178    HB3  GLU  26           HB1      GLU  26 -24.552  -6.251  -7.546
  179    HG2  GLU  26           HG2      GLU  26 -26.621  -5.653  -8.698
  180    HG3  GLU  26           HG1      GLU  26 -25.700  -5.286 -10.157
  181    HA   PRO  27           HA       PRO  27 -21.565  -3.047  -5.039
  182    HB2  PRO  27           HB2      PRO  27 -22.867  -4.639  -2.924
  183    HB3  PRO  27           HB1      PRO  27 -22.369  -2.944  -2.904
  184    HG2  PRO  27           HG2      PRO  27 -24.958  -3.644  -3.009
  185    HG3  PRO  27           HG1      PRO  27 -24.339  -2.218  -3.862
  186    HD2  PRO  27           HD2      PRO  27 -25.007  -4.930  -4.951
  187    HD3  PRO  27           HD1      PRO  27 -25.333  -3.325  -5.640
  188    H    ALA  28           HN       ALA  28 -19.933  -4.268  -5.873
  189    HA   ALA  28           HA       ALA  28 -19.903  -7.107  -5.900
  190    HB1  ALA  28           HB1      ALA  28 -18.599  -5.795  -7.492
  191    HB2  ALA  28           HB2      ALA  28 -17.552  -6.870  -6.563
  192    HB3  ALA  28           HB3      ALA  28 -17.618  -5.150  -6.177
  193    HA   PRO  29           HA       PRO  29 -18.777  -8.060  -1.735
  194    HB2  PRO  29           HB2      PRO  29 -17.142 -10.230  -2.284
  195    HB3  PRO  29           HB1      PRO  29 -18.895 -10.297  -2.103
  196    HG2  PRO  29           HG2      PRO  29 -17.242 -10.197  -4.583
  197    HG3  PRO  29           HG1      PRO  29 -18.738 -11.095  -4.263
  198    HD2  PRO  29           HD2      PRO  29 -18.730  -8.845  -5.725
  199    HD3  PRO  29           HD1      PRO  29 -20.074  -9.240  -4.634
  200    H    ALA  30           HN       ALA  30 -17.353  -7.075  -0.516
  201    HA   ALA  30           HA       ALA  30 -14.528  -7.301  -1.057
  202    HB1  ALA  30           HB1      ALA  30 -15.808  -4.574  -0.936
  203    HB2  ALA  30           HB2      ALA  30 -15.134  -5.334  -2.378
  204    HB3  ALA  30           HB3      ALA  30 -14.080  -4.914  -1.026
  205    HA   PRO  31           HA       PRO  31 -15.688  -7.199   3.457
  206    HB2  PRO  31           HB2      PRO  31 -14.586  -9.583   4.102
  207    HB3  PRO  31           HB1      PRO  31 -16.240  -9.436   3.497
  208    HG2  PRO  31           HG2      PRO  31 -13.740 -10.195   2.031
  209    HG3  PRO  31           HG1      PRO  31 -15.351 -10.925   1.935
  210    HD2  PRO  31           HD2      PRO  31 -14.426  -9.172   0.088
  211    HD3  PRO  31           HD1      PRO  31 -16.144  -9.303   0.509
  212    H    ALA  32           HN       ALA  32 -13.907  -5.517   2.806
  213    HA   ALA  32           HA       ALA  32 -11.259  -6.373   3.729
  214    HB1  ALA  32           HB1      ALA  32 -10.487  -4.189   2.870
  215    HB2  ALA  32           HB2      ALA  32 -12.143  -3.810   2.391
  216    HB3  ALA  32           HB3      ALA  32 -11.287  -5.147   1.624
  217    HA   PRO  33           HA       PRO  33 -12.006  -4.770   7.800
  218    HB2  PRO  33           HB2      PRO  33  -9.378  -4.021   8.329
  219    HB3  PRO  33           HB1      PRO  33 -10.061  -5.629   8.600
  220    HG2  PRO  33           HG2      PRO  33  -8.429  -4.616   6.311
  221    HG3  PRO  33           HG1      PRO  33  -8.391  -6.203   7.104
  222    HD2  PRO  33           HD2      PRO  33  -9.579  -5.863   4.732
  223    HD3  PRO  33           HD1      PRO  33 -10.256  -6.961   5.952
  224    H    GLU  34           HN       GLU  34  -9.856  -2.934   5.678
  225    HA   GLU  34           HA       GLU  34 -11.385  -0.535   6.059
  226    HB2  GLU  34           HB2      GLU  34  -9.878  -0.509   8.028
  227    HB3  GLU  34           HB1      GLU  34  -8.488  -0.625   6.958
  228    HG2  GLU  34           HG2      GLU  34  -8.850   1.650   7.759
  229    HG3  GLU  34           HG1      GLU  34  -9.009   1.540   6.006
  230    H    GLU  35           HN       GLU  35 -10.940   1.008   4.435
  231    HA   GLU  35           HA       GLU  35  -9.258  -0.070   2.266
  232    HB2  GLU  35           HB2      GLU  35 -11.762   1.608   2.017
  233    HB3  GLU  35           HB1      GLU  35 -10.778   1.031   0.677
  234    HG2  GLU  35           HG2      GLU  35 -11.241  -1.302   1.499
  235    HG3  GLU  35           HG1      GLU  35 -12.427  -0.590   2.589
  236    H    TRP  36           HN       TRP  36  -7.425   1.009   2.236
  237    HA   TRP  36           HA       TRP  36  -7.342   3.821   3.014
  238    HB2  TRP  36           HB2      TRP  36  -4.897   2.321   2.163
  239    HB3  TRP  36           HB1      TRP  36  -5.081   3.533   3.426
  240    HD1  TRP  36           HD1      TRP  36  -7.210   2.217   5.286
  241    HE1  TRP  36           HE1      TRP  36  -6.676   0.052   6.570
  242    HE3  TRP  36           HE3      TRP  36  -3.339   0.503   2.411
  243    HZ2  TRP  36           HZ2      TRP  36  -4.827  -2.082   6.396
  244    HZ3  TRP  36           HZ3      TRP  36  -2.260  -1.580   3.043
  245    HH2  TRP  36           HH2      TRP  36  -2.979  -2.859   4.966
  246    H    LEU  37           HN       LEU  37  -5.049   4.540   1.528
  247    HA   LEU  37           HA       LEU  37  -6.268   5.417  -0.880
  248    HB2  LEU  37           HB2      LEU  37  -4.602   6.759   0.302
  249    HB3  LEU  37           HB1      LEU  37  -3.383   5.531   0.020
  250    HG   LEU  37           HG       LEU  37  -3.597   5.940  -2.427
  251   HD11  LEU  37          HD11      LEU  37  -4.727   7.960  -3.194
  252   HD12  LEU  37          HD12      LEU  37  -5.329   8.248  -1.562
  253   HD13  LEU  37          HD13      LEU  37  -5.858   6.824  -2.460
  254   HD21  LEU  37          HD21      LEU  37  -2.401   8.085  -2.413
  255   HD22  LEU  37          HD22      LEU  37  -1.811   6.978  -1.173
  256   HD23  LEU  37          HD23      LEU  37  -2.866   8.321  -0.728
  257    H    ASP  38           HN       ASP  38  -6.692   4.045  -2.461
  258    HA   ASP  38           HA       ASP  38  -5.047   1.841  -3.166
  259    HB2  ASP  38           HB2      ASP  38  -6.485   2.011  -5.337
  260    HB3  ASP  38           HB1      ASP  38  -7.237   1.518  -3.826
  261    H    ILE  39           HN       ILE  39  -3.028   2.279  -3.644
  262    HA   ILE  39           HA       ILE  39  -1.872   4.470  -4.771
  263    HB   ILE  39           HB       ILE  39  -1.019   1.598  -5.121
  264   HG12  ILE  39          HG12      ILE  39  -0.543   3.628  -2.942
  265   HG13  ILE  39          HG11      ILE  39  -1.259   2.032  -2.799
  266   HG21  ILE  39          HG21      ILE  39   0.158   2.990  -6.682
  267   HG22  ILE  39          HG22      ILE  39   1.253   2.531  -5.378
  268   HG23  ILE  39          HG23      ILE  39   0.551   4.149  -5.413
  269   HD11  ILE  39          HD11      ILE  39   0.996   2.094  -1.882
  270   HD12  ILE  39          HD12      ILE  39   1.626   2.578  -3.457
  271   HD13  ILE  39          HD13      ILE  39   0.878   0.993  -3.254
  272    H    LEU  40           HN       LEU  40  -3.035   1.601  -6.537
  273    HA   LEU  40           HA       LEU  40  -2.602   3.096  -9.030
  274    HB2  LEU  40           HB2      LEU  40  -2.980   0.139  -8.612
  275    HB3  LEU  40           HB1      LEU  40  -2.720   0.918 -10.161
  276    HG   LEU  40           HG       LEU  40  -0.741   0.836  -7.875
  277   HD11  LEU  40          HD11      LEU  40  -0.743  -0.555 -10.554
  278   HD12  LEU  40          HD12      LEU  40  -1.005  -1.321  -8.986
  279   HD13  LEU  40          HD13      LEU  40   0.559  -0.600  -9.366
  280   HD21  LEU  40          HD21      LEU  40  -0.569   2.906  -9.181
  281   HD22  LEU  40          HD22      LEU  40  -0.446   1.958 -10.663
  282   HD23  LEU  40          HD23      LEU  40   0.823   1.854  -9.443
  283    H    GLY  41           HN       GLY  41  -4.964   2.705  -6.940
  284    HA2  GLY  41           HA2      GLY  41  -7.232   2.995  -7.044
  285    HA3  GLY  41           HA1      GLY  41  -7.026   3.370  -8.744
  286    H    ASN  42           HN       ASN  42  -5.786   0.381  -7.711
  287    HA   ASN  42           HA       ASN  42  -7.930  -0.988  -9.134
  288    HB2  ASN  42           HB2      ASN  42  -6.292  -2.939  -9.069
  289    HB3  ASN  42           HB1      ASN  42  -5.840  -1.537 -10.029
  290   HD21  ASN  42          HD21      ASN  42  -5.584  -1.562  -6.527
  291   HD22  ASN  42          HD22      ASN  42  -3.857  -1.555  -6.488
  292    H    GLY  43           HN       GLY  43  -6.632  -0.683  -5.917
  293    HA2  GLY  43           HA2      GLY  43  -8.178  -1.052  -4.119
  294    HA3  GLY  43           HA1      GLY  43  -8.862  -2.372  -5.048
  295    H    LEU  44           HN       LEU  44  -6.049  -3.347  -5.671
  296    HA   LEU  44           HA       LEU  44  -5.912  -4.914  -3.223
  297    HB2  LEU  44           HB2      LEU  44  -4.423  -6.452  -4.601
  298    HB3  LEU  44           HB1      LEU  44  -6.124  -6.388  -4.969
  299    HG   LEU  44           HG       LEU  44  -4.499  -6.564  -6.912
  300   HD11  LEU  44          HD11      LEU  44  -6.836  -6.070  -7.255
  301   HD12  LEU  44          HD12      LEU  44  -5.838  -5.122  -8.357
  302   HD13  LEU  44          HD13      LEU  44  -6.546  -4.361  -6.939
  303   HD21  LEU  44          HD21      LEU  44  -2.889  -4.910  -6.224
  304   HD22  LEU  44          HD22      LEU  44  -4.123  -3.652  -6.291
  305   HD23  LEU  44          HD23      LEU  44  -3.612  -4.460  -7.771
  306    H    LEU  45           HN       LEU  45  -4.290  -2.408  -4.666
  307    HA   LEU  45           HA       LEU  45  -2.016  -2.822  -2.859
  308    HB2  LEU  45           HB2      LEU  45  -1.146  -2.951  -5.059
  309    HB3  LEU  45           HB1      LEU  45  -2.092  -1.581  -5.596
  310    HG   LEU  45           HG       LEU  45  -0.707  -0.075  -4.276
  311   HD11  LEU  45          HD11      LEU  45   1.257  -0.864  -3.105
  312   HD12  LEU  45          HD12      LEU  45   0.866  -2.532  -3.526
  313   HD13  LEU  45          HD13      LEU  45  -0.194  -1.621  -2.446
  314   HD21  LEU  45          HD21      LEU  45   0.888  -1.969  -5.992
  315   HD22  LEU  45          HD22      LEU  45   1.379  -0.339  -5.528
  316   HD23  LEU  45          HD23      LEU  45  -0.037  -0.572  -6.553
  317    H    ARG  46           HN       ARG  46  -2.356  -1.593  -1.122
  318    HA   ARG  46           HA       ARG  46  -3.025   1.246  -1.501
  319    HB2  ARG  46           HB2      ARG  46  -4.498  -0.622   0.369
  320    HB3  ARG  46           HB1      ARG  46  -4.667   1.127   0.362
  321    HG2  ARG  46           HG2      ARG  46  -5.553   1.067  -1.873
  322    HG3  ARG  46           HG1      ARG  46  -5.310  -0.672  -1.959
  323    HD2  ARG  46           HD2      ARG  46  -7.109   0.734   0.002
  324    HD3  ARG  46           HD1      ARG  46  -7.650  -0.057  -1.479
  325    HE   ARG  46           HE       ARG  46  -6.126  -1.731   0.313
  326   HH11  ARG  46          HH11      ARG  46  -9.311  -0.674  -0.694
  327   HH12  ARG  46          HH12      ARG  46 -10.131  -2.000   0.057
  328   HH21  ARG  46          HH21      ARG  46  -7.182  -3.486   1.300
  329   HH22  ARG  46          HH22      ARG  46  -8.908  -3.620   1.170
  330    H    LYS  47           HN       LYS  47  -2.111   2.615   0.039
  331    HA   LYS  47           HA       LYS  47  -0.413   1.309   2.083
  332    HB2  LYS  47           HB2      LYS  47   0.741   2.732   0.283
  333    HB3  LYS  47           HB1      LYS  47  -0.044   4.120   1.025
  334    HG2  LYS  47           HG2      LYS  47   1.053   3.148   3.212
  335    HG3  LYS  47           HG1      LYS  47   2.146   2.397   2.057
  336    HD2  LYS  47           HD2      LYS  47   3.113   4.451   2.807
  337    HD3  LYS  47           HD1      LYS  47   2.621   4.650   1.132
  338    HE2  LYS  47           HE2      LYS  47   0.809   6.015   1.703
  339    HE3  LYS  47           HE1      LYS  47   0.824   5.478   3.383
  340    HZ1  LYS  47           HZ1      LYS  47   1.711   7.705   3.199
  341    HZ2  LYS  47           HZ2      LYS  47   2.876   7.201   2.088
  342    HZ3  LYS  47           HZ3      LYS  47   2.940   6.645   3.695
  343    H    LYS  48           HN       LYS  48  -0.922   1.679   4.176
  344    HA   LYS  48           HA       LYS  48  -2.723   3.933   4.767
  345    HB2  LYS  48           HB2      LYS  48  -3.398   1.566   5.450
  346    HB3  LYS  48           HB1      LYS  48  -2.104   1.658   6.641
  347    HG2  LYS  48           HG2      LYS  48  -3.424   3.994   7.082
  348    HG3  LYS  48           HG1      LYS  48  -4.742   2.914   6.624
  349    HD2  LYS  48           HD2      LYS  48  -2.703   2.356   8.776
  350    HD3  LYS  48           HD1      LYS  48  -4.325   2.978   9.059
  351    HE2  LYS  48           HE2      LYS  48  -5.138   0.880   7.830
  352    HE3  LYS  48           HE1      LYS  48  -3.499   0.255   8.072
  353    HZ1  LYS  48           HZ1      LYS  48  -4.555  -0.493   9.957
  354    HZ2  LYS  48           HZ2      LYS  48  -5.604   0.831  10.045
  355    HZ3  LYS  48           HZ3      LYS  48  -3.985   0.998  10.528
  356    H    THR  49           HN       THR  49  -1.984   5.604   5.855
  357    HA   THR  49           HA       THR  49   0.700   5.627   6.891
  358    HB   THR  49           HB       THR  49  -0.097   7.974   7.661
  359    HG1  THR  49           HG1      THR  49  -2.253   7.981   7.442
  360   HG21  THR  49          HG21      THR  49   1.410   7.627   5.794
  361   HG22  THR  49          HG22      THR  49   0.222   8.865   5.383
  362   HG23  THR  49          HG23      THR  49   0.050   7.231   4.740
  363    H    LEU  50           HN       LEU  50   0.862   4.324   8.679
  364    HA   LEU  50           HA       LEU  50  -0.911   4.456  10.916
  365    HB2  LEU  50           HB2      LEU  50   2.036   3.877  11.107
  366    HB3  LEU  50           HB1      LEU  50   0.730   3.205  12.067
  367    HG   LEU  50           HG       LEU  50   1.066   2.590   9.139
  368   HD11  LEU  50          HD11      LEU  50   3.081   1.902  10.314
  369   HD12  LEU  50          HD12      LEU  50   2.119   0.502   9.829
  370   HD13  LEU  50          HD13      LEU  50   2.105   1.045  11.508
  371   HD21  LEU  50          HD21      LEU  50  -1.138   2.186  10.079
  372   HD22  LEU  50          HD22      LEU  50  -0.418   1.225  11.372
  373   HD23  LEU  50          HD23      LEU  50  -0.324   0.668   9.702
  374    H    VAL  51           HN       VAL  51   2.255   5.745  10.226
  375    HA   VAL  51           HA       VAL  51   1.539   8.335  11.413
  376    HB   VAL  51           HB       VAL  51   4.215   6.963  11.693
  377   HG11  VAL  51          HG11      VAL  51   4.838   8.881  13.088
  378   HG12  VAL  51          HG12      VAL  51   3.276   9.629  12.749
  379   HG13  VAL  51          HG13      VAL  51   4.431   9.365  11.443
  380   HG21  VAL  51          HG21      VAL  51   3.749   6.938  14.109
  381   HG22  VAL  51          HG22      VAL  51   2.599   5.970  13.184
  382   HG23  VAL  51          HG23      VAL  51   2.133   7.564  13.778
  383    HA   PRO  52           HA       PRO  52   3.529   9.119   7.468
  384    HB2  PRO  52           HB2      PRO  52   2.095  11.225   6.787
  385    HB3  PRO  52           HB1      PRO  52   1.353   9.628   6.975
  386    HG2  PRO  52           HG2      PRO  52   1.187  11.998   8.767
  387    HG3  PRO  52           HG1      PRO  52  -0.014  10.729   8.469
  388    HD2  PRO  52           HD2      PRO  52   1.925  10.885  10.592
  389    HD3  PRO  52           HD1      PRO  52   0.713   9.619  10.303
  390    H    GLY  53           HN       GLY  53   5.315   9.622   9.256
  391    HA2  GLY  53           HA2      GLY  53   7.254  10.839   9.379
  392    HA3  GLY  53           HA1      GLY  53   6.541  12.013   8.286
  393    HA   PRO  54           HA       PRO  54   6.494  13.866  12.582
  394    HB2  PRO  54           HB2      PRO  54   8.713  15.390  12.467
  395    HB3  PRO  54           HB1      PRO  54   8.764  13.723  13.058
  396    HG2  PRO  54           HG2      PRO  54   9.518  14.815  10.379
  397    HG3  PRO  54           HG1      PRO  54  10.342  13.588  11.359
  398    HD2  PRO  54           HD2      PRO  54   8.696  13.005   9.244
  399    HD3  PRO  54           HD1      PRO  54   8.979  11.902  10.605
  400    HA   PRO  55           HA       PRO  55   4.810  17.571  10.778
  401    HB2  PRO  55           HB2      PRO  55   6.143  19.214  12.847
  402    HB3  PRO  55           HB1      PRO  55   4.423  19.047  12.481
  403    HG2  PRO  55           HG2      PRO  55   5.473  17.940  14.669
  404    HG3  PRO  55           HG1      PRO  55   4.200  17.121  13.741
  405    HD2  PRO  55           HD2      PRO  55   7.154  16.607  13.775
  406    HD3  PRO  55           HD1      PRO  55   5.807  15.448  13.734
  407    H    GLY  56           HN       GLY  56   6.227  17.385   8.933
  408    HA2  GLY  56           HA2      GLY  56   7.326  19.162   7.589
  409    HA3  GLY  56           HA1      GLY  56   8.416  19.374   8.951
  410    H    SER  57           HN       SER  57   7.214  16.438   7.328
  411    HA   SER  57           HA       SER  57   9.894  15.387   7.195
  412    HB2  SER  57           HB2      SER  57   8.528  13.466   6.111
  413    HB3  SER  57           HB1      SER  57   8.326  13.771   7.837
  414    HG   SER  57           HG       SER  57   6.581  14.185   5.705
  415    H    SER  58           HN       SER  58   9.975  13.946   4.978
  416    HA   SER  58           HA       SER  58   9.218  15.467   2.640
  417    HB2  SER  58           HB2      SER  58  12.130  14.796   3.107
  418    HB3  SER  58           HB1      SER  58  11.446  15.746   1.785
  419    HG   SER  58           HG       SER  58  10.687  16.988   3.934
  420    H    ARG  59           HN       ARG  59   8.611  13.954   1.130
  421    HA   ARG  59           HA       ARG  59   9.497  11.234   1.615
  422    HB2  ARG  59           HB2      ARG  59   7.913  10.691  -0.314
  423    HB3  ARG  59           HB1      ARG  59   7.223  11.206   1.226
  424    HG2  ARG  59           HG2      ARG  59   6.880  13.446   0.307
  425    HG3  ARG  59           HG1      ARG  59   7.546  12.901  -1.243
  426    HD2  ARG  59           HD2      ARG  59   5.807  11.189  -1.390
  427    HD3  ARG  59           HD1      ARG  59   5.150  11.722   0.152
  428    HE   ARG  59           HE       ARG  59   5.012  13.968  -1.305
  429   HH11  ARG  59          HH11      ARG  59   4.122  10.669  -2.066
  430   HH12  ARG  59          HH12      ARG  59   2.727  11.123  -2.994
  431   HH21  ARG  59          HH21      ARG  59   3.172  14.572  -2.521
  432   HH22  ARG  59          HH22      ARG  59   2.176  13.345  -3.240
  433    HA   PRO  60           HA       PRO  60  12.962  11.541  -1.010
  434    HB2  PRO  60           HB2      PRO  60  13.187   8.815  -1.466
  435    HB3  PRO  60           HB1      PRO  60  13.840   9.673  -0.065
  436    HG2  PRO  60           HG2      PRO  60  11.283   8.143  -0.332
  437    HG3  PRO  60           HG1      PRO  60  12.432   8.176   1.019
  438    HD2  PRO  60           HD2      PRO  60  10.162   9.551   1.152
  439    HD3  PRO  60           HD1      PRO  60  11.673  10.245   1.773
  440    H    VAL  61           HN       VAL  61  13.615  11.272  -3.128
  441    HA   VAL  61           HA       VAL  61  11.444  10.812  -5.038
  442    HB   VAL  61           HB       VAL  61  14.228  11.805  -5.654
  443   HG11  VAL  61          HG11      VAL  61  11.603  12.103  -7.108
  444   HG12  VAL  61          HG12      VAL  61  12.936  11.047  -7.573
  445   HG13  VAL  61          HG13      VAL  61  13.142  12.798  -7.620
  446   HG21  VAL  61          HG21      VAL  61  11.810  13.452  -4.928
  447   HG22  VAL  61          HG22      VAL  61  13.343  14.089  -5.521
  448   HG23  VAL  61          HG23      VAL  61  13.270  13.272  -3.959
  449    H    LYS  62           HN       LYS  62  11.781   9.391  -6.853
  450    HA   LYS  62           HA       LYS  62  13.128   6.970  -6.192
  451    HB2  LYS  62           HB2      LYS  62  12.174   7.760  -8.951
  452    HB3  LYS  62           HB1      LYS  62  12.349   6.140  -8.287
  453    HG2  LYS  62           HG2      LYS  62  10.557   6.832  -6.602
  454    HG3  LYS  62           HG1      LYS  62  10.253   8.196  -7.679
  455    HD2  LYS  62           HD2      LYS  62   8.743   6.653  -8.485
  456    HD3  LYS  62           HD1      LYS  62  10.141   6.322  -9.511
  457    HE2  LYS  62           HE2      LYS  62  10.800   4.564  -7.821
  458    HE3  LYS  62           HE1      LYS  62   9.213   4.800  -7.092
  459    HZ1  LYS  62           HZ1      LYS  62   9.185   2.952  -8.618
  460    HZ2  LYS  62           HZ2      LYS  62   9.746   3.940  -9.879
  461    HZ3  LYS  62           HZ3      LYS  62   8.205   4.209  -9.223
  462    H    GLY  63           HN       GLY  63  15.126   6.475  -6.412
  463    HA2  GLY  63           HA2      GLY  63  17.156   6.617  -7.875
  464    HA3  GLY  63           HA1      GLY  63  16.862   8.353  -7.873
  465    H    GLN  64           HN       GLN  64  15.885   8.157  -5.041
  466    HA   GLN  64           HA       GLN  64  18.482   8.423  -3.799
  467    HB2  GLN  64           HB2      GLN  64  15.881   8.413  -2.298
  468    HB3  GLN  64           HB1      GLN  64  17.393   9.220  -1.879
  469    HG2  GLN  64           HG2      GLN  64  15.456  10.016  -4.047
  470    HG3  GLN  64           HG1      GLN  64  15.719  10.830  -2.512
  471   HE21  GLN  64          HE21      GLN  64  18.195   9.616  -4.747
  472   HE22  GLN  64          HE22      GLN  64  18.890  11.175  -5.071
  473    H    VAL  65           HN       VAL  65  19.381   7.077  -2.324
  474    HA   VAL  65           HA       VAL  65  18.351   4.374  -2.207
  475    HB   VAL  65           HB       VAL  65  20.856   5.648  -1.092
  476   HG11  VAL  65          HG11      VAL  65  20.045   2.747  -0.996
  477   HG12  VAL  65          HG12      VAL  65  20.081   3.839   0.390
  478   HG13  VAL  65          HG13      VAL  65  21.578   3.422  -0.446
  479   HG21  VAL  65          HG21      VAL  65  20.429   3.614  -3.268
  480   HG22  VAL  65          HG22      VAL  65  21.981   4.283  -2.760
  481   HG23  VAL  65          HG23      VAL  65  20.776   5.325  -3.522
  482    H    VAL  66           HN       VAL  66  17.074   3.673  -0.628
  483    HA   VAL  66           HA       VAL  66  16.795   5.343   1.767
  484    HB   VAL  66           HB       VAL  66  14.341   4.892   1.698
  485   HG11  VAL  66          HG11      VAL  66  15.125   7.044   0.966
  486   HG12  VAL  66          HG12      VAL  66  13.864   6.509  -0.142
  487   HG13  VAL  66          HG13      VAL  66  15.559   6.398  -0.616
  488   HG21  VAL  66          HG21      VAL  66  14.410   2.928   0.250
  489   HG22  VAL  66          HG22      VAL  66  14.953   3.937  -1.094
  490   HG23  VAL  66          HG23      VAL  66  13.347   4.170  -0.409
  491    H    THR  67           HN       THR  67  16.260   4.364   3.662
  492    HA   THR  67           HA       THR  67  16.547   1.444   3.691
  493    HB   THR  67           HB       THR  67  16.949   1.768   6.153
  494    HG1  THR  67           HG1      THR  67  17.658   4.036   6.610
  495   HG21  THR  67          HG21      THR  67  19.240   2.564   5.910
  496   HG22  THR  67          HG22      THR  67  18.856   3.187   4.302
  497   HG23  THR  67          HG23      THR  67  18.808   1.451   4.613
  498    H    VAL  68           HN       VAL  68  14.639   0.429   3.725
  499    HA   VAL  68           HA       VAL  68  12.580   1.589   5.461
  500    HB   VAL  68           HB       VAL  68  10.935   0.139   4.319
  501   HG11  VAL  68          HG11      VAL  68  10.814   1.432   2.253
  502   HG12  VAL  68          HG12      VAL  68  12.488   1.943   2.461
  503   HG13  VAL  68          HG13      VAL  68  11.261   2.461   3.617
  504   HG21  VAL  68          HG21      VAL  68  13.191  -0.480   2.404
  505   HG22  VAL  68          HG22      VAL  68  11.504  -0.969   2.228
  506   HG23  VAL  68          HG23      VAL  68  12.476  -1.611   3.552
  507    H    HIS  69           HN       HIS  69  11.721   0.380   7.092
  508    HA   HIS  69           HA       HIS  69  12.885  -2.295   7.500
  509    HB2  HIS  69           HB2      HIS  69  13.038  -0.854   9.475
  510    HB3  HIS  69           HB1      HIS  69  11.316  -0.495   9.389
  511    HD1  HIS  69           HD1      HIS  69  12.786  -1.907  11.890
  512    HD2  HIS  69           HD2      HIS  69  10.523  -3.768   8.939
  513    HE1  HIS  69           HE1      HIS  69  11.926  -4.068  12.894
  514    HE2  HIS  69           HE2      HIS  69  10.456  -5.057  11.166
  515    H    LEU  70           HN       LEU  70  11.673  -3.892   6.639
  516    HA   LEU  70           HA       LEU  70   8.782  -3.432   6.705
  517    HB2  LEU  70           HB2      LEU  70   8.432  -4.260   4.656
  518    HB3  LEU  70           HB1      LEU  70  10.067  -3.696   4.401
  519    HG   LEU  70           HG       LEU  70   9.427  -6.527   5.165
  520   HD11  LEU  70          HD11      LEU  70   9.732  -7.058   2.764
  521   HD12  LEU  70          HD12      LEU  70   9.772  -5.331   2.412
  522   HD13  LEU  70          HD13      LEU  70   8.306  -6.063   3.062
  523   HD21  LEU  70          HD21      LEU  70  11.649  -6.984   4.279
  524   HD22  LEU  70          HD22      LEU  70  11.724  -5.779   5.567
  525   HD23  LEU  70          HD23      LEU  70  11.853  -5.277   3.882
  526    H    GLN  71           HN       GLN  71   7.566  -4.792   7.666
  527    HA   GLN  71           HA       GLN  71   8.460  -7.575   7.974
  528    HB2  GLN  71           HB2      GLN  71   6.584  -6.522   9.995
  529    HB3  GLN  71           HB1      GLN  71   7.812  -7.761  10.166
  530    HG2  GLN  71           HG2      GLN  71   8.780  -6.204  11.445
  531    HG3  GLN  71           HG1      GLN  71   9.410  -5.676   9.890
  532   HE21  GLN  71          HE21      GLN  71   6.725  -4.752   9.098
  533   HE22  GLN  71          HE22      GLN  71   6.560  -3.224   9.888
  534    H    THR  72           HN       THR  72   7.188  -8.721   6.851
  535    HA   THR  72           HA       THR  72   4.717  -7.478   5.944
  536    HB   THR  72           HB       THR  72   6.407  -9.620   4.683
  537    HG1  THR  72           HG1      THR  72   7.411  -8.019   3.673
  538   HG21  THR  72          HG21      THR  72   4.092  -9.786   4.022
  539   HG22  THR  72          HG22      THR  72   5.056  -9.150   2.686
  540   HG23  THR  72          HG23      THR  72   4.058  -8.061   3.654
  541    H    SER  73           HN       SER  73   2.863  -8.330   6.451
  542    HA   SER  73           HA       SER  73   2.789 -11.008   7.637
  543    HB2  SER  73           HB2      SER  73   1.982  -8.929   8.936
  544    HB3  SER  73           HB1      SER  73   0.640  -8.884   7.800
  545    HG   SER  73           HG       SER  73   0.079 -10.039   9.668
  546    H    LEU  74           HN       LEU  74   0.976 -12.315   7.079
  547    HA   LEU  74           HA       LEU  74   0.219 -12.061   4.307
  548    HB2  LEU  74           HB2      LEU  74  -0.234 -14.183   6.379
  549    HB3  LEU  74           HB1      LEU  74  -0.962 -14.263   4.794
  550    HG   LEU  74           HG       LEU  74   1.893 -14.547   5.591
  551   HD11  LEU  74          HD11      LEU  74   1.770 -16.461   4.058
  552   HD12  LEU  74          HD12      LEU  74   0.084 -16.067   3.725
  553   HD13  LEU  74          HD13      LEU  74   0.572 -16.556   5.349
  554   HD21  LEU  74          HD21      LEU  74   1.942 -12.787   3.943
  555   HD22  LEU  74          HD22      LEU  74   0.922 -13.739   2.861
  556   HD23  LEU  74          HD23      LEU  74   2.558 -14.286   3.238
  557    H    GLU  75           HN       GLU  75  -2.079 -12.442   3.697
  558    HA   GLU  75           HA       GLU  75  -3.729 -10.455   4.650
  559    HB2  GLU  75           HB2      GLU  75  -5.562 -11.698   3.474
  560    HB3  GLU  75           HB1      GLU  75  -4.129 -11.372   2.513
  561    HG2  GLU  75           HG2      GLU  75  -3.366 -13.660   2.861
  562    HG3  GLU  75           HG1      GLU  75  -4.802 -13.987   3.828
  563    H    ASN  76           HN       ASN  76  -3.092 -13.493   6.092
  564    HA   ASN  76           HA       ASN  76  -5.593 -13.458   7.620
  565    HB2  ASN  76           HB2      ASN  76  -5.259 -15.701   8.098
  566    HB3  ASN  76           HB1      ASN  76  -4.551 -15.563   6.492
  567   HD21  ASN  76          HD21      ASN  76  -2.382 -15.896   6.224
  568   HD22  ASN  76          HD22      ASN  76  -1.345 -16.460   7.494
  569    H    GLY  77           HN       GLY  77  -2.367 -12.481   7.866
  570    HA2  GLY  77           HA2      GLY  77  -1.733 -11.112   9.746
  571    HA3  GLY  77           HA1      GLY  77  -2.672 -12.173  10.780
  572    H    THR  78           HN       THR  78  -0.653 -13.649   8.372
  573    HA   THR  78           HA       THR  78   1.209 -14.470  10.484
  574    HB   THR  78           HB       THR  78   1.069 -15.616   7.698
  575    HG1  THR  78           HG1      THR  78  -0.599 -16.012   9.889
  576   HG21  THR  78          HG21      THR  78   2.127 -16.745  10.293
  577   HG22  THR  78          HG22      THR  78   3.112 -16.075   8.992
  578   HG23  THR  78          HG23      THR  78   2.170 -17.540   8.719
  579    H    ARG  79           HN       ARG  79   2.903 -13.147  10.684
  580    HA   ARG  79           HA       ARG  79   3.953 -11.682   8.460
  581    HB2  ARG  79           HB2      ARG  79   4.926 -12.060  11.284
  582    HB3  ARG  79           HB1      ARG  79   5.776 -11.078  10.092
  583    HG2  ARG  79           HG2      ARG  79   3.231 -10.164   9.851
  584    HG3  ARG  79           HG1      ARG  79   3.324 -10.524  11.581
  585    HD2  ARG  79           HD2      ARG  79   5.206  -9.107  11.854
  586    HD3  ARG  79           HD1      ARG  79   5.414  -8.933  10.108
  587    HE   ARG  79           HE       ARG  79   2.947  -7.930  10.512
  588   HH11  ARG  79          HH11      ARG  79   5.968  -7.335  12.149
  589   HH12  ARG  79          HH12      ARG  79   5.634  -5.659  12.446
  590   HH21  ARG  79          HH21      ARG  79   2.492  -5.708  10.896
  591   HH22  ARG  79          HH22      ARG  79   3.676  -4.708  11.679
  592    H    VAL  80           HN       VAL  80   5.143 -12.421   6.967
  593    HA   VAL  80           HA       VAL  80   6.379 -15.045   7.285
  594    HB   VAL  80           HB       VAL  80   6.374 -15.093   4.822
  595   HG11  VAL  80          HG11      VAL  80   3.719 -14.356   6.032
  596   HG12  VAL  80          HG12      VAL  80   4.462 -15.955   6.080
  597   HG13  VAL  80          HG13      VAL  80   3.959 -15.261   4.538
  598   HG21  VAL  80          HG21      VAL  80   6.607 -12.701   4.391
  599   HG22  VAL  80          HG22      VAL  80   4.999 -12.422   5.059
  600   HG23  VAL  80          HG23      VAL  80   5.187 -13.350   3.571
  601    H    GLN  81           HN       GLN  81   7.269 -11.834   7.278
  602    HA   GLN  81           HA       GLN  81  10.056 -12.452   7.089
  603    HB2  GLN  81           HB2      GLN  81  10.512 -10.911   5.182
  604    HB3  GLN  81           HB1      GLN  81   9.604 -12.343   4.717
  605    HG2  GLN  81           HG2      GLN  81   7.527 -10.921   4.927
  606    HG3  GLN  81           HG1      GLN  81   8.606  -9.533   5.014
  607   HE21  GLN  81          HE21      GLN  81   7.369 -12.091   3.040
  608   HE22  GLN  81          HE22      GLN  81   7.915 -11.472   1.524
  609    H    GLU  82           HN       GLU  82  11.060 -11.179   8.506
  610    HA   GLU  82           HA       GLU  82  10.043  -8.447   8.895
  611    HB2  GLU  82           HB2      GLU  82   9.309  -9.842  10.790
  612    HB3  GLU  82           HB1      GLU  82  10.973 -10.304  11.096
  613    HG2  GLU  82           HG2      GLU  82  11.533  -8.262  11.973
  614    HG3  GLU  82           HG1      GLU  82  10.263  -7.421  11.091
  615    H    GLU  83           HN       GLU  83  11.532  -7.204   8.073
  616    HA   GLU  83           HA       GLU  83  14.354  -7.765   8.646
  617    HB2  GLU  83           HB2      GLU  83  14.260  -8.415   6.431
  618    HB3  GLU  83           HB1      GLU  83  12.969  -7.296   6.047
  619    HG2  GLU  83           HG2      GLU  83  14.420  -5.520   5.745
  620    HG3  GLU  83           HG1      GLU  83  15.734  -6.308   6.616
  621    HA   PRO  84           HA       PRO  84  13.899  -3.806  10.456
  622    HB2  PRO  84           HB2      PRO  84  16.764  -3.912  10.984
  623    HB3  PRO  84           HB1      PRO  84  15.415  -3.989  12.118
  624    HG2  PRO  84           HG2      PRO  84  16.987  -6.126  11.585
  625    HG3  PRO  84           HG1      PRO  84  15.268  -6.284  11.998
  626    HD2  PRO  84           HD2      PRO  84  16.597  -6.377   9.313
  627    HD3  PRO  84           HD1      PRO  84  15.296  -7.401   9.963
  628    H    GLU  85           HN       GLU  85  16.068  -4.400   7.810
  629    HA   GLU  85           HA       GLU  85  15.907  -1.666   7.027
  630    HB2  GLU  85           HB2      GLU  85  17.682  -1.598   8.794
  631    HB3  GLU  85           HB1      GLU  85  18.659  -2.658   7.785
  632    HG2  GLU  85           HG2      GLU  85  18.935  -1.019   6.142
  633    HG3  GLU  85           HG1      GLU  85  17.623  -0.030   6.785
  634    H    LEU  86           HN       LEU  86  15.200  -2.231   5.204
  635    HA   LEU  86           HA       LEU  86  16.907  -3.719   3.362
  636    HB2  LEU  86           HB2      LEU  86  14.634  -4.549   3.592
  637    HB3  LEU  86           HB1      LEU  86  13.991  -2.950   3.317
  638    HG   LEU  86           HG       LEU  86  14.658  -2.988   1.051
  639   HD11  LEU  86          HD11      LEU  86  16.771  -4.178   1.255
  640   HD12  LEU  86          HD12      LEU  86  15.753  -4.928   0.025
  641   HD13  LEU  86          HD13      LEU  86  15.907  -5.671   1.617
  642   HD21  LEU  86          HD21      LEU  86  13.322  -4.918   0.255
  643   HD22  LEU  86          HD22      LEU  86  12.542  -4.003   1.547
  644   HD23  LEU  86          HD23      LEU  86  13.326  -5.543   1.908
  645    H    VAL  87           HN       VAL  87  18.250  -2.346   2.359
  646    HA   VAL  87           HA       VAL  87  17.293   0.370   1.767
  647    HB   VAL  87           HB       VAL  87  19.355   0.063   3.183
  648   HG11  VAL  87          HG11      VAL  87  20.599  -0.821   0.591
  649   HG12  VAL  87          HG12      VAL  87  20.330  -1.835   2.008
  650   HG13  VAL  87          HG13      VAL  87  21.461  -0.484   2.094
  651   HG21  VAL  87          HG21      VAL  87  19.683   1.577   0.613
  652   HG22  VAL  87          HG22      VAL  87  20.616   1.837   2.088
  653   HG23  VAL  87          HG23      VAL  87  18.881   2.151   2.074
  654    H    PHE  88           HN       PHE  88  17.277   1.132  -0.323
  655    HA   PHE  88           HA       PHE  88  18.402  -0.408  -2.492
  656    HB2  PHE  88           HB2      PHE  88  16.300  -0.953  -3.577
  657    HB3  PHE  88           HB1      PHE  88  16.381  -1.713  -1.995
  658    HD1  PHE  88           HD2      PHE  88  15.195  -0.489  -0.072
  659    HD2  PHE  88           HD1      PHE  88  14.442   0.298  -4.186
  660    HE1  PHE  88           HE2      PHE  88  13.034   0.523   0.522
  661    HE2  PHE  88           HE1      PHE  88  12.287   1.313  -3.605
  662    HZ   PHE  88           HZ       PHE  88  11.506   1.324  -1.316
  663    H    THR  89           HN       THR  89  17.823   0.538  -4.634
  664    HA   THR  89           HA       THR  89  17.706   3.439  -4.460
  665    HB   THR  89           HB       THR  89  17.974   1.700  -6.923
  666    HG1  THR  89           HG1      THR  89  19.928   1.333  -6.228
  667   HG21  THR  89          HG21      THR  89  18.936   3.727  -7.930
  668   HG22  THR  89          HG22      THR  89  18.648   4.607  -6.430
  669   HG23  THR  89          HG23      THR  89  17.286   4.009  -7.376
  670    H    LEU  90           HN       LEU  90  15.749   4.326  -4.353
  671    HA   LEU  90           HA       LEU  90  13.308   3.117  -4.841
  672    HB2  LEU  90           HB2      LEU  90  13.898   5.370  -3.709
  673    HB3  LEU  90           HB1      LEU  90  13.745   6.046  -5.301
  674    HG   LEU  90           HG       LEU  90  11.427   5.396  -5.428
  675   HD11  LEU  90          HD11      LEU  90  10.316   4.292  -3.548
  676   HD12  LEU  90          HD12      LEU  90  11.869   4.131  -2.728
  677   HD13  LEU  90          HD13      LEU  90  11.579   3.277  -4.245
  678   HD21  LEU  90          HD21      LEU  90  12.049   6.676  -2.768
  679   HD22  LEU  90          HD22      LEU  90  10.515   6.772  -3.632
  680   HD23  LEU  90          HD23      LEU  90  11.961   7.512  -4.318
  681    H    GLY  91           HN       GLY  91  12.429   2.375  -6.675
  682    HA2  GLY  91           HA2      GLY  91  11.381   2.866  -8.735
  683    HA3  GLY  91           HA1      GLY  91  12.578   4.114  -9.025
  684    H    ASP  92           HN       ASP  92  14.315   1.535  -7.944
  685    HA   ASP  92           HA       ASP  92  14.894   0.819 -10.732
  686    HB2  ASP  92           HB2      ASP  92  16.731   1.731  -9.188
  687    HB3  ASP  92           HB1      ASP  92  16.665   0.153  -8.401
  688    H    CYS  93           HN       CYS  93  12.896  -0.144  -8.583
  689    HA   CYS  93           HA       CYS  93  11.775  -2.077  -8.157
  690    HB2  CYS  93           HB2      CYS  93  13.329  -3.223 -10.469
  691    HB3  CYS  93           HB1      CYS  93  11.782  -3.788  -9.837
  692    HG   CYS  93           HG       CYS  93  11.988  -0.632 -11.074
  693    H    ASP  94           HN       ASP  94  14.376  -1.575  -6.939
  694    HA   ASP  94           HA       ASP  94  15.871  -3.958  -6.858
  695    HB2  ASP  94           HB2      ASP  94  15.749  -1.523  -5.120
  696    HB3  ASP  94           HB1      ASP  94  16.642  -2.934  -4.592
  697    H    VAL  95           HN       VAL  95  12.893  -3.196  -5.763
  698    HA   VAL  95           HA       VAL  95  12.827  -5.286  -3.700
  699    HB   VAL  95           HB       VAL  95  11.129  -3.802  -2.530
  700   HG11  VAL  95          HG11      VAL  95  13.377  -4.059  -1.653
  701   HG12  VAL  95          HG12      VAL  95  12.849  -2.384  -1.468
  702   HG13  VAL  95          HG13      VAL  95  13.970  -2.821  -2.758
  703   HG21  VAL  95          HG21      VAL  95  12.306  -1.749  -4.414
  704   HG22  VAL  95          HG22      VAL  95  11.267  -1.385  -3.032
  705   HG23  VAL  95          HG23      VAL  95  10.634  -2.316  -4.389
  706    H    ILE  96           HN       ILE  96  10.103  -5.087  -3.153
  707    HA   ILE  96           HA       ILE  96   8.889  -6.136  -5.523
  708    HB   ILE  96           HB       ILE  96   6.845  -6.300  -4.148
  709   HG12  ILE  96          HG12      ILE  96   8.533  -5.028  -1.976
  710   HG13  ILE  96          HG11      ILE  96   7.153  -4.283  -2.770
  711   HG21  ILE  96          HG21      ILE  96   7.710  -7.917  -2.502
  712   HG22  ILE  96          HG22      ILE  96   9.343  -7.330  -2.817
  713   HG23  ILE  96          HG23      ILE  96   8.427  -8.118  -4.100
  714   HD11  ILE  96          HD11      ILE  96   7.080  -6.734  -1.030
  715   HD12  ILE  96          HD12      ILE  96   5.692  -6.008  -1.842
  716   HD13  ILE  96          HD13      ILE  96   6.545  -5.114  -0.584
  717    H    GLN  97           HN       GLN  97   7.334  -5.097  -6.738
  718    HA   GLN  97           HA       GLN  97   7.861  -2.374  -7.138
  719    HB2  GLN  97           HB2      GLN  97   6.860  -4.216  -8.751
  720    HB3  GLN  97           HB1      GLN  97   5.334  -3.521  -8.218
  721    HG2  GLN  97           HG2      GLN  97   5.911  -2.372 -10.180
  722    HG3  GLN  97           HG1      GLN  97   6.277  -1.272  -8.851
  723   HE21  GLN  97          HE21      GLN  97   8.498  -0.921  -8.282
  724   HE22  GLN  97          HE22      GLN  97   9.747  -1.220  -9.440
  725    H    ALA  98           HN       ALA  98   5.368  -4.012  -5.305
  726    HA   ALA  98           HA       ALA  98   3.622  -1.898  -4.782
  727    HB1  ALA  98           HB1      ALA  98   3.112  -3.041  -2.685
  728    HB2  ALA  98           HB2      ALA  98   4.548  -4.046  -2.876
  729    HB3  ALA  98           HB3      ALA  98   3.213  -4.187  -4.017
  730    H    LEU  99           HN       LEU  99   6.661  -2.796  -3.231
  731    HA   LEU  99           HA       LEU  99   6.555  -0.741  -1.249
  732    HB2  LEU  99           HB2      LEU  99   7.804  -2.821  -0.893
  733    HB3  LEU  99           HB1      LEU  99   8.889  -2.384  -2.208
  734    HG   LEU  99           HG       LEU  99   9.650  -0.418  -0.924
  735   HD11  LEU  99          HD11      LEU  99   7.849  -1.508   1.231
  736   HD12  LEU  99          HD12      LEU  99   7.656   0.019   0.367
  737   HD13  LEU  99          HD13      LEU  99   9.033  -0.219   1.443
  738   HD21  LEU  99          HD21      LEU  99   9.835  -3.007   0.599
  739   HD22  LEU  99          HD22      LEU  99  10.894  -1.610   0.793
  740   HD23  LEU  99          HD23      LEU  99  10.879  -2.501  -0.728
  741    H    ASP 100           HN       ASP 100   8.107  -1.156  -4.343
  742    HA   ASP 100           HA       ASP 100   9.938   0.953  -4.224
  743    HB2  ASP 100           HB2      ASP 100   9.989  -0.911  -5.857
  744    HB3  ASP 100           HB1      ASP 100   8.566  -0.249  -6.637
  745    H    LEU 101           HN       LEU 101   6.566   0.785  -5.050
  746    HA   LEU 101           HA       LEU 101   6.444   3.566  -5.847
  747    HB2  LEU 101           HB2      LEU 101   4.290   1.475  -5.563
  748    HB3  LEU 101           HB1      LEU 101   4.082   3.060  -6.256
  749    HG   LEU 101           HG       LEU 101   5.749   0.814  -7.370
  750   HD11  LEU 101          HD11      LEU 101   3.356   0.536  -7.704
  751   HD12  LEU 101          HD12      LEU 101   4.160   0.895  -9.231
  752   HD13  LEU 101          HD13      LEU 101   3.249   2.153  -8.397
  753   HD21  LEU 101          HD21      LEU 101   5.396   3.622  -8.414
  754   HD22  LEU 101          HD22      LEU 101   6.180   2.301  -9.280
  755   HD23  LEU 101          HD23      LEU 101   6.885   2.915  -7.785
  756    H    SER 102           HN       SER 102   5.641   1.571  -3.060
  757    HA   SER 102           HA       SER 102   3.801   3.439  -1.947
  758    HB2  SER 102           HB2      SER 102   3.921   2.040   0.093
  759    HB3  SER 102           HB1      SER 102   3.639   1.082  -1.359
  760    HG   SER 102           HG       SER 102   6.224   1.488  -0.278
  761    H    VAL 103           HN       VAL 103   7.230   3.009  -1.793
  762    HA   VAL 103           HA       VAL 103   7.758   4.435   0.568
  763    HB   VAL 103           HB       VAL 103   9.438   3.879  -1.844
  764   HG11  VAL 103          HG11      VAL 103  10.306   5.134   0.774
  765   HG12  VAL 103          HG12      VAL 103  10.246   5.947  -0.790
  766   HG13  VAL 103          HG13      VAL 103  11.381   4.626  -0.530
  767   HG21  VAL 103          HG21      VAL 103   8.986   1.909  -0.623
  768   HG22  VAL 103          HG22      VAL 103   9.238   2.721   0.922
  769   HG23  VAL 103          HG23      VAL 103  10.607   2.411  -0.139
  770    HA   PRO 104           HA       PRO 104   8.429   8.374  -2.197
  771    HB2  PRO 104           HB2      PRO 104   7.201   8.272  -4.658
  772    HB3  PRO 104           HB1      PRO 104   8.922   7.974  -4.388
  773    HG2  PRO 104           HG2      PRO 104   6.689   6.014  -4.716
  774    HG3  PRO 104           HG1      PRO 104   8.336   5.959  -5.358
  775    HD2  PRO 104           HD2      PRO 104   7.619   4.508  -3.233
  776    HD3  PRO 104           HD1      PRO 104   9.235   5.220  -3.373
  777    H    LEU 105           HN       LEU 105   5.596   6.359  -2.218
  778    HA   LEU 105           HA       LEU 105   3.761   8.586  -2.061
  779    HB2  LEU 105           HB2      LEU 105   3.526   5.624  -1.649
  780    HB3  LEU 105           HB1      LEU 105   2.179   6.707  -1.312
  781    HG   LEU 105           HG       LEU 105   3.457   6.061  -3.953
  782   HD11  LEU 105          HD11      LEU 105   1.634   4.647  -3.116
  783   HD12  LEU 105          HD12      LEU 105   1.203   5.513  -4.590
  784   HD13  LEU 105          HD13      LEU 105   0.593   6.068  -3.031
  785   HD21  LEU 105          HD21      LEU 105   3.306   8.453  -3.974
  786   HD22  LEU 105          HD22      LEU 105   1.676   8.406  -3.304
  787   HD23  LEU 105          HD23      LEU 105   1.975   7.805  -4.936
  788    H    MET 106           HN       MET 106   5.811   6.946   0.097
  789    HA   MET 106           HA       MET 106   4.344   7.920   2.435
  790    HB2  MET 106           HB2      MET 106   5.017   6.033   3.419
  791    HB3  MET 106           HB1      MET 106   5.686   5.530   1.876
  792    HG2  MET 106           HG2      MET 106   7.786   6.801   2.588
  793    HG3  MET 106           HG1      MET 106   7.058   6.820   4.201
  794    HE1  MET 106           HE1      MET 106   5.558   4.069   4.334
  795    HE2  MET 106           HE2      MET 106   6.588   4.667   5.635
  796    HE3  MET 106           HE3      MET 106   6.791   3.020   5.032
  797    H    ASP 107           HN       ASP 107   5.370   9.215   4.027
  798    HA   ASP 107           HA       ASP 107   7.476  10.931   2.919
  799    HB2  ASP 107           HB2      ASP 107   5.298  11.291   4.812
  800    HB3  ASP 107           HB1      ASP 107   6.820  11.896   5.458
  801    H    VAL 108           HN       VAL 108   9.277  11.631   4.346
  802    HA   VAL 108           HA       VAL 108  10.646   9.310   5.208
  803    HB   VAL 108           HB       VAL 108  11.572  11.636   4.329
  804   HG11  VAL 108          HG11      VAL 108  10.838  12.855   6.374
  805   HG12  VAL 108          HG12      VAL 108  12.552  13.017   6.001
  806   HG13  VAL 108          HG13      VAL 108  12.027  11.928   7.286
  807   HG21  VAL 108          HG21      VAL 108  12.862   9.600   4.532
  808   HG22  VAL 108          HG22      VAL 108  13.025   9.850   6.271
  809   HG23  VAL 108          HG23      VAL 108  13.788  10.970   5.142
  810    H    GLY 109           HN       GLY 109  10.747   8.359   7.083
  811    HA2  GLY 109           HA2      GLY 109  10.923   8.222   9.413
  812    HA3  GLY 109           HA1      GLY 109  10.315   9.870   9.539
  813    H    GLU 110           HN       GLU 110   8.440   7.991   7.419
  814    HA   GLU 110           HA       GLU 110   6.428   7.791   9.513
  815    HB2  GLU 110           HB2      GLU 110   4.774   7.901   7.923
  816    HB3  GLU 110           HB1      GLU 110   6.009   8.929   7.215
  817    HG2  GLU 110           HG2      GLU 110   6.557   7.329   5.604
  818    HG3  GLU 110           HG1      GLU 110   5.732   6.043   6.484
  819    H    THR 111           HN       THR 111   4.943   5.936   9.365
  820    HA   THR 111           HA       THR 111   6.277   3.483   8.505
  821    HB   THR 111           HB       THR 111   4.600   3.643  11.012
  822    HG1  THR 111           HG1      THR 111   6.989   4.678  10.712
  823   HG21  THR 111          HG21      THR 111   6.586   1.589  10.020
  824   HG22  THR 111          HG22      THR 111   4.830   1.433   9.953
  825   HG23  THR 111          HG23      THR 111   5.655   1.493  11.512
  826    H    ALA 112           HN       ALA 112   5.057   2.509   7.043
  827    HA   ALA 112           HA       ALA 112   2.179   3.135   7.036
  828    HB1  ALA 112           HB1      ALA 112   2.278   3.020   4.596
  829    HB2  ALA 112           HB2      ALA 112   4.021   2.763   4.688
  830    HB3  ALA 112           HB3      ALA 112   3.323   4.285   5.239
  831    H    MET 113           HN       MET 113   0.812   1.461   6.889
  832    HA   MET 113           HA       MET 113   1.986  -1.190   6.405
  833    HB2  MET 113           HB2      MET 113   0.712  -1.176   8.443
  834    HB3  MET 113           HB1      MET 113  -0.640  -0.359   7.666
  835    HG2  MET 113           HG2      MET 113  -1.253  -2.259   6.470
  836    HG3  MET 113           HG1      MET 113   0.281  -3.072   6.779
  837    HE1  MET 113           HE1      MET 113  -3.281  -2.263   7.991
  838    HE2  MET 113           HE2      MET 113  -2.357  -1.201   9.050
  839    HE3  MET 113           HE3      MET 113  -3.216  -2.581   9.726
  840    H    VAL 114           HN       VAL 114   1.809  -1.902   4.417
  841    HA   VAL 114           HA       VAL 114  -0.256  -0.704   2.671
  842    HB   VAL 114           HB       VAL 114   2.250  -2.108   1.797
  843   HG11  VAL 114          HG11      VAL 114   0.549  -1.884   0.093
  844   HG12  VAL 114          HG12      VAL 114   1.945  -0.872  -0.279
  845   HG13  VAL 114          HG13      VAL 114   0.479  -0.146   0.380
  846   HG21  VAL 114          HG21      VAL 114   2.868  -0.254   3.245
  847   HG22  VAL 114          HG22      VAL 114   1.910   0.836   2.244
  848   HG23  VAL 114          HG23      VAL 114   3.335   0.044   1.570
  849    H    THR 115           HN       THR 115  -1.761  -2.088   1.779
  850    HA   THR 115           HA       THR 115  -1.044  -4.924   1.932
  851    HB   THR 115           HB       THR 115  -3.795  -3.734   1.571
  852    HG1  THR 115           HG1      THR 115  -2.265  -4.386   3.757
  853   HG21  THR 115          HG21      THR 115  -2.903  -6.575   2.022
  854   HG22  THR 115          HG22      THR 115  -3.439  -5.924   0.473
  855   HG23  THR 115          HG23      THR 115  -4.568  -6.019   1.827
  856    H    ALA 116           HN       ALA 116  -0.284  -5.682   0.228
  857    HA   ALA 116           HA       ALA 116  -1.151  -4.674  -2.404
  858    HB1  ALA 116           HB1      ALA 116   1.043  -3.754  -1.891
  859    HB2  ALA 116           HB2      ALA 116   1.137  -4.933  -3.199
  860    HB3  ALA 116           HB3      ALA 116   1.659  -5.377  -1.575
  861    H    ASP 117           HN       ASP 117  -1.822  -6.227  -3.697
  862    HA   ASP 117           HA       ASP 117  -2.055  -8.888  -3.018
  863    HB2  ASP 117           HB2      ASP 117  -3.039  -7.572  -5.055
  864    HB3  ASP 117           HB1      ASP 117  -1.583  -8.132  -5.853
  865    H    SER 118           HN       SER 118  -0.849 -10.744  -3.474
  866    HA   SER 118           HA       SER 118   1.883 -10.592  -3.151
  867    HB2  SER 118           HB2      SER 118   0.223 -12.614  -3.005
  868    HB3  SER 118           HB1      SER 118   0.681 -12.867  -4.688
  869    HG   SER 118           HG       SER 118   1.953 -13.975  -2.991
  870    H    LYS 119           HN       LYS 119  -0.011 -10.438  -6.083
  871    HA   LYS 119           HA       LYS 119   1.948 -10.878  -7.991
  872    HB2  LYS 119           HB2      LYS 119   0.580  -9.345  -9.427
  873    HB3  LYS 119           HB1      LYS 119  -0.306 -10.673  -8.686
  874    HG2  LYS 119           HG2      LYS 119  -1.116  -9.121  -6.969
  875    HG3  LYS 119           HG1      LYS 119  -0.250  -7.811  -7.770
  876    HD2  LYS 119           HD2      LYS 119  -2.605  -7.792  -8.387
  877    HD3  LYS 119           HD1      LYS 119  -1.609  -8.183  -9.792
  878    HE2  LYS 119           HE2      LYS 119  -2.103 -10.550  -9.496
  879    HE3  LYS 119           HE1      LYS 119  -3.057 -10.180  -8.061
  880    HZ1  LYS 119           HZ1      LYS 119  -3.675  -9.119 -10.762
  881    HZ2  LYS 119           HZ2      LYS 119  -4.640  -9.031  -9.377
  882    HZ3  LYS 119           HZ3      LYS 119  -4.375 -10.523 -10.118
  883    H    TYR 120           HN       TYR 120   1.413  -7.995  -6.008
  884    HA   TYR 120           HA       TYR 120   3.591  -6.606  -7.399
  885    HB2  TYR 120           HB2      TYR 120   1.796  -5.695  -5.134
  886    HB3  TYR 120           HB1      TYR 120   3.031  -4.705  -5.909
  887    HD1  TYR 120           HD2      TYR 120  -0.215  -6.350  -6.351
  888    HD2  TYR 120           HD1      TYR 120   2.660  -3.704  -8.022
  889    HE1  TYR 120           HE2      TYR 120  -1.875  -5.590  -8.004
  890    HE2  TYR 120           HE1      TYR 120   1.023  -2.939  -9.670
  891    HH   TYR 120           HH       TYR 120  -2.327  -3.784  -9.456
  892    H    CYS 121           HN       CYS 121   3.334  -8.898  -5.177
  893    HA   CYS 121           HA       CYS 121   5.574  -7.894  -3.567
  894    HB2  CYS 121           HB2      CYS 121   3.367  -9.773  -2.722
  895    HB3  CYS 121           HB1      CYS 121   4.730  -9.287  -1.720
  896    HG   CYS 121           HG       CYS 121   1.844  -7.880  -1.929
  897    H    TYR 122           HN       TYR 122   4.278 -11.225  -3.541
  898    HA   TYR 122           HA       TYR 122   6.515 -12.066  -5.227
  899    HB2  TYR 122           HB2      TYR 122   6.087 -13.477  -2.597
  900    HB3  TYR 122           HB1      TYR 122   7.430 -13.606  -3.707
  901    HD1  TYR 122           HD2      TYR 122   9.197 -11.961  -3.745
  902    HD2  TYR 122           HD1      TYR 122   5.974 -11.640  -0.988
  903    HE1  TYR 122           HE2      TYR 122  10.488 -10.340  -2.431
  904    HE2  TYR 122           HE1      TYR 122   7.258 -10.019   0.334
  905    HH   TYR 122           HH       TYR 122   9.554  -9.342   0.716
  906    H    GLY 123           HN       GLY 123   3.609 -12.089  -5.686
  907    HA2  GLY 123           HA2      GLY 123   2.433 -14.566  -5.282
  908    HA3  GLY 123           HA1      GLY 123   2.118 -13.529  -6.663
  909    HA   PRO 124           HA       PRO 124   4.208 -16.545  -9.141
  910    HB2  PRO 124           HB2      PRO 124   5.168 -14.615 -11.045
  911    HB3  PRO 124           HB1      PRO 124   3.762 -15.669 -11.180
  912    HG2  PRO 124           HG2      PRO 124   3.636 -12.929 -10.951
  913    HG3  PRO 124           HG1      PRO 124   2.323 -14.035 -10.516
  914    HD2  PRO 124           HD2      PRO 124   4.314 -12.666  -8.753
  915    HD3  PRO 124           HD1      PRO 124   2.590 -12.995  -8.470
  916    H    GLN 125           HN       GLN 125   5.798 -14.451  -7.251
  917    HA   GLN 125           HA       GLN 125   8.439 -14.825  -8.509
  918    HB2  GLN 125           HB2      GLN 125   8.017 -12.952  -6.227
  919    HB3  GLN 125           HB1      GLN 125   9.131 -12.831  -7.580
  920    HG2  GLN 125           HG2      GLN 125   7.277 -12.257  -9.058
  921    HG3  GLN 125           HG1      GLN 125   6.156 -12.393  -7.706
  922   HE21  GLN 125          HE21      GLN 125   5.472 -10.311  -7.671
  923   HE22  GLN 125          HE22      GLN 125   6.497  -8.983  -7.279
  924    H    GLY 126           HN       GLY 126   6.776 -14.776  -5.405
  925    HA2  GLY 126           HA2      GLY 126   7.020 -16.145  -3.576
  926    HA3  GLY 126           HA1      GLY 126   8.325 -16.991  -4.393
  927    H    SER 127           HN       SER 127   8.021 -15.796  -1.675
  928    HA   SER 127           HA       SER 127   9.900 -13.641  -1.730
  929    HB2  SER 127           HB2      SER 127   8.053 -13.221  -0.307
  930    HB3  SER 127           HB1      SER 127   8.160 -14.809   0.426
  931    HG   SER 127           HG       SER 127  10.035 -12.678   0.706
  932    H    ARG 128           HN       ARG 128  11.787 -13.550  -0.402
  933    HA   ARG 128           HA       ARG 128  13.554 -15.578  -0.976
  934    HB2  ARG 128           HB2      ARG 128  15.151 -14.444   0.457
  935    HB3  ARG 128           HB1      ARG 128  14.211 -13.258  -0.434
  936    HG2  ARG 128           HG2      ARG 128  12.866 -12.800   1.521
  937    HG3  ARG 128           HG1      ARG 128  13.708 -14.060   2.423
  938    HD2  ARG 128           HD2      ARG 128  14.904 -12.276   3.145
  939    HD3  ARG 128           HD1      ARG 128  15.817 -12.631   1.679
  940    HE   ARG 128           HE       ARG 128  14.088 -10.887   0.719
  941   HH11  ARG 128          HH11      ARG 128  16.000 -10.810   3.641
  942   HH12  ARG 128          HH12      ARG 128  15.948  -9.074   3.800
  943   HH21  ARG 128          HH21      ARG 128  14.037  -8.590   0.906
  944   HH22  ARG 128          HH22      ARG 128  14.806  -7.817   2.266
  945    H    SER 129           HN       SER 129  11.822 -15.045   2.090
  946    HA   SER 129           HA       SER 129  13.043 -17.417   3.201
  947    HB2  SER 129           HB2      SER 129  10.850 -15.729   4.432
  948    HB3  SER 129           HB1      SER 129  11.913 -16.870   5.257
  949    HG   SER 129           HG       SER 129  13.637 -15.379   4.305
  950    HA   PRO 130           HA       PRO 130   8.924 -19.300   2.092
  951    HB2  PRO 130           HB2      PRO 130   6.613 -17.818   2.400
  952    HB3  PRO 130           HB1      PRO 130   7.384 -18.715   3.704
  953    HG2  PRO 130           HG2      PRO 130   7.093 -15.901   3.515
  954    HG3  PRO 130           HG1      PRO 130   8.043 -16.792   4.717
  955    HD2  PRO 130           HD2      PRO 130   8.930 -15.521   2.154
  956    HD3  PRO 130           HD1      PRO 130   9.778 -15.631   3.704
  957    H    TYR 131           HN       TYR 131   8.801 -19.598  -0.120
  958    HA   TYR 131           HA       TYR 131   8.246 -17.657  -2.030
  959    HB2  TYR 131           HB2      TYR 131   8.992 -20.011  -2.502
  960    HB3  TYR 131           HB1      TYR 131   7.368 -20.559  -2.111
  961    HD1  TYR 131           HD1      TYR 131   5.439 -19.470  -3.530
  962    HD2  TYR 131           HD2      TYR 131   9.532 -19.526  -4.700
  963    HE1  TYR 131           HE1      TYR 131   4.766 -19.137  -5.870
  964    HE2  TYR 131           HE2      TYR 131   8.871 -19.187  -7.044
  965    HH   TYR 131           HH       TYR 131   5.688 -18.318  -7.949
  966    H    ILE 132           HN       ILE 132   6.640 -16.249  -1.522
  967    HA   ILE 132           HA       ILE 132   4.313 -16.938  -0.108
  968    HB   ILE 132           HB       ILE 132   4.734 -14.508  -1.855
  969   HG12  ILE 132          HG12      ILE 132   6.513 -14.453  -0.299
  970   HG13  ILE 132          HG11      ILE 132   5.284 -13.331   0.289
  971   HG21  ILE 132          HG21      ILE 132   3.060 -13.468  -0.381
  972   HG22  ILE 132          HG22      ILE 132   2.862 -15.012   0.450
  973   HG23  ILE 132          HG23      ILE 132   2.416 -14.860  -1.253
  974   HD11  ILE 132          HD11      ILE 132   4.582 -14.920   1.941
  975   HD12  ILE 132          HD12      ILE 132   6.326 -14.637   2.044
  976   HD13  ILE 132          HD13      ILE 132   5.714 -16.118   1.304
  977    HA   PRO 133           HA       PRO 133   1.973 -18.943  -3.323
  978    HB2  PRO 133           HB2      PRO 133  -0.308 -17.849  -1.739
  979    HB3  PRO 133           HB1      PRO 133  -0.015 -19.501  -2.298
  980    HG2  PRO 133           HG2      PRO 133   0.362 -18.839   0.255
  981    HG3  PRO 133           HG1      PRO 133   1.455 -19.968  -0.568
  982    HD2  PRO 133           HD2      PRO 133   1.875 -17.106   0.158
  983    HD3  PRO 133           HD1      PRO 133   3.037 -18.447   0.126
  984    HA   PRO 134           HA       PRO 134   1.105 -15.620  -6.109
  985    HB2  PRO 134           HB2      PRO 134  -0.850 -17.522  -7.283
  986    HB3  PRO 134           HB1      PRO 134   0.477 -16.651  -8.057
  987    HG2  PRO 134           HG2      PRO 134   0.660 -19.263  -7.546
  988    HG3  PRO 134           HG1      PRO 134   2.066 -18.194  -7.364
  989    HD2  PRO 134           HD2      PRO 134   0.287 -19.369  -5.265
  990    HD3  PRO 134           HD1      PRO 134   2.040 -19.091  -5.236
  991    H    HIS 135           HN       HIS 135  -0.203 -13.960  -5.924
  992    HA   HIS 135           HA       HIS 135  -2.101 -12.686  -5.817
  993    HB2  HIS 135           HB2      HIS 135  -3.121 -14.850  -6.961
  994    HB3  HIS 135           HB1      HIS 135  -3.839 -15.082  -5.379
  995    HD1  HIS 135           HD1      HIS 135  -4.057 -11.621  -5.548
  996    HD2  HIS 135           HD2      HIS 135  -5.939 -14.683  -7.646
  997    HE1  HIS 135           HE1      HIS 135  -6.176 -10.624  -6.457
  998    HE2  HIS 135           HE2      HIS 135  -7.363 -12.517  -7.608
  999    H    ALA 136           HN       ALA 136  -0.858 -14.556  -3.418
 1000    HA   ALA 136           HA       ALA 136  -2.848 -14.318  -1.394
 1001    HB1  ALA 136           HB1      ALA 136  -1.078 -14.882   0.172
 1002    HB2  ALA 136           HB2      ALA 136   0.141 -14.567  -1.060
 1003    HB3  ALA 136           HB3      ALA 136  -0.971 -15.921  -1.250
 1004    H    ALA 137           HN       ALA 137  -3.479 -12.511  -0.344
 1005    HA   ALA 137           HA       ALA 137  -2.298 -10.074  -1.240
 1006    HB1  ALA 137           HB1      ALA 137  -4.476 -10.514   0.789
 1007    HB2  ALA 137           HB2      ALA 137  -4.703 -10.261  -0.940
 1008    HB3  ALA 137           HB3      ALA 137  -4.040  -8.970   0.064
 1009    H    LEU 138           HN       LEU 138  -0.539  -9.210  -0.403
 1010    HA   LEU 138           HA       LEU 138   0.399 -10.047   2.210
 1011    HB2  LEU 138           HB2      LEU 138   1.602  -9.199  -0.244
 1012    HB3  LEU 138           HB1      LEU 138   2.190  -8.207   1.077
 1013    HG   LEU 138           HG       LEU 138   2.893 -10.178   2.294
 1014   HD11  LEU 138          HD11      LEU 138   1.840 -11.704  -0.065
 1015   HD12  LEU 138          HD12      LEU 138   1.154 -11.683   1.559
 1016   HD13  LEU 138          HD13      LEU 138   2.748 -12.387   1.284
 1017   HD21  LEU 138          HD21      LEU 138   3.853 -10.222  -0.557
 1018   HD22  LEU 138          HD22      LEU 138   4.676 -10.947   0.825
 1019   HD23  LEU 138          HD23      LEU 138   4.479  -9.197   0.734
 1020    H    CYS 139           HN       CYS 139   0.441  -8.816   3.982
 1021    HA   CYS 139           HA       CYS 139  -0.148  -5.942   3.666
 1022    HB2  CYS 139           HB2      CYS 139  -1.839  -7.477   4.881
 1023    HB3  CYS 139           HB1      CYS 139  -0.645  -7.505   6.170
 1024    HG   CYS 139           HG       CYS 139  -1.197  -5.220   7.228
 1025    H    LEU 140           HN       LEU 140   1.785  -5.029   3.731
 1026    HA   LEU 140           HA       LEU 140   3.769  -6.044   5.650
 1027    HB2  LEU 140           HB2      LEU 140   5.440  -5.048   4.114
 1028    HB3  LEU 140           HB1      LEU 140   4.521  -6.372   3.419
 1029    HG   LEU 140           HG       LEU 140   3.080  -4.126   2.705
 1030   HD11  LEU 140          HD11      LEU 140   4.726  -2.606   1.723
 1031   HD12  LEU 140          HD12      LEU 140   6.031  -3.564   2.425
 1032   HD13  LEU 140          HD13      LEU 140   4.910  -2.701   3.476
 1033   HD21  LEU 140          HD21      LEU 140   3.505  -6.084   1.319
 1034   HD22  LEU 140          HD22      LEU 140   5.195  -5.608   1.142
 1035   HD23  LEU 140          HD23      LEU 140   3.919  -4.602   0.456
 1036    H    GLU 141           HN       GLU 141   4.735  -4.690   7.065
 1037    HA   GLU 141           HA       GLU 141   3.813  -1.899   7.050
 1038    HB2  GLU 141           HB2      GLU 141   3.273  -3.151   9.078
 1039    HB3  GLU 141           HB1      GLU 141   4.957  -3.617   9.268
 1040    HG2  GLU 141           HG2      GLU 141   5.530  -1.224   9.557
 1041    HG3  GLU 141           HG1      GLU 141   3.803  -0.851   9.511
 1042    H    VAL 142           HN       VAL 142   5.275  -0.365   6.505
 1043    HA   VAL 142           HA       VAL 142   8.107  -1.128   6.582
 1044    HB   VAL 142           HB       VAL 142   8.358   0.482   4.601
 1045   HG11  VAL 142          HG11      VAL 142   7.849  -1.313   3.012
 1046   HG12  VAL 142          HG12      VAL 142   6.922  -2.149   4.259
 1047   HG13  VAL 142          HG13      VAL 142   8.661  -1.930   4.451
 1048   HG21  VAL 142          HG21      VAL 142   6.132   1.477   4.674
 1049   HG22  VAL 142          HG22      VAL 142   5.403  -0.105   4.400
 1050   HG23  VAL 142          HG23      VAL 142   6.388   0.640   3.141
 1051    H    THR 143           HN       THR 143   9.323   0.094   7.824
 1052    HA   THR 143           HA       THR 143   8.543   2.843   8.478
 1053    HB   THR 143           HB       THR 143  11.042   1.418   9.420
 1054    HG1  THR 143           HG1      THR 143   8.584   0.611   9.929
 1055   HG21  THR 143          HG21      THR 143  10.873   2.968  11.301
 1056   HG22  THR 143          HG22      THR 143   9.386   3.643  10.637
 1057   HG23  THR 143          HG23      THR 143  10.911   3.851   9.774
 1058    H    LEU 144           HN       LEU 144   9.188   4.375   7.037
 1059    HA   LEU 144           HA       LEU 144  11.676   4.055   5.563
 1060    HB2  LEU 144           HB2      LEU 144   9.688   5.091   4.513
 1061    HB3  LEU 144           HB1      LEU 144   9.755   6.383   5.696
 1062    HG   LEU 144           HG       LEU 144  11.914   7.119   4.796
 1063   HD11  LEU 144          HD11      LEU 144  11.541   4.863   2.835
 1064   HD12  LEU 144          HD12      LEU 144  12.816   5.016   4.044
 1065   HD13  LEU 144          HD13      LEU 144  12.745   6.142   2.688
 1066   HD21  LEU 144          HD21      LEU 144   9.793   7.999   3.875
 1067   HD22  LEU 144          HD22      LEU 144   9.866   6.770   2.610
 1068   HD23  LEU 144          HD23      LEU 144  11.115   8.012   2.709
 1069    H    LYS 145           HN       LYS 145  13.382   4.197   6.818
 1070    HA   LYS 145           HA       LYS 145  13.289   5.996   9.114
 1071    HB2  LYS 145           HB2      LYS 145  15.448   4.000   8.468
 1072    HB3  LYS 145           HB1      LYS 145  15.026   4.681  10.034
 1073    HG2  LYS 145           HG2      LYS 145  12.929   3.479  10.029
 1074    HG3  LYS 145           HG1      LYS 145  13.291   2.829   8.428
 1075    HD2  LYS 145           HD2      LYS 145  14.937   2.348  10.910
 1076    HD3  LYS 145           HD1      LYS 145  13.750   1.217  10.240
 1077    HE2  LYS 145           HE2      LYS 145  15.006   0.880   8.304
 1078    HE3  LYS 145           HE1      LYS 145  16.057   2.265   8.613
 1079    HZ1  LYS 145           HZ1      LYS 145  17.388   0.529   9.273
 1080    HZ2  LYS 145           HZ2      LYS 145  16.090  -0.412   9.834
 1081    HZ3  LYS 145           HZ3      LYS 145  16.636   0.906  10.752
 1082    H    THR 146           HN       THR 146  14.958   5.513   6.090
 1083    HA   THR 146           HA       THR 146  16.246   8.082   6.416
 1084    HB   THR 146           HB       THR 146  17.910   5.670   5.696
 1085    HG1  THR 146           HG1      THR 146  17.184   6.706   8.177
 1086   HG21  THR 146          HG21      THR 146  19.795   7.196   6.172
 1087   HG22  THR 146          HG22      THR 146  18.648   8.504   6.466
 1088   HG23  THR 146          HG23      THR 146  18.773   7.786   4.860
 1089    H    ALA 147           HN       ALA 147  16.697   9.108   4.528
 1090    HA   ALA 147           HA       ALA 147  16.611   7.575   2.030
 1091    HB1  ALA 147           HB1      ALA 147  15.220  10.212   2.542
 1092    HB2  ALA 147           HB2      ALA 147  14.445   8.666   2.193
 1093    HB3  ALA 147           HB3      ALA 147  15.410   9.470   0.954
 1094    H    VAL 148           HN       VAL 148  18.406   7.974   0.833
 1095    HA   VAL 148           HA       VAL 148  19.776  10.533   1.275
 1096    HB   VAL 148           HB       VAL 148  21.993   9.208   1.091
 1097   HG11  VAL 148          HG11      VAL 148  20.304   9.120   3.591
 1098   HG12  VAL 148          HG12      VAL 148  21.334  10.453   3.064
 1099   HG13  VAL 148          HG13      VAL 148  22.055   8.916   3.539
 1100   HG21  VAL 148          HG21      VAL 148  21.000   7.030   0.576
 1101   HG22  VAL 148          HG22      VAL 148  20.171   7.038   2.136
 1102   HG23  VAL 148          HG23      VAL 148  21.933   6.971   2.074
 1103    H    ASP 149           HN       ASP 149  20.293  11.524  -0.529
 1104    HA   ASP 149           HA       ASP 149  19.604  10.416  -3.043
 1105    HB2  ASP 149           HB2      ASP 149  19.330  12.755  -2.807
 1106    HB3  ASP 149           HB1      ASP 149  20.983  12.969  -2.225
 1107    H    LEU 150           HN       LEU 150  20.775   9.160  -4.322
 1108    HA   LEU 150           HA       LEU 150  23.679   9.316  -4.252
 1109    HB2  LEU 150           HB2      LEU 150  22.701   7.633  -2.525
 1110    HB3  LEU 150           HB1      LEU 150  22.392   6.626  -3.927
 1111    HG   LEU 150           HG       LEU 150  24.824   6.721  -4.472
 1112   HD11  LEU 150          HD11      LEU 150  26.371   7.530  -2.757
 1113   HD12  LEU 150          HD12      LEU 150  25.005   8.093  -1.790
 1114   HD13  LEU 150          HD13      LEU 150  25.338   8.826  -3.357
 1115   HD21  LEU 150          HD21      LEU 150  23.887   4.837  -3.241
 1116   HD22  LEU 150          HD22      LEU 150  24.134   5.693  -1.720
 1117   HD23  LEU 150          HD23      LEU 150  25.523   5.198  -2.690
 1118    H    GLU 151           HN       GLU 151  21.167   9.525  -6.126
 1119    HA   GLU 151           HA       GLU 151  21.904   7.539  -8.109
 1120    HB2  GLU 151           HB2      GLU 151  19.515   8.930  -7.562
 1121    HB3  GLU 151           HB1      GLU 151  20.049   9.469  -9.151
 1122    HG2  GLU 151           HG2      GLU 151  19.717   6.589  -8.323
 1123    HG3  GLU 151           HG1      GLU 151  18.529   7.512  -9.253
 1124    H    HIS 152           HN       HIS 152  21.936   8.500 -10.466
 1125    HA   HIS 152           HA       HIS 152  24.332  10.204 -10.315
 1126    HB2  HIS 152           HB2      HIS 152  23.602   8.087 -12.352
 1127    HB3  HIS 152           HB1      HIS 152  25.108   8.995 -12.302
 1128    HD1  HIS 152           HD1      HIS 152  23.163   6.496 -10.200
 1129    HD2  HIS 152           HD2      HIS 152  27.062   7.850 -10.788
 1130    HE1  HIS 152           HE1      HIS 152  24.632   4.993  -8.813
 1131    HE2  HIS 152           HE2      HIS 152  26.991   5.732  -9.299
 1132    H    HIS 153           HN       HIS 153  24.847  11.098 -12.630
 1133    HA   HIS 153           HA       HIS 153  22.464  12.509 -13.556
 1134    HB2  HIS 153           HB2      HIS 153  24.214  13.800 -14.952
 1135    HB3  HIS 153           HB1      HIS 153  24.154  14.076 -13.218
 1136    HD1  HIS 153           HD1      HIS 153  26.135  13.179 -11.801
 1137    HD2  HIS 153           HD2      HIS 153  26.588  12.676 -15.905
 1138    HE1  HIS 153           HE1      HIS 153  28.571  12.650 -12.155
 1139    HE2  HIS 153           HE2      HIS 153  28.856  12.589 -14.657
 1140    H    HIS 154           HN       HIS 154  23.662   9.674 -14.132
 1141    HA   HIS 154           HA       HIS 154  22.627   9.711 -16.866
 1142    HB2  HIS 154           HB2      HIS 154  25.176   9.480 -16.827
 1143    HB3  HIS 154           HB1      HIS 154  24.925   7.915 -16.062
 1144    HD1  HIS 154           HD1      HIS 154  25.575   6.324 -17.908
 1145    HD2  HIS 154           HD2      HIS 154  22.957   9.288 -19.199
 1146    HE1  HIS 154           HE1      HIS 154  24.993   5.731 -20.277
 1147    HE2  HIS 154           HE2      HIS 154  23.563   7.646 -21.100
 1148    H    HIS 155           HN       HIS 155  20.684   8.902 -16.323
 1149    HA   HIS 155           HA       HIS 155  20.190   7.043 -14.290
 1150    HB2  HIS 155           HB2      HIS 155  17.932   6.897 -15.145
 1151    HB3  HIS 155           HB1      HIS 155  18.472   8.567 -15.213
 1152    HD1  HIS 155           HD1      HIS 155  16.230   6.961 -16.985
 1153    HD2  HIS 155           HD2      HIS 155  19.956   8.347 -18.193
 1154    HE1  HIS 155           HE1      HIS 155  16.076   7.237 -19.474
 1155    HE2  HIS 155           HE2      HIS 155  18.418   7.823 -20.199
 1156    H    HIS 156           HN       HIS 156  19.621   4.882 -14.309
 1157    HA   HIS 156           HA       HIS 156  20.922   3.317 -16.402
 1158    HB2  HIS 156           HB2      HIS 156  19.666   2.348 -13.824
 1159    HB3  HIS 156           HB1      HIS 156  20.723   1.429 -14.884
 1160    HD1  HIS 156           HD1      HIS 156  23.193   1.587 -14.460
 1161    HD2  HIS 156           HD2      HIS 156  20.990   4.395 -12.326
 1162    HE1  HIS 156           HE1      HIS 156  24.814   2.648 -12.854
 1163    HE2  HIS 156           HE2      HIS 156  23.365   4.091 -11.379
 1164    H    HIS 157           HN       HIS 157  17.801   3.995 -15.052
 1165    HA   HIS 157           HA       HIS 157  16.519   2.485 -17.205
 1166    HB2  HIS 157           HB2      HIS 157  15.772   2.434 -14.272
 1167    HB3  HIS 157           HB1      HIS 157  14.699   1.882 -15.553
 1168    HD1  HIS 157           HD1      HIS 157  16.971   0.569 -13.165
 1169    HD2  HIS 157           HD2      HIS 157  16.193  -0.229 -17.185
 1170    HE1  HIS 157           HE1      HIS 157  17.874  -1.738 -13.600
 1171    HE2  HIS 157           HE2      HIS 157  17.284  -2.249 -15.996
  Start of MODEL    9
    1    H1   MET   1           HT1      MET   1 -18.862  51.323  23.353
    2    H2   MET   1           HT2      MET   1 -18.791  50.316  24.709
    3    H3   MET   1           HT3      MET   1 -19.473  49.749  23.260
    4    HA   MET   1           HA       MET   1 -17.302  50.066  22.174
    5    HB2  MET   1           HB2      MET   1 -16.441  50.482  25.042
    6    HB3  MET   1           HB1      MET   1 -15.329  50.076  23.743
    7    HG2  MET   1           HG2      MET   1 -17.068  52.533  23.832
    8    HG3  MET   1           HG1      MET   1 -15.355  52.472  24.236
    9    HE1  MET   1           HE1      MET   1 -14.946  54.462  22.525
   10    HE2  MET   1           HE2      MET   1 -16.655  54.472  22.091
   11    HE3  MET   1           HE3      MET   1 -15.429  54.407  20.826
   12    H    GLY   2           HN       GLY   2 -15.462  48.344  22.646
   13    HA2  GLY   2           HA2      GLY   2 -15.069  46.075  23.274
   14    HA3  GLY   2           HA1      GLY   2 -16.790  45.902  23.602
   15    H    GLN   3           HN       GLN   3 -14.831  46.995  20.835
   16    HA   GLN   3           HA       GLN   3 -16.754  45.933  18.980
   17    HB2  GLN   3           HB2      GLN   3 -13.998  47.087  18.522
   18    HB3  GLN   3           HB1      GLN   3 -15.154  46.713  17.252
   19    HG2  GLN   3           HG2      GLN   3 -16.723  48.333  18.438
   20    HG3  GLN   3           HG1      GLN   3 -15.310  48.835  19.362
   21   HE21  GLN   3          HE21      GLN   3 -13.620  49.935  18.303
   22   HE22  GLN   3          HE22      GLN   3 -13.848  50.659  16.744
   23    HA   PRO   4           HA       PRO   4 -15.255  41.795  18.469
   24    HB2  PRO   4           HB2      PRO   4 -15.658  42.298  15.565
   25    HB3  PRO   4           HB1      PRO   4 -16.292  40.999  16.582
   26    HG2  PRO   4           HG2      PRO   4 -17.869  42.987  15.788
   27    HG3  PRO   4           HG1      PRO   4 -18.006  42.314  17.423
   28    HD2  PRO   4           HD2      PRO   4 -16.745  44.869  16.523
   29    HD3  PRO   4           HD1      PRO   4 -17.685  44.532  17.992
   30    HA   PRO   5           HA       PRO   5 -10.965  42.784  17.862
   31    HB2  PRO   5           HB2      PRO   5 -10.776  39.810  17.842
   32    HB3  PRO   5           HB1      PRO   5  -9.871  40.992  18.797
   33    HG2  PRO   5           HG2      PRO   5 -11.812  39.573  19.920
   34    HG3  PRO   5           HG1      PRO   5 -11.603  41.290  20.315
   35    HD2  PRO   5           HD2      PRO   5 -13.629  39.982  18.545
   36    HD3  PRO   5           HD1      PRO   5 -13.816  41.357  19.653
   37    H    ALA   6           HN       ALA   6  -9.768  43.099  16.117
   38    HA   ALA   6           HA       ALA   6 -10.282  41.465  13.718
   39    HB1  ALA   6           HB1      ALA   6  -9.361  44.340  13.866
   40    HB2  ALA   6           HB2      ALA   6 -10.982  43.799  13.432
   41    HB3  ALA   6           HB3      ALA   6  -9.614  43.412  12.385
   42    H    GLU   7           HN       GLU   7  -8.578  40.535  12.706
   43    HA   GLU   7           HA       GLU   7  -6.559  39.531  12.540
   44    HB2  GLU   7           HB2      GLU   7  -5.618  42.272  13.406
   45    HB3  GLU   7           HB1      GLU   7  -4.505  40.977  12.987
   46    HG2  GLU   7           HG2      GLU   7  -4.680  42.293  11.065
   47    HG3  GLU   7           HG1      GLU   7  -5.684  40.882  10.750
   48    H    GLU   8           HN       GLU   8  -7.428  38.238  14.377
   49    HA   GLU   8           HA       GLU   8  -6.347  38.687  16.985
   50    HB2  GLU   8           HB2      GLU   8  -7.364  36.073  15.855
   51    HB3  GLU   8           HB1      GLU   8  -7.195  36.497  17.550
   52    HG2  GLU   8           HG2      GLU   8  -9.417  36.831  17.334
   53    HG3  GLU   8           HG1      GLU   8  -8.861  38.431  16.841
   54    H    ALA   9           HN       ALA   9  -4.378  38.151  17.742
   55    HA   ALA   9           HA       ALA   9  -2.747  36.242  16.209
   56    HB1  ALA   9           HB1      ALA   9  -1.758  38.947  17.115
   57    HB2  ALA   9           HB2      ALA   9  -2.195  38.530  15.458
   58    HB3  ALA   9           HB3      ALA   9  -0.833  37.728  16.241
   59    H    GLU  10           HN       GLU  10  -2.682  38.341  19.083
   60    HA   GLU  10           HA       GLU  10  -1.997  38.051  21.193
   61    HB2  GLU  10           HB2      GLU  10  -2.622  35.179  20.554
   62    HB3  GLU  10           HB1      GLU  10  -2.053  35.689  22.138
   63    HG2  GLU  10           HG2      GLU  10  -3.966  37.176  22.367
   64    HG3  GLU  10           HG1      GLU  10  -4.531  36.709  20.767
   65    H    GLN  11           HN       GLN  11  -0.021  38.762  21.288
   66    HA   GLN  11           HA       GLN  11   2.215  38.765  21.655
   67    HB2  GLN  11           HB2      GLN  11   2.077  35.758  21.838
   68    HB3  GLN  11           HB1      GLN  11   3.225  36.840  22.620
   69    HG2  GLN  11           HG2      GLN  11   1.483  37.712  24.044
   70    HG3  GLN  11           HG1      GLN  11   0.274  36.737  23.209
   71   HE21  GLN  11          HE21      GLN  11   0.933  36.757  26.013
   72   HE22  GLN  11          HE22      GLN  11   1.456  35.160  26.419
   73    HA   PRO  12           HA       PRO  12   3.125  37.439  17.320
   74    HB2  PRO  12           HB2      PRO  12   3.244  40.147  16.452
   75    HB3  PRO  12           HB1      PRO  12   1.976  38.968  16.111
   76    HG2  PRO  12           HG2      PRO  12   1.670  41.258  17.660
   77    HG3  PRO  12           HG1      PRO  12   0.590  39.853  17.681
   78    HD2  PRO  12           HD2      PRO  12   2.800  40.580  19.562
   79    HD3  PRO  12           HD1      PRO  12   1.220  39.837  19.904
   80    H    GLY  13           HN       GLY  13   4.978  38.203  15.863
   81    HA2  GLY  13           HA2      GLY  13   7.035  39.520  15.743
   82    HA3  GLY  13           HA1      GLY  13   7.172  39.324  17.485
   83    H    ALA  14           HN       ALA  14   8.744  37.987  18.012
   84    HA   ALA  14           HA       ALA  14   9.791  36.055  16.181
   85    HB1  ALA  14           HB1      ALA  14  11.253  37.202  17.780
   86    HB2  ALA  14           HB2      ALA  14  11.317  35.453  17.998
   87    HB3  ALA  14           HB3      ALA  14  10.387  36.448  19.119
   88    H    LEU  15           HN       LEU  15  10.101  33.733  16.929
   89    HA   LEU  15           HA       LEU  15   7.483  32.647  17.339
   90    HB2  LEU  15           HB2      LEU  15   9.019  31.584  15.782
   91    HB3  LEU  15           HB1      LEU  15  10.164  31.282  17.075
   92    HG   LEU  15           HG       LEU  15   8.512  29.766  18.147
   93   HD11  LEU  15          HD11      LEU  15   6.923  30.212  15.626
   94   HD12  LEU  15          HD12      LEU  15   6.482  30.768  17.240
   95   HD13  LEU  15          HD13      LEU  15   6.557  29.040  16.893
   96   HD21  LEU  15          HD21      LEU  15  10.247  28.888  16.678
   97   HD22  LEU  15          HD22      LEU  15   9.178  29.086  15.289
   98   HD23  LEU  15          HD23      LEU  15   8.766  27.938  16.564
   99    H    ALA  16           HN       ALA  16   7.062  33.496  19.469
  100    HA   ALA  16           HA       ALA  16   8.457  32.291  21.697
  101    HB1  ALA  16           HB1      ALA  16   6.706  33.351  23.071
  102    HB2  ALA  16           HB2      ALA  16   5.856  33.833  21.605
  103    HB3  ALA  16           HB3      ALA  16   7.445  34.510  21.963
  104    H    ARG  17           HN       ARG  17   8.280  30.129  21.716
  105    HA   ARG  17           HA       ARG  17   5.598  28.991  21.280
  106    HB2  ARG  17           HB2      ARG  17   6.686  27.010  20.343
  107    HB3  ARG  17           HB1      ARG  17   7.110  28.458  19.438
  108    HG2  ARG  17           HG2      ARG  17   9.292  28.456  20.205
  109    HG3  ARG  17           HG1      ARG  17   8.899  27.478  21.620
  110    HD2  ARG  17           HD2      ARG  17   8.973  26.554  18.755
  111    HD3  ARG  17           HD1      ARG  17  10.127  26.143  20.026
  112    HE   ARG  17           HE       ARG  17   8.068  25.129  21.163
  113   HH11  ARG  17          HH11      ARG  17   8.633  25.187  17.709
  114   HH12  ARG  17          HH12      ARG  17   7.604  23.828  17.386
  115   HH21  ARG  17          HH21      ARG  17   6.726  23.323  20.751
  116   HH22  ARG  17          HH22      ARG  17   6.533  22.751  19.118
  117    H    GLU  18           HN       GLU  18   5.330  26.821  22.232
  118    HA   GLU  18           HA       GLU  18   6.420  26.790  24.938
  119    HB2  GLU  18           HB2      GLU  18   4.108  25.307  23.679
  120    HB3  GLU  18           HB1      GLU  18   4.658  25.040  25.328
  121    HG2  GLU  18           HG2      GLU  18   3.662  27.660  24.239
  122    HG3  GLU  18           HG1      GLU  18   2.715  26.527  25.202
  123    H    PHE  19           HN       PHE  19   7.569  25.127  25.757
  124    HA   PHE  19           HA       PHE  19   8.827  23.338  23.855
  125    HB2  PHE  19           HB2      PHE  19  10.262  22.696  25.776
  126    HB3  PHE  19           HB1      PHE  19  10.261  24.428  25.478
  127    HD1  PHE  19           HD1      PHE  19   9.099  25.950  27.002
  128    HD2  PHE  19           HD2      PHE  19   9.392  21.779  27.798
  129    HE1  PHE  19           HE1      PHE  19   8.490  26.357  29.348
  130    HE2  PHE  19           HE2      PHE  19   8.775  22.178  30.145
  131    HZ   PHE  19           HZ       PHE  19   8.324  24.473  30.923
  132    H    LEU  20           HN       LEU  20   5.970  23.184  25.055
  133    HA   LEU  20           HA       LEU  20   6.009  20.576  26.334
  134    HB2  LEU  20           HB2      LEU  20   3.668  22.348  25.624
  135    HB3  LEU  20           HB1      LEU  20   3.622  20.931  26.660
  136    HG   LEU  20           HG       LEU  20   5.098  23.496  27.259
  137   HD11  LEU  20          HD11      LEU  20   2.576  22.337  28.433
  138   HD12  LEU  20          HD12      LEU  20   2.687  23.765  27.404
  139   HD13  LEU  20          HD13      LEU  20   3.409  23.778  29.013
  140   HD21  LEU  20          HD21      LEU  20   5.507  22.509  29.447
  141   HD22  LEU  20          HD22      LEU  20   6.212  21.513  28.175
  142   HD23  LEU  20          HD23      LEU  20   4.702  21.023  28.944
  143    H    ALA  21           HN       ALA  21   6.376  21.400  23.308
  144    HA   ALA  21           HA       ALA  21   6.157  20.374  21.306
  145    HB1  ALA  21           HB1      ALA  21   6.708  18.331  22.558
  146    HB2  ALA  21           HB2      ALA  21   5.595  18.006  21.227
  147    HB3  ALA  21           HB3      ALA  21   4.993  18.078  22.883
  148    H    ALA  22           HN       ALA  22   4.236  18.820  20.144
  149    HA   ALA  22           HA       ALA  22   2.095  20.680  19.804
  150    HB1  ALA  22           HB1      ALA  22   2.470  17.871  18.756
  151    HB2  ALA  22           HB2      ALA  22   2.880  19.370  17.925
  152    HB3  ALA  22           HB3      ALA  22   1.192  18.975  18.246
  153    H    MET  23           HN       MET  23  -0.012  20.529  20.437
  154    HA   MET  23           HA       MET  23  -0.506  18.899  22.801
  155    HB2  MET  23           HB2      MET  23  -2.133  21.127  21.549
  156    HB3  MET  23           HB1      MET  23  -2.453  20.377  23.108
  157    HG2  MET  23           HG2      MET  23  -0.426  21.258  24.019
  158    HG3  MET  23           HG1      MET  23   0.086  21.842  22.439
  159    HE1  MET  23           HE1      MET  23  -0.570  25.160  24.395
  160    HE2  MET  23           HE2      MET  23   0.572  24.258  23.401
  161    HE3  MET  23           HE3      MET  23   0.135  23.661  25.004
  162    H    GLU  24           HN       GLU  24  -0.410  17.527  20.350
  163    HA   GLU  24           HA       GLU  24  -1.466  16.007  19.064
  164    HB2  GLU  24           HB2      GLU  24  -2.472  15.190  21.154
  165    HB3  GLU  24           HB1      GLU  24  -3.785  16.348  20.981
  166    HG2  GLU  24           HG2      GLU  24  -4.600  15.247  19.031
  167    HG3  GLU  24           HG1      GLU  24  -3.181  14.207  18.952
  168    HA   PRO  25           HA       PRO  25  -3.245  19.028  16.334
  169    HB2  PRO  25           HB2      PRO  25  -2.867  16.984  14.275
  170    HB3  PRO  25           HB1      PRO  25  -2.093  18.561  14.444
  171    HG2  PRO  25           HG2      PRO  25  -0.749  16.256  14.828
  172    HG3  PRO  25           HG1      PRO  25  -0.379  17.734  15.740
  173    HD2  PRO  25           HD2      PRO  25  -1.983  15.339  16.582
  174    HD3  PRO  25           HD1      PRO  25  -0.769  16.261  17.496
  175    H    GLU  26           HN       GLU  26  -4.877  18.969  14.528
  176    HA   GLU  26           HA       GLU  26  -7.278  17.756  15.474
  177    HB2  GLU  26           HB2      GLU  26  -6.701  19.267  12.924
  178    HB3  GLU  26           HB1      GLU  26  -8.306  18.814  13.483
  179    HG2  GLU  26           HG2      GLU  26  -8.048  20.222  15.437
  180    HG3  GLU  26           HG1      GLU  26  -6.402  20.628  14.950
  181    HA   PRO  27           HA       PRO  27  -7.118  13.982  13.152
  182    HB2  PRO  27           HB2      PRO  27  -9.782  13.450  12.993
  183    HB3  PRO  27           HB1      PRO  27  -8.835  13.215  14.468
  184    HG2  PRO  27           HG2      PRO  27 -10.620  15.493  13.704
  185    HG3  PRO  27           HG1      PRO  27 -10.469  14.663  15.265
  186    HD2  PRO  27           HD2      PRO  27  -9.297  17.049  14.770
  187    HD3  PRO  27           HD1      PRO  27  -8.571  15.838  15.847
  188    H    ALA  28           HN       ALA  28  -7.026  13.492  11.041
  189    HA   ALA  28           HA       ALA  28  -7.976  15.386   9.089
  190    HB1  ALA  28           HB1      ALA  28  -6.819  13.989   7.467
  191    HB2  ALA  28           HB2      ALA  28  -6.582  12.737   8.686
  192    HB3  ALA  28           HB3      ALA  28  -5.778  14.298   8.857
  193    HA   PRO  29           HA       PRO  29 -11.832  13.429   8.133
  194    HB2  PRO  29           HB2      PRO  29 -11.364  14.096   5.304
  195    HB3  PRO  29           HB1      PRO  29 -12.638  14.655   6.392
  196    HG2  PRO  29           HG2      PRO  29 -10.657  16.279   5.588
  197    HG3  PRO  29           HG1      PRO  29 -11.361  16.393   7.211
  198    HD2  PRO  29           HD2      PRO  29  -8.783  15.137   6.346
  199    HD3  PRO  29           HD1      PRO  29  -9.133  16.115   7.787
  200    H    ALA  30           HN       ALA  30 -12.240  11.350   7.910
  201    HA   ALA  30           HA       ALA  30 -11.015   9.891   5.692
  202    HB1  ALA  30           HB1      ALA  30 -10.443   8.000   7.135
  203    HB2  ALA  30           HB2      ALA  30 -10.948   8.926   8.549
  204    HB3  ALA  30           HB3      ALA  30  -9.563   9.457   7.593
  205    HA   PRO  31           HA       PRO  31 -15.522   8.803   6.063
  206    HB2  PRO  31           HB2      PRO  31 -16.060   9.184   3.433
  207    HB3  PRO  31           HB1      PRO  31 -16.150  10.493   4.620
  208    HG2  PRO  31           HG2      PRO  31 -13.929   9.802   2.723
  209    HG3  PRO  31           HG1      PRO  31 -14.625  11.391   3.088
  210    HD2  PRO  31           HD2      PRO  31 -12.316  10.570   4.198
  211    HD3  PRO  31           HD1      PRO  31 -13.474  11.581   5.078
  212    H    ALA  32           HN       ALA  32 -13.159   7.143   5.845
  213    HA   ALA  32           HA       ALA  32 -13.983   5.201   3.794
  214    HB1  ALA  32           HB1      ALA  32 -11.689   4.368   3.811
  215    HB2  ALA  32           HB2      ALA  32 -11.259   5.558   5.042
  216    HB3  ALA  32           HB3      ALA  32 -11.732   6.090   3.428
  217    HA   PRO  33           HA       PRO  33 -15.247   2.836   7.398
  218    HB2  PRO  33           HB2      PRO  33 -15.687   0.726   5.378
  219    HB3  PRO  33           HB1      PRO  33 -16.821   1.439   6.529
  220    HG2  PRO  33           HG2      PRO  33 -16.968   1.996   3.916
  221    HG3  PRO  33           HG1      PRO  33 -17.313   3.225   5.150
  222    HD2  PRO  33           HD2      PRO  33 -14.839   2.829   3.505
  223    HD3  PRO  33           HD1      PRO  33 -15.674   4.337   3.938
  224    H    GLU  34           HN       GLU  34 -12.944   1.831   4.955
  225    HA   GLU  34           HA       GLU  34 -11.278   0.535   6.872
  226    HB2  GLU  34           HB2      GLU  34 -12.861  -1.277   6.629
  227    HB3  GLU  34           HB1      GLU  34 -12.743  -1.196   4.878
  228    HG2  GLU  34           HG2      GLU  34 -10.139  -1.574   5.988
  229    HG3  GLU  34           HG1      GLU  34 -11.251  -2.773   6.648
  230    H    GLU  35           HN       GLU  35 -12.074   0.547   3.416
  231    HA   GLU  35           HA       GLU  35  -9.575  -0.096   2.428
  232    HB2  GLU  35           HB2      GLU  35 -10.380   0.977   0.309
  233    HB3  GLU  35           HB1      GLU  35 -11.471  -0.214   1.000
  234    HG2  GLU  35           HG2      GLU  35 -12.759   1.665   2.014
  235    HG3  GLU  35           HG1      GLU  35 -11.736   2.780   1.114
  236    H    TRP  36           HN       TRP  36  -7.703   0.889   2.356
  237    HA   TRP  36           HA       TRP  36  -7.469   3.688   3.060
  238    HB2  TRP  36           HB2      TRP  36  -5.103   2.121   2.142
  239    HB3  TRP  36           HB1      TRP  36  -5.226   3.301   3.437
  240    HD1  TRP  36           HD1      TRP  36  -7.536   1.784   5.119
  241    HE1  TRP  36           HE1      TRP  36  -6.925  -0.361   6.403
  242    HE3  TRP  36           HE3      TRP  36  -3.265   0.507   2.588
  243    HZ2  TRP  36           HZ2      TRP  36  -4.865  -2.307   6.366
  244    HZ3  TRP  36           HZ3      TRP  36  -2.062  -1.488   3.282
  245    HH2  TRP  36           HH2      TRP  36  -2.833  -2.877   5.112
  246    H    LEU  37           HN       LEU  37  -5.328   4.517   1.631
  247    HA   LEU  37           HA       LEU  37  -6.444   5.155  -0.916
  248    HB2  LEU  37           HB2      LEU  37  -5.022   6.721   0.345
  249    HB3  LEU  37           HB1      LEU  37  -3.672   5.619   0.197
  250    HG   LEU  37           HG       LEU  37  -3.800   5.912  -2.291
  251   HD11  LEU  37          HD11      LEU  37  -6.119   6.657  -2.425
  252   HD12  LEU  37          HD12      LEU  37  -5.023   7.827  -3.159
  253   HD13  LEU  37          HD13      LEU  37  -5.698   8.134  -1.559
  254   HD21  LEU  37          HD21      LEU  37  -3.333   8.402  -0.650
  255   HD22  LEU  37          HD22      LEU  37  -2.733   8.109  -2.282
  256   HD23  LEU  37          HD23      LEU  37  -2.164   7.114  -0.944
  257    H    ASP  38           HN       ASP  38  -6.544   3.564  -2.431
  258    HA   ASP  38           HA       ASP  38  -4.446   1.657  -2.742
  259    HB2  ASP  38           HB2      ASP  38  -6.859   1.300  -3.496
  260    HB3  ASP  38           HB1      ASP  38  -6.459   2.316  -4.883
  261    H    ILE  39           HN       ILE  39  -2.622   1.866  -3.694
  262    HA   ILE  39           HA       ILE  39  -1.550   4.258  -4.578
  263    HB   ILE  39           HB       ILE  39  -0.669   1.448  -5.244
  264   HG12  ILE  39          HG12      ILE  39  -0.236   3.230  -2.868
  265   HG13  ILE  39          HG11      ILE  39  -0.811   1.574  -2.903
  266   HG21  ILE  39          HG21      ILE  39   0.902   4.018  -5.262
  267   HG22  ILE  39          HG22      ILE  39   0.439   3.063  -6.672
  268   HG23  ILE  39          HG23      ILE  39   1.569   2.402  -5.491
  269   HD11  ILE  39          HD11      ILE  39   1.440   1.704  -2.012
  270   HD12  ILE  39          HD12      ILE  39   2.001   2.463  -3.502
  271   HD13  ILE  39          HD13      ILE  39   1.411   0.801  -3.526
  272    H    LEU  40           HN       LEU  40  -3.205   1.738  -6.353
  273    HA   LEU  40           HA       LEU  40  -2.810   3.305  -8.821
  274    HB2  LEU  40           HB2      LEU  40  -3.378   0.353  -8.594
  275    HB3  LEU  40           HB1      LEU  40  -3.103   1.239 -10.082
  276    HG   LEU  40           HG       LEU  40  -1.064   0.717  -7.906
  277   HD11  LEU  40          HD11      LEU  40  -1.578  -1.239  -9.268
  278   HD12  LEU  40          HD12      LEU  40   0.037  -0.629  -9.629
  279   HD13  LEU  40          HD13      LEU  40  -1.296  -0.306 -10.736
  280   HD21  LEU  40          HD21      LEU  40  -0.709   2.911  -8.908
  281   HD22  LEU  40          HD22      LEU  40  -0.786   2.205 -10.521
  282   HD23  LEU  40          HD23      LEU  40   0.540   1.782  -9.436
  283    H    GLY  41           HN       GLY  41  -4.947   2.718  -6.468
  284    HA2  GLY  41           HA2      GLY  41  -7.219   2.870  -6.231
  285    HA3  GLY  41           HA1      GLY  41  -7.258   3.569  -7.841
  286    H    ASN  42           HN       ASN  42  -5.821   0.470  -7.313
  287    HA   ASN  42           HA       ASN  42  -7.862  -0.613  -9.097
  288    HB2  ASN  42           HB2      ASN  42  -6.315  -2.268  -9.790
  289    HB3  ASN  42           HB1      ASN  42  -5.507  -0.721  -9.844
  290   HD21  ASN  42          HD21      ASN  42  -5.141  -0.878  -6.816
  291   HD22  ASN  42          HD22      ASN  42  -3.806  -1.950  -6.636
  292    H    GLY  43           HN       GLY  43  -6.751  -1.010  -5.826
  293    HA2  GLY  43           HA2      GLY  43  -8.689  -1.612  -4.454
  294    HA3  GLY  43           HA1      GLY  43  -8.994  -2.915  -5.587
  295    H    LEU  44           HN       LEU  44  -5.834  -3.206  -5.455
  296    HA   LEU  44           HA       LEU  44  -5.949  -4.882  -3.043
  297    HB2  LEU  44           HB2      LEU  44  -4.315  -6.418  -4.302
  298    HB3  LEU  44           HB1      LEU  44  -6.016  -6.492  -4.672
  299    HG   LEU  44           HG       LEU  44  -4.394  -6.656  -6.606
  300   HD11  LEU  44          HD11      LEU  44  -6.558  -4.563  -6.679
  301   HD12  LEU  44          HD12      LEU  44  -6.741  -6.288  -7.004
  302   HD13  LEU  44          HD13      LEU  44  -5.794  -5.277  -8.096
  303   HD21  LEU  44          HD21      LEU  44  -4.127  -3.734  -5.987
  304   HD22  LEU  44          HD22      LEU  44  -3.649  -4.474  -7.512
  305   HD23  LEU  44          HD23      LEU  44  -2.847  -4.944  -6.008
  306    H    LEU  45           HN       LEU  45  -4.364  -2.318  -4.395
  307    HA   LEU  45           HA       LEU  45  -1.968  -2.838  -2.761
  308    HB2  LEU  45           HB2      LEU  45  -1.260  -2.954  -5.015
  309    HB3  LEU  45           HB1      LEU  45  -2.207  -1.552  -5.461
  310    HG   LEU  45           HG       LEU  45  -0.682  -0.093  -4.237
  311   HD11  LEU  45          HD11      LEU  45   1.348  -0.940  -3.224
  312   HD12  LEU  45          HD12      LEU  45   0.876  -2.595  -3.610
  313   HD13  LEU  45          HD13      LEU  45  -0.065  -1.658  -2.449
  314   HD21  LEU  45          HD21      LEU  45   1.313  -0.414  -5.618
  315   HD22  LEU  45          HD22      LEU  45  -0.174  -0.591  -6.554
  316   HD23  LEU  45          HD23      LEU  45   0.735  -2.021  -6.062
  317    H    ARG  46           HN       ARG  46  -2.349  -1.669  -0.950
  318    HA   ARG  46           HA       ARG  46  -3.190   1.147  -1.270
  319    HB2  ARG  46           HB2      ARG  46  -4.418  -0.950   0.515
  320    HB3  ARG  46           HB1      ARG  46  -4.684   0.771   0.741
  321    HG2  ARG  46           HG2      ARG  46  -5.742   0.950  -1.372
  322    HG3  ARG  46           HG1      ARG  46  -5.313  -0.705  -1.794
  323    HD2  ARG  46           HD2      ARG  46  -7.119   0.091   0.491
  324    HD3  ARG  46           HD1      ARG  46  -7.671  -0.452  -1.095
  325    HE   ARG  46           HE       ARG  46  -6.061  -2.462  -0.341
  326   HH11  ARG  46          HH11      ARG  46  -8.728  -0.880   1.277
  327   HH12  ARG  46          HH12      ARG  46  -9.101  -2.241   2.294
  328   HH21  ARG  46          HH21      ARG  46  -6.556  -4.262   0.951
  329   HH22  ARG  46          HH22      ARG  46  -7.862  -4.181   2.097
  330    H    LYS  47           HN       LYS  47  -2.275   2.572   0.172
  331    HA   LYS  47           HA       LYS  47  -0.389   1.452   2.159
  332    HB2  LYS  47           HB2      LYS  47   0.444   2.854   0.148
  333    HB3  LYS  47           HB1      LYS  47  -0.265   4.223   0.988
  334    HG2  LYS  47           HG2      LYS  47   1.175   3.336   2.989
  335    HG3  LYS  47           HG1      LYS  47   2.104   2.578   1.693
  336    HD2  LYS  47           HD2      LYS  47   3.158   4.621   2.003
  337    HD3  LYS  47           HD1      LYS  47   2.117   4.898   0.614
  338    HE2  LYS  47           HE2      LYS  47   0.671   6.256   1.766
  339    HE3  LYS  47           HE1      LYS  47   1.018   5.494   3.318
  340    HZ1  LYS  47           HZ1      LYS  47   3.102   6.661   3.438
  341    HZ2  LYS  47           HZ2      LYS  47   1.877   7.785   3.135
  342    HZ3  LYS  47           HZ3      LYS  47   2.899   7.294   1.875
  343    H    LYS  48           HN       LYS  48  -0.950   1.773   4.249
  344    HA   LYS  48           HA       LYS  48  -2.720   4.047   4.868
  345    HB2  LYS  48           HB2      LYS  48  -3.676   1.847   5.404
  346    HB3  LYS  48           HB1      LYS  48  -2.295   1.488   6.428
  347    HG2  LYS  48           HG2      LYS  48  -2.934   3.108   8.023
  348    HG3  LYS  48           HG1      LYS  48  -4.108   3.834   6.926
  349    HD2  LYS  48           HD2      LYS  48  -5.264   2.511   8.586
  350    HD3  LYS  48           HD1      LYS  48  -5.428   1.752   7.004
  351    HE2  LYS  48           HE2      LYS  48  -4.991   0.021   8.572
  352    HE3  LYS  48           HE1      LYS  48  -3.522   0.249   7.626
  353    HZ1  LYS  48           HZ1      LYS  48  -4.013   1.375  10.334
  354    HZ2  LYS  48           HZ2      LYS  48  -2.586   1.524   9.434
  355    HZ3  LYS  48           HZ3      LYS  48  -3.073   0.005  10.002
  356    H    THR  49           HN       THR  49  -1.785   5.705   5.780
  357    HA   THR  49           HA       THR  49   0.823   5.628   6.950
  358    HB   THR  49           HB       THR  49   0.108   8.045   7.587
  359    HG1  THR  49           HG1      THR  49  -1.834   8.618   6.934
  360   HG21  THR  49          HG21      THR  49   0.591   8.792   5.294
  361   HG22  THR  49          HG22      THR  49   0.325   7.150   4.706
  362   HG23  THR  49          HG23      THR  49   1.672   7.492   5.793
  363    H    LEU  50           HN       LEU  50   0.886   4.376   8.754
  364    HA   LEU  50           HA       LEU  50  -0.924   4.567  10.945
  365    HB2  LEU  50           HB2      LEU  50   1.992   3.908  11.247
  366    HB3  LEU  50           HB1      LEU  50   0.621   3.231  12.104
  367    HG   LEU  50           HG       LEU  50   1.117   2.707   9.181
  368   HD11  LEU  50          HD11      LEU  50   2.004   1.090  11.562
  369   HD12  LEU  50          HD12      LEU  50   3.050   1.940  10.422
  370   HD13  LEU  50          HD13      LEU  50   2.080   0.568   9.880
  371   HD21  LEU  50          HD21      LEU  50  -0.340   0.790   9.604
  372   HD22  LEU  50          HD22      LEU  50  -1.143   2.322   9.954
  373   HD23  LEU  50          HD23      LEU  50  -0.542   1.320  11.273
  374    H    VAL  51           HN       VAL  51   2.324   5.708  10.402
  375    HA   VAL  51           HA       VAL  51   1.684   8.323  11.587
  376    HB   VAL  51           HB       VAL  51   4.357   6.935  11.741
  377   HG11  VAL  51          HG11      VAL  51   4.900   8.736  13.352
  378   HG12  VAL  51          HG12      VAL  51   3.338   9.475  12.999
  379   HG13  VAL  51          HG13      VAL  51   4.552   9.325  11.727
  380   HG21  VAL  51          HG21      VAL  51   2.808   5.743  13.157
  381   HG22  VAL  51          HG22      VAL  51   2.291   7.251  13.908
  382   HG23  VAL  51          HG23      VAL  51   3.935   6.662  14.156
  383    HA   PRO  52           HA       PRO  52   3.659   9.024   7.630
  384    HB2  PRO  52           HB2      PRO  52   2.062  11.079   6.913
  385    HB3  PRO  52           HB1      PRO  52   1.563   9.382   6.930
  386    HG2  PRO  52           HG2      PRO  52   0.645  11.532   8.638
  387    HG3  PRO  52           HG1      PRO  52   0.031   9.882   8.521
  388    HD2  PRO  52           HD2      PRO  52   2.010  11.027  10.414
  389    HD3  PRO  52           HD1      PRO  52   0.946   9.612  10.609
  390    H    GLY  53           HN       GLY  53   5.497   9.763   9.222
  391    HA2  GLY  53           HA2      GLY  53   7.364  11.088   8.917
  392    HA3  GLY  53           HA1      GLY  53   6.399  12.168   7.930
  393    HA   PRO  54           HA       PRO  54   6.899  13.938  12.341
  394    HB2  PRO  54           HB2      PRO  54   9.660  14.713  11.761
  395    HB3  PRO  54           HB1      PRO  54   9.007  13.928  13.200
  396    HG2  PRO  54           HG2      PRO  54  10.620  12.645  11.446
  397    HG3  PRO  54           HG1      PRO  54   9.353  11.816  12.367
  398    HD2  PRO  54           HD2      PRO  54   9.333  12.728   9.515
  399    HD3  PRO  54           HD1      PRO  54   8.698  11.227  10.226
  400    HA   PRO  55           HA       PRO  55   5.776  17.679  10.285
  401    HB2  PRO  55           HB2      PRO  55   7.242  19.032  12.510
  402    HB3  PRO  55           HB1      PRO  55   5.618  19.345  11.885
  403    HG2  PRO  55           HG2      PRO  55   5.955  18.008  14.158
  404    HG3  PRO  55           HG1      PRO  55   4.701  17.527  13.002
  405    HD2  PRO  55           HD2      PRO  55   7.320  16.246  13.602
  406    HD3  PRO  55           HD1      PRO  55   5.784  15.502  13.110
  407    H    GLY  56           HN       GLY  56   6.860  18.052   8.439
  408    HA2  GLY  56           HA2      GLY  56   8.417  19.329   7.196
  409    HA3  GLY  56           HA1      GLY  56   9.475  19.364   8.603
  410    H    SER  57           HN       SER  57   7.911  16.571   7.055
  411    HA   SER  57           HA       SER  57  10.483  15.310   6.737
  412    HB2  SER  57           HB2      SER  57   8.879  13.474   5.823
  413    HB3  SER  57           HB1      SER  57   8.892  13.814   7.555
  414    HG   SER  57           HG       SER  57   6.929  14.274   5.638
  415    H    SER  58           HN       SER  58  10.020  13.780   4.484
  416    HA   SER  58           HA       SER  58   9.282  15.411   2.251
  417    HB2  SER  58           HB2      SER  58  11.600  16.214   2.709
  418    HB3  SER  58           HB1      SER  58  12.177  14.551   2.573
  419    HG   SER  58           HG       SER  58  12.269  16.031   0.636
  420    H    ARG  59           HN       ARG  59   8.903  14.104   0.428
  421    HA   ARG  59           HA       ARG  59   8.999  11.239   0.996
  422    HB2  ARG  59           HB2      ARG  59   7.657  12.643  -1.326
  423    HB3  ARG  59           HB1      ARG  59   7.447  10.957  -0.839
  424    HG2  ARG  59           HG2      ARG  59   6.577  11.850   1.361
  425    HG3  ARG  59           HG1      ARG  59   6.505  13.431   0.583
  426    HD2  ARG  59           HD2      ARG  59   5.057  10.921  -0.257
  427    HD3  ARG  59           HD1      ARG  59   4.344  12.367   0.454
  428    HE   ARG  59           HE       ARG  59   5.535  13.312  -1.796
  429   HH11  ARG  59          HH11      ARG  59   3.211  10.771  -1.148
  430   HH12  ARG  59          HH12      ARG  59   2.525  10.808  -2.740
  431   HH21  ARG  59          HH21      ARG  59   4.614  13.392  -3.896
  432   HH22  ARG  59          HH22      ARG  59   3.304  12.312  -4.299
  433    HA   PRO  60           HA       PRO  60  12.916  11.077  -1.145
  434    HB2  PRO  60           HB2      PRO  60  12.745   8.291  -1.430
  435    HB3  PRO  60           HB1      PRO  60  13.522   9.164  -0.105
  436    HG2  PRO  60           HG2      PRO  60  10.778   7.987  -0.254
  437    HG3  PRO  60           HG1      PRO  60  11.906   8.044   1.114
  438    HD2  PRO  60           HD2      PRO  60   9.833   9.694   1.039
  439    HD3  PRO  60           HD1      PRO  60  11.423  10.281   1.575
  440    H    VAL  61           HN       VAL  61  13.666  10.735  -3.195
  441    HA   VAL  61           HA       VAL  61  11.597  10.403  -5.230
  442    HB   VAL  61           HB       VAL  61  14.454  11.298  -5.642
  443   HG11  VAL  61          HG11      VAL  61  11.992  11.641  -7.339
  444   HG12  VAL  61          HG12      VAL  61  13.316  10.518  -7.647
  445   HG13  VAL  61          HG13      VAL  61  13.602  12.258  -7.718
  446   HG21  VAL  61          HG21      VAL  61  13.585  13.606  -5.664
  447   HG22  VAL  61          HG22      VAL  61  13.412  12.838  -4.085
  448   HG23  VAL  61          HG23      VAL  61  12.012  12.998  -5.147
  449    H    LYS  62           HN       LYS  62  11.931   8.981  -6.996
  450    HA   LYS  62           HA       LYS  62  13.252   6.528  -6.353
  451    HB2  LYS  62           HB2      LYS  62  12.051   7.575  -8.933
  452    HB3  LYS  62           HB1      LYS  62  12.703   5.953  -8.748
  453    HG2  LYS  62           HG2      LYS  62  11.051   5.426  -7.075
  454    HG3  LYS  62           HG1      LYS  62  10.426   7.076  -7.120
  455    HD2  LYS  62           HD2      LYS  62   9.845   6.749  -9.499
  456    HD3  LYS  62           HD1      LYS  62  10.405   5.080  -9.382
  457    HE2  LYS  62           HE2      LYS  62   8.707   4.649  -7.662
  458    HE3  LYS  62           HE1      LYS  62   8.135   6.311  -7.825
  459    HZ1  LYS  62           HZ1      LYS  62   8.013   4.137  -9.830
  460    HZ2  LYS  62           HZ2      LYS  62   7.785   5.764 -10.245
  461    HZ3  LYS  62           HZ3      LYS  62   6.721   5.015  -9.158
  462    H    GLY  63           HN       GLY  63  15.246   6.038  -6.573
  463    HA2  GLY  63           HA2      GLY  63  17.294   6.230  -8.024
  464    HA3  GLY  63           HA1      GLY  63  17.013   7.969  -7.918
  465    H    GLN  64           HN       GLN  64  16.021   7.748  -5.172
  466    HA   GLN  64           HA       GLN  64  18.594   7.811  -3.844
  467    HB2  GLN  64           HB2      GLN  64  16.035   7.982  -2.311
  468    HB3  GLN  64           HB1      GLN  64  17.555   8.840  -2.055
  469    HG2  GLN  64           HG2      GLN  64  15.492   9.439  -4.168
  470    HG3  GLN  64           HG1      GLN  64  15.785  10.353  -2.698
  471   HE21  GLN  64          HE21      GLN  64  18.241   9.059  -4.873
  472   HE22  GLN  64          HE22      GLN  64  18.878  10.604  -5.340
  473    H    VAL  65           HN       VAL  65  19.360   6.274  -2.427
  474    HA   VAL  65           HA       VAL  65  17.789   3.833  -2.269
  475    HB   VAL  65           HB       VAL  65  19.652   2.665  -1.477
  476   HG11  VAL  65          HG11      VAL  65  21.450   3.155  -3.068
  477   HG12  VAL  65          HG12      VAL  65  20.678   4.697  -3.440
  478   HG13  VAL  65          HG13      VAL  65  19.849   3.186  -3.809
  479   HG21  VAL  65          HG21      VAL  65  21.766   3.713  -0.753
  480   HG22  VAL  65          HG22      VAL  65  20.395   4.089   0.291
  481   HG23  VAL  65          HG23      VAL  65  20.983   5.294  -0.859
  482    H    VAL  66           HN       VAL  66  16.648   3.293  -0.570
  483    HA   VAL  66           HA       VAL  66  16.787   5.058   1.769
  484    HB   VAL  66           HB       VAL  66  14.333   4.998   1.895
  485   HG11  VAL  66          HG11      VAL  66  15.272   6.890   0.763
  486   HG12  VAL  66          HG12      VAL  66  13.857   6.374  -0.145
  487   HG13  VAL  66          HG13      VAL  66  15.477   5.971  -0.721
  488   HG21  VAL  66          HG21      VAL  66  12.962   4.038   0.243
  489   HG22  VAL  66          HG22      VAL  66  14.175   2.807   0.596
  490   HG23  VAL  66          HG23      VAL  66  14.319   3.799  -0.863
  491    H    THR  67           HN       THR  67  16.412   4.205   3.732
  492    HA   THR  67           HA       THR  67  16.525   1.319   3.929
  493    HB   THR  67           HB       THR  67  16.942   1.668   6.305
  494    HG1  THR  67           HG1      THR  67  17.255   4.023   6.889
  495   HG21  THR  67          HG21      THR  67  19.046   2.884   6.201
  496   HG22  THR  67          HG22      THR  67  18.588   3.558   4.637
  497   HG23  THR  67          HG23      THR  67  18.865   1.825   4.804
  498    H    VAL  68           HN       VAL  68  14.604   0.305   3.846
  499    HA   VAL  68           HA       VAL  68  12.474   1.456   5.507
  500    HB   VAL  68           HB       VAL  68  10.897  -0.075   4.316
  501   HG11  VAL  68          HG11      VAL  68  10.783   1.254   2.269
  502   HG12  VAL  68          HG12      VAL  68  12.412   1.863   2.566
  503   HG13  VAL  68          HG13      VAL  68  11.101   2.267   3.676
  504   HG21  VAL  68          HG21      VAL  68  12.480  -1.747   3.550
  505   HG22  VAL  68          HG22      VAL  68  13.283  -0.557   2.526
  506   HG23  VAL  68          HG23      VAL  68  11.627  -1.049   2.173
  507    H    HIS  69           HN       HIS  69  11.676   0.315   7.188
  508    HA   HIS  69           HA       HIS  69  12.744  -2.392   7.580
  509    HB2  HIS  69           HB2      HIS  69  12.958  -0.952   9.567
  510    HB3  HIS  69           HB1      HIS  69  11.239  -0.583   9.515
  511    HD1  HIS  69           HD1      HIS  69  12.727  -2.041  11.974
  512    HD2  HIS  69           HD2      HIS  69  10.444  -3.854   9.017
  513    HE1  HIS  69           HE1      HIS  69  11.928  -4.260  12.922
  514    HE2  HIS  69           HE2      HIS  69  10.618  -5.332  11.123
  515    H    LEU  70           HN       LEU  70  11.463  -4.017   6.874
  516    HA   LEU  70           HA       LEU  70   8.603  -3.456   7.037
  517    HB2  LEU  70           HB2      LEU  70   8.080  -4.106   4.964
  518    HB3  LEU  70           HB1      LEU  70   9.714  -3.572   4.637
  519    HG   LEU  70           HG       LEU  70   9.035  -6.444   5.228
  520   HD11  LEU  70          HD11      LEU  70   9.092  -6.802   2.788
  521   HD12  LEU  70          HD12      LEU  70   9.209  -5.061   2.541
  522   HD13  LEU  70          HD13      LEU  70   7.757  -5.753   3.265
  523   HD21  LEU  70          HD21      LEU  70  11.162  -6.907   4.204
  524   HD22  LEU  70          HD22      LEU  70  11.386  -5.686   5.461
  525   HD23  LEU  70          HD23      LEU  70  11.365  -5.209   3.763
  526    H    GLN  71           HN       GLN  71   7.433  -4.835   8.017
  527    HA   GLN  71           HA       GLN  71   8.313  -7.640   8.223
  528    HB2  GLN  71           HB2      GLN  71   6.418  -6.598  10.240
  529    HB3  GLN  71           HB1      GLN  71   7.638  -7.849  10.406
  530    HG2  GLN  71           HG2      GLN  71   8.605  -6.309  11.707
  531    HG3  GLN  71           HG1      GLN  71   9.254  -5.772  10.162
  532   HE21  GLN  71          HE21      GLN  71   6.525  -4.828   9.400
  533   HE22  GLN  71          HE22      GLN  71   6.375  -3.310  10.214
  534    H    THR  72           HN       THR  72   7.034  -8.809   7.121
  535    HA   THR  72           HA       THR  72   4.563  -7.568   6.205
  536    HB   THR  72           HB       THR  72   6.280  -9.673   4.926
  537    HG1  THR  72           HG1      THR  72   6.941  -7.943   3.595
  538   HG21  THR  72          HG21      THR  72   3.909  -8.121   3.918
  539   HG22  THR  72          HG22      THR  72   3.989  -9.862   4.214
  540   HG23  THR  72          HG23      THR  72   4.944  -9.141   2.918
  541    H    SER  73           HN       SER  73   2.706  -8.482   6.610
  542    HA   SER  73           HA       SER  73   2.644 -11.197   7.713
  543    HB2  SER  73           HB2      SER  73   0.283  -9.335   7.736
  544    HB3  SER  73           HB1      SER  73   0.734 -10.570   8.909
  545    HG   SER  73           HG       SER  73   1.344  -7.932   8.858
  546    H    LEU  74           HN       LEU  74   1.043 -12.605   6.967
  547    HA   LEU  74           HA       LEU  74   0.422 -12.356   4.170
  548    HB2  LEU  74           HB2      LEU  74  -0.087 -14.487   6.228
  549    HB3  LEU  74           HB1      LEU  74  -0.659 -14.615   4.575
  550    HG   LEU  74           HG       LEU  74   2.132 -14.731   5.633
  551   HD11  LEU  74          HD11      LEU  74   0.576 -16.368   3.641
  552   HD12  LEU  74          HD12      LEU  74   0.959 -16.819   5.303
  553   HD13  LEU  74          HD13      LEU  74   2.251 -16.656   4.111
  554   HD21  LEU  74          HD21      LEU  74   1.372 -14.025   2.810
  555   HD22  LEU  74          HD22      LEU  74   2.991 -14.462   3.356
  556   HD23  LEU  74          HD23      LEU  74   2.222 -12.988   3.962
  557    H    GLU  75           HN       GLU  75  -1.776 -12.778   3.382
  558    HA   GLU  75           HA       GLU  75  -3.772 -11.159   4.365
  559    HB2  GLU  75           HB2      GLU  75  -5.317 -12.686   3.052
  560    HB3  GLU  75           HB1      GLU  75  -3.966 -11.998   2.166
  561    HG2  GLU  75           HG2      GLU  75  -2.730 -14.088   2.419
  562    HG3  GLU  75           HG1      GLU  75  -4.096 -14.780   3.295
  563    H    ASN  76           HN       ASN  76  -2.678 -14.165   5.550
  564    HA   ASN  76           HA       ASN  76  -5.091 -14.761   7.062
  565    HB2  ASN  76           HB2      ASN  76  -2.435 -16.217   7.066
  566    HB3  ASN  76           HB1      ASN  76  -3.949 -16.797   7.749
  567   HD21  ASN  76          HD21      ASN  76  -2.085 -16.360   4.886
  568   HD22  ASN  76          HD22      ASN  76  -3.148 -17.186   3.805
  569    H    GLY  77           HN       GLY  77  -2.501 -12.749   7.435
  570    HA2  GLY  77           HA2      GLY  77  -2.107 -11.399   9.315
  571    HA3  GLY  77           HA1      GLY  77  -2.923 -12.588  10.321
  572    H    THR  78           HN       THR  78  -0.713 -13.980   8.207
  573    HA   THR  78           HA       THR  78   1.018 -14.596  10.455
  574    HB   THR  78           HB       THR  78   1.012 -15.882   7.727
  575    HG1  THR  78           HG1      THR  78  -0.516 -16.398  10.067
  576   HG21  THR  78          HG21      THR  78   2.047 -17.766   8.927
  577   HG22  THR  78          HG22      THR  78   2.022 -16.824  10.418
  578   HG23  THR  78          HG23      THR  78   3.021 -16.301   9.061
  579    H    ARG  79           HN       ARG  79   2.754 -13.358  10.718
  580    HA   ARG  79           HA       ARG  79   3.868 -11.858   8.538
  581    HB2  ARG  79           HB2      ARG  79   4.748 -12.213  11.392
  582    HB3  ARG  79           HB1      ARG  79   5.592 -11.189  10.230
  583    HG2  ARG  79           HG2      ARG  79   3.037 -10.349   9.914
  584    HG3  ARG  79           HG1      ARG  79   3.063 -10.757  11.636
  585    HD2  ARG  79           HD2      ARG  79   4.932  -9.303  12.019
  586    HD3  ARG  79           HD1      ARG  79   5.110  -9.007  10.285
  587    HE   ARG  79           HE       ARG  79   2.601  -8.165  10.756
  588   HH11  ARG  79          HH11      ARG  79   5.638  -7.488  12.354
  589   HH12  ARG  79          HH12      ARG  79   5.171  -5.887  12.842
  590   HH21  ARG  79          HH21      ARG  79   1.965  -6.067  11.401
  591   HH22  ARG  79          HH22      ARG  79   3.069  -5.071  12.317
  592    H    VAL  80           HN       VAL  80   5.311 -12.438   7.180
  593    HA   VAL  80           HA       VAL  80   6.504 -15.097   7.510
  594    HB   VAL  80           HB       VAL  80   6.521 -15.153   5.037
  595   HG11  VAL  80          HG11      VAL  80   4.702 -16.147   6.338
  596   HG12  VAL  80          HG12      VAL  80   4.134 -15.525   4.789
  597   HG13  VAL  80          HG13      VAL  80   3.830 -14.612   6.268
  598   HG21  VAL  80          HG21      VAL  80   4.949 -12.588   5.268
  599   HG22  VAL  80          HG22      VAL  80   5.217 -13.505   3.786
  600   HG23  VAL  80          HG23      VAL  80   6.579 -12.744   4.607
  601    H    GLN  81           HN       GLN  81   7.319 -11.852   7.388
  602    HA   GLN  81           HA       GLN  81  10.112 -12.427   7.099
  603    HB2  GLN  81           HB2      GLN  81  10.462 -10.938   5.151
  604    HB3  GLN  81           HB1      GLN  81   9.499 -12.353   4.745
  605    HG2  GLN  81           HG2      GLN  81   7.458 -10.915   5.025
  606    HG3  GLN  81           HG1      GLN  81   8.538  -9.530   5.137
  607   HE21  GLN  81          HE21      GLN  81   7.178 -11.958   3.082
  608   HE22  GLN  81          HE22      GLN  81   7.676 -11.254   1.583
  609    H    GLU  82           HN       GLU  82  11.120 -11.131   8.498
  610    HA   GLU  82           HA       GLU  82  10.071  -8.406   8.815
  611    HB2  GLU  82           HB2      GLU  82   9.469  -9.681  10.827
  612    HB3  GLU  82           HB1      GLU  82  11.161 -10.111  11.059
  613    HG2  GLU  82           HG2      GLU  82  11.771  -7.877  11.510
  614    HG3  GLU  82           HG1      GLU  82  10.218  -7.264  10.954
  615    H    GLU  83           HN       GLU  83  11.462  -7.177   7.896
  616    HA   GLU  83           HA       GLU  83  14.321  -7.661   8.326
  617    HB2  GLU  83           HB2      GLU  83  14.033  -8.098   6.062
  618    HB3  GLU  83           HB1      GLU  83  12.748  -6.922   5.892
  619    HG2  GLU  83           HG2      GLU  83  14.627  -6.137   4.689
  620    HG3  GLU  83           HG1      GLU  83  14.442  -5.130   6.129
  621    HA   PRO  84           HA       PRO  84  13.800  -3.848  10.525
  622    HB2  PRO  84           HB2      PRO  84  16.391  -3.682  11.371
  623    HB3  PRO  84           HB1      PRO  84  15.170  -4.703  12.136
  624    HG2  PRO  84           HG2      PRO  84  17.298  -5.442  10.169
  625    HG3  PRO  84           HG1      PRO  84  16.756  -6.314  11.614
  626    HD2  PRO  84           HD2      PRO  84  15.976  -7.010   9.125
  627    HD3  PRO  84           HD1      PRO  84  14.922  -7.210  10.540
  628    H    GLU  85           HN       GLU  85  15.976  -4.373   7.835
  629    HA   GLU  85           HA       GLU  85  15.761  -1.634   7.098
  630    HB2  GLU  85           HB2      GLU  85  17.470  -1.458   8.897
  631    HB3  GLU  85           HB1      GLU  85  18.522  -2.509   7.959
  632    HG2  GLU  85           HG2      GLU  85  18.781  -0.902   6.257
  633    HG3  GLU  85           HG1      GLU  85  17.439   0.065   6.867
  634    H    LEU  86           HN       LEU  86  15.174  -2.149   5.208
  635    HA   LEU  86           HA       LEU  86  17.013  -3.584   3.442
  636    HB2  LEU  86           HB2      LEU  86  14.820  -4.556   3.512
  637    HB3  LEU  86           HB1      LEU  86  14.059  -2.993   3.326
  638    HG   LEU  86           HG       LEU  86  14.968  -2.847   1.059
  639   HD11  LEU  86          HD11      LEU  86  16.916  -4.282   1.289
  640   HD12  LEU  86          HD12      LEU  86  15.878  -4.878  -0.009
  641   HD13  LEU  86          HD13      LEU  86  15.875  -5.679   1.564
  642   HD21  LEU  86          HD21      LEU  86  13.455  -4.557   0.085
  643   HD22  LEU  86          HD22      LEU  86  12.711  -3.626   1.381
  644   HD23  LEU  86          HD23      LEU  86  13.282  -5.264   1.687
  645    H    VAL  87           HN       VAL  87  18.360  -2.098   2.540
  646    HA   VAL  87           HA       VAL  87  17.233   0.510   1.780
  647    HB   VAL  87           HB       VAL  87  20.136  -0.071   1.498
  648   HG11  VAL  87          HG11      VAL  87  19.285   2.056   0.742
  649   HG12  VAL  87          HG12      VAL  87  20.370   2.267   2.119
  650   HG13  VAL  87          HG13      VAL  87  18.624   2.369   2.347
  651   HG21  VAL  87          HG21      VAL  87  19.724  -0.975   3.678
  652   HG22  VAL  87          HG22      VAL  87  18.791   0.454   4.125
  653   HG23  VAL  87          HG23      VAL  87  20.529   0.586   3.848
  654    H    PHE  88           HN       PHE  88  16.871   0.956  -0.315
  655    HA   PHE  88           HA       PHE  88  18.090  -0.702  -2.395
  656    HB2  PHE  88           HB2      PHE  88  15.960  -1.349  -3.348
  657    HB3  PHE  88           HB1      PHE  88  16.061  -1.924  -1.687
  658    HD1  PHE  88           HD2      PHE  88  14.824  -0.683   0.102
  659    HD2  PHE  88           HD1      PHE  88  14.253   0.112  -4.039
  660    HE1  PHE  88           HE2      PHE  88  12.695   0.441   0.612
  661    HE2  PHE  88           HE1      PHE  88  12.131   1.235  -3.540
  662    HZ   PHE  88           HZ       PHE  88  11.327   1.362  -1.215
  663    H    THR  89           HN       THR  89  17.629   0.103  -4.557
  664    HA   THR  89           HA       THR  89  17.539   2.985  -4.607
  665    HB   THR  89           HB       THR  89  17.631   1.087  -6.965
  666    HG1  THR  89           HG1      THR  89  19.542   1.778  -5.079
  667   HG21  THR  89          HG21      THR  89  18.696   2.976  -8.105
  668   HG22  THR  89          HG22      THR  89  18.540   3.956  -6.649
  669   HG23  THR  89          HG23      THR  89  17.097   3.427  -7.513
  670    H    LEU  90           HN       LEU  90  15.639   3.963  -4.469
  671    HA   LEU  90           HA       LEU  90  13.121   2.840  -4.953
  672    HB2  LEU  90           HB2      LEU  90  13.755   4.982  -3.696
  673    HB3  LEU  90           HB1      LEU  90  13.759   5.763  -5.239
  674    HG   LEU  90           HG       LEU  90  11.408   5.289  -5.553
  675   HD11  LEU  90          HD11      LEU  90  11.310   3.122  -4.450
  676   HD12  LEU  90          HD12      LEU  90  10.106   4.212  -3.763
  677   HD13  LEU  90          HD13      LEU  90  11.602   3.885  -2.889
  678   HD21  LEU  90          HD21      LEU  90  11.888   6.368  -2.779
  679   HD22  LEU  90          HD22      LEU  90  10.520   6.720  -3.837
  680   HD23  LEU  90          HD23      LEU  90  12.131   7.287  -4.263
  681    H    GLY  91           HN       GLY  91  11.978   2.496  -6.786
  682    HA2  GLY  91           HA2      GLY  91  11.152   2.943  -8.911
  683    HA3  GLY  91           HA1      GLY  91  12.388   4.172  -9.117
  684    H    ASP  92           HN       ASP  92  13.866   1.456  -7.967
  685    HA   ASP  92           HA       ASP  92  14.761   0.757 -10.666
  686    HB2  ASP  92           HB2      ASP  92  16.505   1.446  -9.075
  687    HB3  ASP  92           HB1      ASP  92  16.027   0.138  -7.995
  688    H    CYS  93           HN       CYS  93  12.567  -0.230  -8.491
  689    HA   CYS  93           HA       CYS  93  11.432  -2.158  -8.092
  690    HB2  CYS  93           HB2      CYS  93  12.688  -3.184 -10.647
  691    HB3  CYS  93           HB1      CYS  93  11.186  -3.724  -9.900
  692    HG   CYS  93           HG       CYS  93   9.668  -2.171 -11.245
  693    H    ASP  94           HN       ASP  94  14.103  -1.811  -7.016
  694    HA   ASP  94           HA       ASP  94  15.500  -4.284  -7.205
  695    HB2  ASP  94           HB2      ASP  94  16.601  -2.146  -6.562
  696    HB3  ASP  94           HB1      ASP  94  15.691  -2.164  -5.052
  697    H    VAL  95           HN       VAL  95  12.708  -3.350  -5.856
  698    HA   VAL  95           HA       VAL  95  12.649  -5.483  -3.839
  699    HB   VAL  95           HB       VAL  95  11.139  -3.945  -2.517
  700   HG11  VAL  95          HG11      VAL  95  12.969  -2.694  -1.538
  701   HG12  VAL  95          HG12      VAL  95  13.945  -2.953  -2.983
  702   HG13  VAL  95          HG13      VAL  95  13.511  -4.319  -1.959
  703   HG21  VAL  95          HG21      VAL  95  11.307  -1.534  -2.995
  704   HG22  VAL  95          HG22      VAL  95  10.549  -2.413  -4.323
  705   HG23  VAL  95          HG23      VAL  95  12.232  -1.895  -4.454
  706    H    ILE  96           HN       ILE  96   9.954  -4.957  -3.133
  707    HA   ILE  96           HA       ILE  96   8.591  -6.032  -5.414
  708    HB   ILE  96           HB       ILE  96   6.649  -6.193  -3.955
  709   HG12  ILE  96          HG12      ILE  96   8.354  -4.809  -1.871
  710   HG13  ILE  96          HG11      ILE  96   6.984  -4.076  -2.699
  711   HG21  ILE  96          HG21      ILE  96   9.190  -7.047  -2.574
  712   HG22  ILE  96          HG22      ILE  96   8.332  -7.944  -3.829
  713   HG23  ILE  96          HG23      ILE  96   7.579  -7.688  -2.255
  714   HD11  ILE  96          HD11      ILE  96   6.863  -6.462  -0.866
  715   HD12  ILE  96          HD12      ILE  96   5.490  -5.715  -1.682
  716   HD13  ILE  96          HD13      ILE  96   6.387  -4.813  -0.461
  717    H    GLN  97           HN       GLN  97   7.137  -4.945  -6.649
  718    HA   GLN  97           HA       GLN  97   7.667  -2.228  -7.045
  719    HB2  GLN  97           HB2      GLN  97   6.568  -4.074  -8.608
  720    HB3  GLN  97           HB1      GLN  97   5.080  -3.334  -8.034
  721    HG2  GLN  97           HG2      GLN  97   5.611  -2.247 -10.051
  722    HG3  GLN  97           HG1      GLN  97   6.037  -1.118  -8.765
  723   HE21  GLN  97          HE21      GLN  97   8.260  -0.679  -8.366
  724   HE22  GLN  97          HE22      GLN  97   9.468  -1.076  -9.532
  725    H    ALA  98           HN       ALA  98   5.258  -3.834  -5.110
  726    HA   ALA  98           HA       ALA  98   3.513  -1.703  -4.575
  727    HB1  ALA  98           HB1      ALA  98   3.054  -3.990  -3.879
  728    HB2  ALA  98           HB2      ALA  98   2.992  -2.896  -2.498
  729    HB3  ALA  98           HB3      ALA  98   4.401  -3.931  -2.743
  730    H    LEU  99           HN       LEU  99   6.558  -2.652  -3.073
  731    HA   LEU  99           HA       LEU  99   6.452  -0.567  -1.103
  732    HB2  LEU  99           HB2      LEU  99   7.637  -2.622  -0.595
  733    HB3  LEU  99           HB1      LEU  99   8.724  -2.344  -1.943
  734    HG   LEU  99           HG       LEU  99   9.612  -0.348  -0.835
  735   HD11  LEU  99          HD11      LEU  99   7.600   0.291   0.392
  736   HD12  LEU  99          HD12      LEU  99   8.995   0.172   1.465
  737   HD13  LEU  99          HD13      LEU  99   7.786  -1.113   1.440
  738   HD21  LEU  99          HD21      LEU  99   9.621  -2.830   0.879
  739   HD22  LEU  99          HD22      LEU  99  10.746  -1.480   1.033
  740   HD23  LEU  99          HD23      LEU  99  10.733  -2.450  -0.440
  741    H    ASP 100           HN       ASP 100   7.964  -1.103  -4.175
  742    HA   ASP 100           HA       ASP 100   9.784   1.032  -4.162
  743    HB2  ASP 100           HB2      ASP 100   9.872  -0.874  -5.724
  744    HB3  ASP 100           HB1      ASP 100   8.388  -0.328  -6.478
  745    H    LEU 101           HN       LEU 101   6.390   0.806  -4.843
  746    HA   LEU 101           HA       LEU 101   6.244   3.528  -5.797
  747    HB2  LEU 101           HB2      LEU 101   4.097   1.476  -5.310
  748    HB3  LEU 101           HB1      LEU 101   3.864   3.023  -6.073
  749    HG   LEU 101           HG       LEU 101   5.492   0.733  -7.143
  750   HD11  LEU 101          HD11      LEU 101   3.089   0.419  -7.338
  751   HD12  LEU 101          HD12      LEU 101   3.826   0.682  -8.917
  752   HD13  LEU 101          HD13      LEU 101   2.937   1.987  -8.129
  753   HD21  LEU 101          HD21      LEU 101   5.047   3.477  -8.323
  754   HD22  LEU 101          HD22      LEU 101   5.828   2.119  -9.136
  755   HD23  LEU 101          HD23      LEU 101   6.571   2.834  -7.707
  756    H    SER 102           HN       SER 102   5.525   1.727  -2.852
  757    HA   SER 102           HA       SER 102   3.759   3.721  -1.840
  758    HB2  SER 102           HB2      SER 102   3.941   2.378   0.302
  759    HB3  SER 102           HB1      SER 102   3.366   1.495  -1.110
  760    HG   SER 102           HG       SER 102   5.141   0.351  -1.151
  761    H    VAL 103           HN       VAL 103   7.175   3.143  -1.689
  762    HA   VAL 103           HA       VAL 103   7.827   4.669   0.566
  763    HB   VAL 103           HB       VAL 103   9.399   4.071  -1.916
  764   HG11  VAL 103          HG11      VAL 103  11.389   4.868  -0.744
  765   HG12  VAL 103          HG12      VAL 103  10.411   5.323   0.652
  766   HG13  VAL 103          HG13      VAL 103  10.212   6.173  -0.880
  767   HG21  VAL 103          HG21      VAL 103   9.211   2.917   0.846
  768   HG22  VAL 103          HG22      VAL 103  10.660   2.693  -0.127
  769   HG23  VAL 103          HG23      VAL 103   9.105   2.096  -0.713
  770    HA   PRO 104           HA       PRO 104   8.385   8.509  -2.356
  771    HB2  PRO 104           HB2      PRO 104   7.016   8.315  -4.745
  772    HB3  PRO 104           HB1      PRO 104   8.751   8.038  -4.560
  773    HG2  PRO 104           HG2      PRO 104   6.519   6.050  -4.689
  774    HG3  PRO 104           HG1      PRO 104   8.130   5.975  -5.415
  775    HD2  PRO 104           HD2      PRO 104   7.549   4.607  -3.204
  776    HD3  PRO 104           HD1      PRO 104   9.140   5.338  -3.451
  777    H    LEU 105           HN       LEU 105   5.525   6.497  -2.292
  778    HA   LEU 105           HA       LEU 105   3.681   8.687  -2.126
  779    HB2  LEU 105           HB2      LEU 105   3.510   5.743  -1.621
  780    HB3  LEU 105           HB1      LEU 105   2.170   6.804  -1.206
  781    HG   LEU 105           HG       LEU 105   3.305   6.252  -3.940
  782   HD11  LEU 105          HD11      LEU 105   0.615   5.808  -2.675
  783   HD12  LEU 105          HD12      LEU 105   1.785   4.576  -3.153
  784   HD13  LEU 105          HD13      LEU 105   0.982   5.556  -4.381
  785   HD21  LEU 105          HD21      LEU 105   2.840   8.627  -3.795
  786   HD22  LEU 105          HD22      LEU 105   1.239   8.292  -3.138
  787   HD23  LEU 105          HD23      LEU 105   1.627   7.826  -4.794
  788    H    MET 106           HN       MET 106   5.826   7.235   0.068
  789    HA   MET 106           HA       MET 106   4.287   8.197   2.373
  790    HB2  MET 106           HB2      MET 106   5.081   6.437   3.538
  791    HB3  MET 106           HB1      MET 106   5.399   5.761   1.953
  792    HG2  MET 106           HG2      MET 106   7.708   6.852   2.172
  793    HG3  MET 106           HG1      MET 106   7.298   7.015   3.884
  794    HE1  MET 106           HE1      MET 106   6.722   3.235   4.870
  795    HE2  MET 106           HE2      MET 106   5.520   4.402   4.319
  796    HE3  MET 106           HE3      MET 106   6.758   4.888   5.475
  797    H    ASP 107           HN       ASP 107   5.379   9.378   4.062
  798    HA   ASP 107           HA       ASP 107   7.446  11.143   2.998
  799    HB2  ASP 107           HB2      ASP 107   5.582  11.232   5.326
  800    HB3  ASP 107           HB1      ASP 107   7.085  12.130   5.450
  801    H    VAL 108           HN       VAL 108   9.438  11.552   4.107
  802    HA   VAL 108           HA       VAL 108  10.705   9.212   5.033
  803    HB   VAL 108           HB       VAL 108  11.753  11.362   3.991
  804   HG11  VAL 108          HG11      VAL 108  12.172  12.028   6.891
  805   HG12  VAL 108          HG12      VAL 108  11.029  12.859   5.845
  806   HG13  VAL 108          HG13      VAL 108  12.754  12.923   5.487
  807   HG21  VAL 108          HG21      VAL 108  13.159   9.852   6.185
  808   HG22  VAL 108          HG22      VAL 108  13.936  10.744   4.875
  809   HG23  VAL 108          HG23      VAL 108  12.968   9.314   4.516
  810    H    GLY 109           HN       GLY 109  10.750   8.303   6.912
  811    HA2  GLY 109           HA2      GLY 109  11.073   8.290   9.256
  812    HA3  GLY 109           HA1      GLY 109  10.436   9.928   9.322
  813    H    GLU 110           HN       GLU 110   8.488   7.984   7.349
  814    HA   GLU 110           HA       GLU 110   6.559   7.818   9.530
  815    HB2  GLU 110           HB2      GLU 110   4.831   7.837   7.979
  816    HB3  GLU 110           HB1      GLU 110   5.993   8.981   7.330
  817    HG2  GLU 110           HG2      GLU 110   6.621   7.508   5.618
  818    HG3  GLU 110           HG1      GLU 110   5.839   6.135   6.406
  819    H    THR 111           HN       THR 111   5.028   5.985   9.431
  820    HA   THR 111           HA       THR 111   6.297   3.512   8.527
  821    HB   THR 111           HB       THR 111   4.696   3.699  11.082
  822    HG1  THR 111           HG1      THR 111   7.176   4.600  10.653
  823   HG21  THR 111          HG21      THR 111   5.773   1.548  11.573
  824   HG22  THR 111          HG22      THR 111   6.619   1.617  10.027
  825   HG23  THR 111          HG23      THR 111   4.860   1.471  10.064
  826    H    ALA 112           HN       ALA 112   5.012   2.585   7.075
  827    HA   ALA 112           HA       ALA 112   2.132   3.182   7.235
  828    HB1  ALA 112           HB1      ALA 112   3.791   2.889   4.734
  829    HB2  ALA 112           HB2      ALA 112   3.195   4.408   5.403
  830    HB3  ALA 112           HB3      ALA 112   2.055   3.202   4.803
  831    H    MET 113           HN       MET 113   0.763   1.534   6.998
  832    HA   MET 113           HA       MET 113   1.913  -1.136   6.588
  833    HB2  MET 113           HB2      MET 113   0.536  -1.166   8.514
  834    HB3  MET 113           HB1      MET 113  -0.688  -0.147   7.762
  835    HG2  MET 113           HG2      MET 113  -1.304  -1.965   6.272
  836    HG3  MET 113           HG1      MET 113  -0.065  -2.989   6.993
  837    HE1  MET 113           HE1      MET 113  -0.371  -4.396   9.060
  838    HE2  MET 113           HE2      MET 113  -1.401  -3.927  10.413
  839    HE3  MET 113           HE3      MET 113  -0.076  -2.876   9.907
  840    H    VAL 114           HN       VAL 114   1.819  -1.896   4.585
  841    HA   VAL 114           HA       VAL 114  -0.224  -0.757   2.788
  842    HB   VAL 114           HB       VAL 114   2.365  -2.003   1.926
  843   HG11  VAL 114          HG11      VAL 114   2.024  -0.760  -0.132
  844   HG12  VAL 114          HG12      VAL 114   0.536  -0.074   0.524
  845   HG13  VAL 114          HG13      VAL 114   0.648  -1.808   0.212
  846   HG21  VAL 114          HG21      VAL 114   2.854  -0.153   3.431
  847   HG22  VAL 114          HG22      VAL 114   1.870   0.908   2.422
  848   HG23  VAL 114          HG23      VAL 114   3.349   0.196   1.775
  849    H    THR 115           HN       THR 115  -1.667  -2.145   2.017
  850    HA   THR 115           HA       THR 115  -0.920  -4.980   2.082
  851    HB   THR 115           HB       THR 115  -3.704  -3.808   1.863
  852    HG1  THR 115           HG1      THR 115  -3.564  -5.227   4.003
  853   HG21  THR 115          HG21      THR 115  -2.738  -6.640   2.178
  854   HG22  THR 115          HG22      THR 115  -3.389  -5.944   0.695
  855   HG23  THR 115          HG23      THR 115  -4.422  -6.119   2.113
  856    H    ALA 116           HN       ALA 116  -0.222  -5.682   0.313
  857    HA   ALA 116           HA       ALA 116  -1.230  -4.631  -2.262
  858    HB1  ALA 116           HB1      ALA 116   0.990  -3.733  -1.806
  859    HB2  ALA 116           HB2      ALA 116   1.021  -4.867  -3.157
  860    HB3  ALA 116           HB3      ALA 116   1.604  -5.369  -1.570
  861    H    ASP 117           HN       ASP 117  -1.828  -6.145  -3.672
  862    HA   ASP 117           HA       ASP 117  -2.007  -8.848  -3.083
  863    HB2  ASP 117           HB2      ASP 117  -3.075  -7.554  -5.047
  864    HB3  ASP 117           HB1      ASP 117  -1.563  -7.872  -5.870
  865    H    SER 118           HN       SER 118  -0.730 -10.649  -3.688
  866    HA   SER 118           HA       SER 118   2.002 -10.371  -3.264
  867    HB2  SER 118           HB2      SER 118   0.425 -12.473  -3.190
  868    HB3  SER 118           HB1      SER 118   0.949 -12.675  -4.862
  869    HG   SER 118           HG       SER 118   2.238 -13.779  -3.230
  870    H    LYS 119           HN       LYS 119   0.155 -10.214  -6.205
  871    HA   LYS 119           HA       LYS 119   2.134 -10.501  -8.112
  872    HB2  LYS 119           HB2      LYS 119   0.738  -8.913  -9.469
  873    HB3  LYS 119           HB1      LYS 119  -0.118 -10.307  -8.819
  874    HG2  LYS 119           HG2      LYS 119  -1.077  -8.939  -7.090
  875    HG3  LYS 119           HG1      LYS 119  -0.102  -7.558  -7.603
  876    HD2  LYS 119           HD2      LYS 119  -2.340  -7.311  -8.451
  877    HD3  LYS 119           HD1      LYS 119  -1.237  -7.617  -9.796
  878    HE2  LYS 119           HE2      LYS 119  -1.897 -10.075  -9.531
  879    HE3  LYS 119           HE1      LYS 119  -3.225  -9.480  -8.528
  880    HZ1  LYS 119           HZ1      LYS 119  -2.706  -8.857 -11.384
  881    HZ2  LYS 119           HZ2      LYS 119  -3.837  -8.018 -10.443
  882    HZ3  LYS 119           HZ3      LYS 119  -4.043  -9.678 -10.736
  883    H    TYR 120           HN       TYR 120   1.475  -7.716  -6.006
  884    HA   TYR 120           HA       TYR 120   3.661  -6.246  -7.299
  885    HB2  TYR 120           HB2      TYR 120   1.828  -5.378  -5.055
  886    HB3  TYR 120           HB1      TYR 120   3.025  -4.367  -5.853
  887    HD1  TYR 120           HD2      TYR 120  -0.189  -6.056  -6.200
  888    HD2  TYR 120           HD1      TYR 120   2.602  -3.406  -8.001
  889    HE1  TYR 120           HE2      TYR 120  -1.881  -5.424  -7.840
  890    HE2  TYR 120           HE1      TYR 120   0.898  -2.752  -9.667
  891    HH   TYR 120           HH       TYR 120  -2.377  -3.452  -9.314
  892    H    CYS 121           HN       CYS 121   3.376  -8.580  -5.146
  893    HA   CYS 121           HA       CYS 121   5.567  -7.593  -3.449
  894    HB2  CYS 121           HB2      CYS 121   3.450  -9.636  -2.759
  895    HB3  CYS 121           HB1      CYS 121   4.741  -9.086  -1.698
  896    HG   CYS 121           HG       CYS 121   1.757  -7.836  -2.089
  897    H    TYR 122           HN       TYR 122   4.448 -10.951  -3.516
  898    HA   TYR 122           HA       TYR 122   6.720 -11.662  -5.224
  899    HB2  TYR 122           HB2      TYR 122   6.291 -13.154  -2.639
  900    HB3  TYR 122           HB1      TYR 122   7.659 -13.212  -3.726
  901    HD1  TYR 122           HD1      TYR 122   6.062 -11.317  -1.025
  902    HD2  TYR 122           HD2      TYR 122   9.408 -11.525  -3.646
  903    HE1  TYR 122           HE1      TYR 122   7.227  -9.628   0.331
  904    HE2  TYR 122           HE2      TYR 122  10.579  -9.849  -2.295
  905    HH   TYR 122           HH       TYR 122  10.040  -8.031  -0.733
  906    H    GLY 123           HN       GLY 123   3.888 -11.795  -5.856
  907    HA2  GLY 123           HA2      GLY 123   2.659 -14.228  -5.454
  908    HA3  GLY 123           HA1      GLY 123   2.481 -13.272  -6.912
  909    HA   PRO 124           HA       PRO 124   4.656 -16.556  -8.979
  910    HB2  PRO 124           HB2      PRO 124   5.441 -15.346 -11.233
  911    HB3  PRO 124           HB1      PRO 124   3.729 -15.613 -10.888
  912    HG2  PRO 124           HG2      PRO 124   5.343 -13.115 -10.648
  913    HG3  PRO 124           HG1      PRO 124   3.672 -13.325 -11.199
  914    HD2  PRO 124           HD2      PRO 124   4.432 -12.507  -8.647
  915    HD3  PRO 124           HD1      PRO 124   2.852 -13.181  -9.075
  916    H    GLN 125           HN       GLN 125   6.104 -14.303  -7.287
  917    HA   GLN 125           HA       GLN 125   8.794 -14.571  -8.452
  918    HB2  GLN 125           HB2      GLN 125   7.844 -12.605  -6.362
  919    HB3  GLN 125           HB1      GLN 125   9.361 -12.563  -7.250
  920    HG2  GLN 125           HG2      GLN 125   8.250 -12.046  -9.286
  921    HG3  GLN 125           HG1      GLN 125   6.674 -12.341  -8.566
  922   HE21  GLN 125          HE21      GLN 125   5.762 -10.836  -7.249
  923   HE22  GLN 125          HE22      GLN 125   6.357  -9.228  -7.076
  924    H    GLY 126           HN       GLY 126   7.025 -14.596  -5.402
  925    HA2  GLY 126           HA2      GLY 126   7.342 -15.832  -3.508
  926    HA3  GLY 126           HA1      GLY 126   8.716 -16.617  -4.268
  927    H    SER 127           HN       SER 127   8.283 -15.424  -1.618
  928    HA   SER 127           HA       SER 127  10.026 -13.159  -1.615
  929    HB2  SER 127           HB2      SER 127   8.191 -12.802  -0.199
  930    HB3  SER 127           HB1      SER 127   8.262 -14.430   0.446
  931    HG   SER 127           HG       SER 127   9.121 -12.451   1.703
  932    H    ARG 128           HN       ARG 128  11.801 -12.967  -0.082
  933    HA   ARG 128           HA       ARG 128  13.733 -14.864  -0.730
  934    HB2  ARG 128           HB2      ARG 128  15.183 -13.630   0.895
  935    HB3  ARG 128           HB1      ARG 128  14.433 -12.636  -0.343
  936    HG2  ARG 128           HG2      ARG 128  12.741 -11.916   1.271
  937    HG3  ARG 128           HG1      ARG 128  13.520 -12.900   2.513
  938    HD2  ARG 128           HD2      ARG 128  14.175 -10.543   2.668
  939    HD3  ARG 128           HD1      ARG 128  15.550 -11.584   2.311
  940    HE   ARG 128           HE       ARG 128  14.385 -10.527  -0.071
  941   HH11  ARG 128          HH11      ARG 128  16.517  -9.719   2.596
  942   HH12  ARG 128          HH12      ARG 128  17.400  -8.519   1.694
  943   HH21  ARG 128          HH21      ARG 128  15.518  -8.936  -1.252
  944   HH22  ARG 128          HH22      ARG 128  16.835  -8.089  -0.498
  945    H    SER 129           HN       SER 129  11.837 -14.502   2.239
  946    HA   SER 129           HA       SER 129  13.187 -16.829   3.332
  947    HB2  SER 129           HB2      SER 129  10.902 -15.218   4.484
  948    HB3  SER 129           HB1      SER 129  11.769 -16.520   5.311
  949    HG   SER 129           HG       SER 129  13.690 -15.225   5.053
  950    HA   PRO 130           HA       PRO 130   9.217 -18.921   2.076
  951    HB2  PRO 130           HB2      PRO 130   6.817 -17.578   2.332
  952    HB3  PRO 130           HB1      PRO 130   7.601 -18.454   3.640
  953    HG2  PRO 130           HG2      PRO 130   7.154 -15.656   3.482
  954    HG3  PRO 130           HG1      PRO 130   8.112 -16.514   4.702
  955    HD2  PRO 130           HD2      PRO 130   9.012 -15.139   2.204
  956    HD3  PRO 130           HD1      PRO 130   9.819 -15.252   3.780
  957    H    TYR 131           HN       TYR 131   9.144 -19.209  -0.164
  958    HA   TYR 131           HA       TYR 131   8.457 -17.305  -2.051
  959    HB2  TYR 131           HB2      TYR 131   9.250 -19.497  -2.741
  960    HB3  TYR 131           HB1      TYR 131   7.825 -20.273  -2.057
  961    HD1  TYR 131           HD1      TYR 131   5.589 -19.923  -3.171
  962    HD2  TYR 131           HD2      TYR 131   9.212 -18.533  -4.917
  963    HE1  TYR 131           HE1      TYR 131   4.446 -19.676  -5.329
  964    HE2  TYR 131           HE2      TYR 131   8.070 -18.284  -7.079
  965    HH   TYR 131           HH       TYR 131   4.708 -18.344  -7.382
  966    H    ILE 132           HN       ILE 132   6.854 -15.940  -1.516
  967    HA   ILE 132           HA       ILE 132   4.489 -16.666  -0.186
  968    HB   ILE 132           HB       ILE 132   4.921 -14.246  -1.940
  969   HG12  ILE 132          HG12      ILE 132   6.692 -14.207  -0.351
  970   HG13  ILE 132          HG11      ILE 132   5.471 -13.056   0.186
  971   HG21  ILE 132          HG21      ILE 132   3.222 -13.226  -0.483
  972   HG22  ILE 132          HG22      ILE 132   3.049 -14.769   0.360
  973   HG23  ILE 132          HG23      ILE 132   2.602 -14.636  -1.345
  974   HD11  ILE 132          HD11      ILE 132   5.795 -15.836   1.273
  975   HD12  ILE 132          HD12      ILE 132   4.704 -14.578   1.864
  976   HD13  ILE 132          HD13      ILE 132   6.455 -14.370   1.996
  977    HA   PRO 133           HA       PRO 133   2.284 -18.655  -3.526
  978    HB2  PRO 133           HB2      PRO 133  -0.068 -17.620  -2.016
  979    HB3  PRO 133           HB1      PRO 133   0.270 -19.259  -2.583
  980    HG2  PRO 133           HG2      PRO 133   0.539 -18.628  -0.009
  981    HG3  PRO 133           HG1      PRO 133   1.690 -19.721  -0.802
  982    HD2  PRO 133           HD2      PRO 133   2.011 -16.850  -0.043
  983    HD3  PRO 133           HD1      PRO 133   3.203 -18.166  -0.019
  984    HA   PRO 134           HA       PRO 134   1.432 -15.287  -6.277
  985    HB2  PRO 134           HB2      PRO 134  -0.456 -17.150  -7.600
  986    HB3  PRO 134           HB1      PRO 134   0.931 -16.279  -8.268
  987    HG2  PRO 134           HG2      PRO 134   1.039 -18.915  -7.801
  988    HG3  PRO 134           HG1      PRO 134   2.447 -17.870  -7.540
  989    HD2  PRO 134           HD2      PRO 134   0.561 -19.044  -5.536
  990    HD3  PRO 134           HD1      PRO 134   2.319 -18.810  -5.431
  991    H    HIS 135           HN       HIS 135   0.101 -13.656  -6.153
  992    HA   HIS 135           HA       HIS 135  -1.774 -12.386  -5.971
  993    HB2  HIS 135           HB2      HIS 135  -2.806 -14.866  -6.847
  994    HB3  HIS 135           HB1      HIS 135  -3.847 -14.316  -5.541
  995    HD1  HIS 135           HD1      HIS 135  -4.543 -11.593  -5.922
  996    HD2  HIS 135           HD2      HIS 135  -3.628 -13.939  -9.237
  997    HE1  HIS 135           HE1      HIS 135  -5.651 -10.466  -7.875
  998    HE2  HIS 135           HE2      HIS 135  -5.216 -11.981  -9.840
  999    H    ALA 136           HN       ALA 136  -0.605 -14.332  -3.592
 1000    HA   ALA 136           HA       ALA 136  -2.625 -14.137  -1.607
 1001    HB1  ALA 136           HB1      ALA 136  -0.870 -14.694  -0.010
 1002    HB2  ALA 136           HB2      ALA 136   0.357 -14.393  -1.239
 1003    HB3  ALA 136           HB3      ALA 136  -0.771 -15.735  -1.431
 1004    H    ALA 137           HN       ALA 137  -3.250 -12.424  -0.435
 1005    HA   ALA 137           HA       ALA 137  -2.144  -9.888  -1.176
 1006    HB1  ALA 137           HB1      ALA 137  -4.275 -10.537   0.860
 1007    HB2  ALA 137           HB2      ALA 137  -4.543 -10.135  -0.833
 1008    HB3  ALA 137           HB3      ALA 137  -3.877  -8.927   0.265
 1009    H    LEU 138           HN       LEU 138  -0.398  -9.080  -0.312
 1010    HA   LEU 138           HA       LEU 138   0.571 -10.024   2.255
 1011    HB2  LEU 138           HB2      LEU 138   1.743  -9.218  -0.187
 1012    HB3  LEU 138           HB1      LEU 138   2.297  -8.108   1.055
 1013    HG   LEU 138           HG       LEU 138   3.185  -9.912   2.364
 1014   HD11  LEU 138          HD11      LEU 138   3.058 -12.238   1.565
 1015   HD12  LEU 138          HD12      LEU 138   1.967 -11.705   0.285
 1016   HD13  LEU 138          HD13      LEU 138   1.480 -11.559   1.973
 1017   HD21  LEU 138          HD21      LEU 138   4.595  -9.050   0.565
 1018   HD22  LEU 138          HD22      LEU 138   3.932 -10.264  -0.530
 1019   HD23  LEU 138          HD23      LEU 138   4.897 -10.763   0.860
 1020    H    CYS 139           HN       CYS 139   0.584  -8.837   4.060
 1021    HA   CYS 139           HA       CYS 139  -0.093  -5.969   3.851
 1022    HB2  CYS 139           HB2      CYS 139  -1.720  -7.632   5.022
 1023    HB3  CYS 139           HB1      CYS 139  -0.520  -7.635   6.308
 1024    HG   CYS 139           HG       CYS 139  -1.969  -4.751   5.186
 1025    H    LEU 140           HN       LEU 140   1.826  -4.981   3.962
 1026    HA   LEU 140           HA       LEU 140   3.778  -5.959   5.945
 1027    HB2  LEU 140           HB2      LEU 140   5.479  -4.956   4.385
 1028    HB3  LEU 140           HB1      LEU 140   4.660  -6.400   3.811
 1029    HG   LEU 140           HG       LEU 140   3.189  -4.124   2.939
 1030   HD11  LEU 140          HD11      LEU 140   6.116  -4.040   2.213
 1031   HD12  LEU 140          HD12      LEU 140   5.314  -2.911   3.302
 1032   HD13  LEU 140          HD13      LEU 140   4.847  -2.975   1.600
 1033   HD21  LEU 140          HD21      LEU 140   3.717  -5.044   0.720
 1034   HD22  LEU 140          HD22      LEU 140   3.190  -6.296   1.848
 1035   HD23  LEU 140          HD23      LEU 140   4.903  -6.122   1.459
 1036    H    GLU 141           HN       GLU 141   4.611  -4.572   7.359
 1037    HA   GLU 141           HA       GLU 141   3.763  -1.776   7.185
 1038    HB2  GLU 141           HB2      GLU 141   3.220  -2.920   9.263
 1039    HB3  GLU 141           HB1      GLU 141   4.900  -3.388   9.475
 1040    HG2  GLU 141           HG2      GLU 141   5.464  -0.946   9.599
 1041    HG3  GLU 141           HG1      GLU 141   3.726  -0.631   9.635
 1042    H    VAL 142           HN       VAL 142   5.173  -0.378   6.373
 1043    HA   VAL 142           HA       VAL 142   8.019  -1.063   6.493
 1044    HB   VAL 142           HB       VAL 142   8.231   0.575   4.548
 1045   HG11  VAL 142          HG11      VAL 142   6.677  -1.979   4.181
 1046   HG12  VAL 142          HG12      VAL 142   8.432  -1.831   4.292
 1047   HG13  VAL 142          HG13      VAL 142   7.572  -1.134   2.918
 1048   HG21  VAL 142          HG21      VAL 142   5.255   0.103   4.417
 1049   HG22  VAL 142          HG22      VAL 142   6.227   0.918   3.190
 1050   HG23  VAL 142          HG23      VAL 142   6.036   1.639   4.791
 1051    H    THR 143           HN       THR 143   9.245   0.099   7.739
 1052    HA   THR 143           HA       THR 143   8.484   2.828   8.509
 1053    HB   THR 143           HB       THR 143  10.898   1.313   9.513
 1054    HG1  THR 143           HG1      THR 143   8.257   0.722   9.914
 1055   HG21  THR 143          HG21      THR 143   9.156   3.486  10.700
 1056   HG22  THR 143          HG22      THR 143  10.787   3.684  10.056
 1057   HG23  THR 143          HG23      THR 143  10.528   2.724  11.510
 1058    H    LEU 144           HN       LEU 144   9.134   4.269   6.997
 1059    HA   LEU 144           HA       LEU 144  11.671   3.933   5.624
 1060    HB2  LEU 144           HB2      LEU 144   9.733   4.937   4.464
 1061    HB3  LEU 144           HB1      LEU 144   9.714   6.246   5.631
 1062    HG   LEU 144           HG       LEU 144  11.893   7.012   4.834
 1063   HD11  LEU 144          HD11      LEU 144  12.872   6.015   2.796
 1064   HD12  LEU 144          HD12      LEU 144  11.680   4.718   2.887
 1065   HD13  LEU 144          HD13      LEU 144  12.876   4.906   4.168
 1066   HD21  LEU 144          HD21      LEU 144   9.820   7.846   3.805
 1067   HD22  LEU 144          HD22      LEU 144   9.935   6.580   2.582
 1068   HD23  LEU 144          HD23      LEU 144  11.170   7.834   2.671
 1069    H    LYS 145           HN       LYS 145  13.322   4.105   6.964
 1070    HA   LYS 145           HA       LYS 145  13.157   6.003   9.176
 1071    HB2  LYS 145           HB2      LYS 145  15.328   3.966   8.728
 1072    HB3  LYS 145           HB1      LYS 145  14.824   4.714  10.240
 1073    HG2  LYS 145           HG2      LYS 145  12.775   3.479  10.248
 1074    HG3  LYS 145           HG1      LYS 145  13.105   2.845   8.633
 1075    HD2  LYS 145           HD2      LYS 145  14.745   2.297  11.106
 1076    HD3  LYS 145           HD1      LYS 145  13.577   1.188  10.374
 1077    HE2  LYS 145           HE2      LYS 145  14.875   0.941   8.431
 1078    HE3  LYS 145           HE1      LYS 145  15.927   2.297   8.845
 1079    HZ1  LYS 145           HZ1      LYS 145  17.211   0.503   9.439
 1080    HZ2  LYS 145           HZ2      LYS 145  15.888  -0.434   9.944
 1081    HZ3  LYS 145           HZ3      LYS 145  16.444   0.837  10.918
 1082    H    THR 146           HN       THR 146  14.804   5.459   6.202
 1083    HA   THR 146           HA       THR 146  16.184   7.988   6.454
 1084    HB   THR 146           HB       THR 146  17.764   5.495   5.830
 1085    HG1  THR 146           HG1      THR 146  17.134   6.676   8.275
 1086   HG21  THR 146          HG21      THR 146  18.683   7.543   4.882
 1087   HG22  THR 146          HG22      THR 146  19.713   6.951   6.185
 1088   HG23  THR 146          HG23      THR 146  18.636   8.317   6.468
 1089    H    ALA 147           HN       ALA 147  16.673   8.893   4.477
 1090    HA   ALA 147           HA       ALA 147  16.498   7.216   2.096
 1091    HB1  ALA 147           HB1      ALA 147  15.187   8.956   0.930
 1092    HB2  ALA 147           HB2      ALA 147  15.053   9.850   2.446
 1093    HB3  ALA 147           HB3      ALA 147  14.303   8.261   2.289
 1094    H    VAL 148           HN       VAL 148  18.229   7.607   0.761
 1095    HA   VAL 148           HA       VAL 148  19.545  10.227   1.041
 1096    HB   VAL 148           HB       VAL 148  21.766   9.257   1.174
 1097   HG11  VAL 148          HG11      VAL 148  21.661   8.295   3.435
 1098   HG12  VAL 148          HG12      VAL 148  19.909   8.147   3.271
 1099   HG13  VAL 148          HG13      VAL 148  20.666   9.742   3.267
 1100   HG21  VAL 148          HG21      VAL 148  21.383   7.173  -0.032
 1101   HG22  VAL 148          HG22      VAL 148  20.398   6.573   1.303
 1102   HG23  VAL 148          HG23      VAL 148  22.121   6.867   1.541
 1103    H    ASP 149           HN       ASP 149  20.464  11.018  -0.790
 1104    HA   ASP 149           HA       ASP 149  19.647   9.747  -3.237
 1105    HB2  ASP 149           HB2      ASP 149  19.415  12.101  -3.253
 1106    HB3  ASP 149           HB1      ASP 149  21.041  12.354  -2.619
 1107    H    LEU 150           HN       LEU 150  20.832   8.376  -4.372
 1108    HA   LEU 150           HA       LEU 150  23.722   8.536  -4.353
 1109    HB2  LEU 150           HB2      LEU 150  22.875   7.150  -2.341
 1110    HB3  LEU 150           HB1      LEU 150  22.450   5.937  -3.534
 1111    HG   LEU 150           HG       LEU 150  24.827   5.845  -4.246
 1112   HD11  LEU 150          HD11      LEU 150  26.526   6.907  -2.861
 1113   HD12  LEU 150          HD12      LEU 150  25.265   7.678  -1.895
 1114   HD13  LEU 150          HD13      LEU 150  25.458   8.105  -3.596
 1115   HD21  LEU 150          HD21      LEU 150  24.371   5.370  -1.300
 1116   HD22  LEU 150          HD22      LEU 150  25.640   4.640  -2.286
 1117   HD23  LEU 150          HD23      LEU 150  23.948   4.261  -2.604
 1118    H    GLU 151           HN       GLU 151  21.328   8.612  -6.218
 1119    HA   GLU 151           HA       GLU 151  21.701   6.307  -7.913
 1120    HB2  GLU 151           HB2      GLU 151  19.631   8.049  -7.631
 1121    HB3  GLU 151           HB1      GLU 151  20.425   8.732  -9.044
 1122    HG2  GLU 151           HG2      GLU 151  19.600   5.846  -8.820
 1123    HG3  GLU 151           HG1      GLU 151  18.576   7.098  -9.530
 1124    H    HIS 152           HN       HIS 152  22.596   6.413 -10.049
 1125    HA   HIS 152           HA       HIS 152  25.123   7.660 -10.056
 1126    HB2  HIS 152           HB2      HIS 152  24.103   5.586 -11.401
 1127    HB3  HIS 152           HB1      HIS 152  23.883   6.821 -12.636
 1128    HD1  HIS 152           HD1      HIS 152  26.546   5.002 -10.716
 1129    HD2  HIS 152           HD2      HIS 152  26.209   7.649 -13.911
 1130    HE1  HIS 152           HE1      HIS 152  28.824   5.064 -11.790
 1131    HE2  HIS 152           HE2      HIS 152  28.525   6.493 -13.847
 1132    H    HIS 153           HN       HIS 153  22.248   8.256 -12.054
 1133    HA   HIS 153           HA       HIS 153  21.826  10.873 -11.843
 1134    HB2  HIS 153           HB2      HIS 153  24.420  10.762 -12.851
 1135    HB3  HIS 153           HB1      HIS 153  23.431  11.080 -14.274
 1136    HD1  HIS 153           HD1      HIS 153  21.972  13.310 -14.205
 1137    HD2  HIS 153           HD2      HIS 153  24.781  12.890 -11.161
 1138    HE1  HIS 153           HE1      HIS 153  22.211  15.592 -13.184
 1139    HE2  HIS 153           HE2      HIS 153  23.828  15.296 -11.270
 1140    H    HIS 154           HN       HIS 154  22.297   8.250 -14.065
 1141    HA   HIS 154           HA       HIS 154  19.920   9.021 -15.565
 1142    HB2  HIS 154           HB2      HIS 154  22.126  10.015 -16.536
 1143    HB3  HIS 154           HB1      HIS 154  22.443   8.369 -17.064
 1144    HD1  HIS 154           HD1      HIS 154  20.947  11.422 -18.170
 1145    HD2  HIS 154           HD2      HIS 154  20.191   7.375 -18.784
 1146    HE1  HIS 154           HE1      HIS 154  19.539  11.301 -20.255
 1147    HE2  HIS 154           HE2      HIS 154  19.356   8.837 -20.751
 1148    H    HIS 155           HN       HIS 155  19.896   6.956 -13.887
 1149    HA   HIS 155           HA       HIS 155  20.690   4.472 -15.049
 1150    HB2  HIS 155           HB2      HIS 155  20.310   4.746 -12.636
 1151    HB3  HIS 155           HB1      HIS 155  18.612   5.076 -12.938
 1152    HD1  HIS 155           HD1      HIS 155  21.041   2.189 -13.614
 1153    HD2  HIS 155           HD2      HIS 155  17.079   2.915 -12.570
 1154    HE1  HIS 155           HE1      HIS 155  20.025  -0.064 -13.191
 1155    HE2  HIS 155           HE2      HIS 155  17.731   0.428 -12.275
 1156    H    HIS 156           HN       HIS 156  19.942   4.503 -17.174
 1157    HA   HIS 156           HA       HIS 156  17.394   3.479 -17.732
 1158    HB2  HIS 156           HB2      HIS 156  16.655   5.765 -17.102
 1159    HB3  HIS 156           HB1      HIS 156  17.688   6.434 -18.356
 1160    HD1  HIS 156           HD1      HIS 156  14.359   4.968 -17.764
 1161    HD2  HIS 156           HD2      HIS 156  16.758   5.917 -21.033
 1162    HE1  HIS 156           HE1      HIS 156  12.837   4.930 -19.766
 1163    HE2  HIS 156           HE2      HIS 156  14.322   5.416 -21.742
 1164    H    HIS 157           HN       HIS 157  20.309   5.055 -18.716
 1165    HA   HIS 157           HA       HIS 157  21.596   5.021 -20.579
 1166    HB2  HIS 157           HB2      HIS 157  19.779   2.731 -21.330
 1167    HB3  HIS 157           HB1      HIS 157  21.069   3.295 -22.382
 1168    HD1  HIS 157           HD1      HIS 157  20.452   0.734 -20.062
 1169    HD2  HIS 157           HD2      HIS 157  23.660   3.296 -20.736
 1170    HE1  HIS 157           HE1      HIS 157  22.453  -0.393 -19.025
 1171    HE2  HIS 157           HE2      HIS 157  24.405   1.074 -19.641
  Start of MODEL   10
    1    H1   MET   1           HT1      MET   1  17.742 -59.523  14.072
    2    H2   MET   1           HT2      MET   1  17.205 -58.151  14.910
    3    H3   MET   1           HT3      MET   1  18.602 -58.966  15.417
    4    HA   MET   1           HA       MET   1  19.798 -58.341  13.485
    5    HB2  MET   1           HB2      MET   1  18.816 -56.989  11.728
    6    HB3  MET   1           HB1      MET   1  17.899 -58.475  11.915
    7    HG2  MET   1           HG2      MET   1  16.213 -57.250  13.219
    8    HG3  MET   1           HG1      MET   1  17.123 -55.763  12.952
    9    HE1  MET   1           HE1      MET   1  16.870 -55.385   9.045
   10    HE2  MET   1           HE2      MET   1  18.151 -56.150   9.985
   11    HE3  MET   1           HE3      MET   1  17.443 -54.630  10.532
   12    H    GLY   2           HN       GLY   2  18.409 -57.137  16.093
   13    HA2  GLY   2           HA2      GLY   2  20.179 -54.901  16.230
   14    HA3  GLY   2           HA1      GLY   2  18.498 -54.401  16.082
   15    H    GLN   3           HN       GLN   3  20.128 -53.856  18.326
   16    HA   GLN   3           HA       GLN   3  18.967 -55.664  20.335
   17    HB2  GLN   3           HB2      GLN   3  20.868 -55.012  21.797
   18    HB3  GLN   3           HB1      GLN   3  21.377 -55.835  20.330
   19    HG2  GLN   3           HG2      GLN   3  21.891 -53.638  19.326
   20    HG3  GLN   3           HG1      GLN   3  21.494 -52.879  20.865
   21   HE21  GLN   3          HE21      GLN   3  23.999 -52.908  19.373
   22   HE22  GLN   3          HE22      GLN   3  25.187 -53.558  20.453
   23    HA   PRO   4           HA       PRO   4  16.506 -52.388  21.822
   24    HB2  PRO   4           HB2      PRO   4  16.967 -53.400  24.558
   25    HB3  PRO   4           HB1      PRO   4  15.461 -53.264  23.648
   26    HG2  PRO   4           HG2      PRO   4  16.598 -55.642  24.108
   27    HG3  PRO   4           HG1      PRO   4  15.767 -55.295  22.577
   28    HD2  PRO   4           HD2      PRO   4  18.704 -55.334  23.180
   29    HD3  PRO   4           HD1      PRO   4  17.839 -55.944  21.751
   30    HA   PRO   5           HA       PRO   5  19.615 -49.480  23.320
   31    HB2  PRO   5           HB2      PRO   5  18.335 -47.256  22.527
   32    HB3  PRO   5           HB1      PRO   5  19.178 -48.301  21.376
   33    HG2  PRO   5           HG2      PRO   5  16.257 -48.129  21.992
   34    HG3  PRO   5           HG1      PRO   5  17.057 -48.286  20.419
   35    HD2  PRO   5           HD2      PRO   5  15.924 -50.375  21.789
   36    HD3  PRO   5           HD1      PRO   5  17.247 -50.560  20.619
   37    H    ALA   6           HN       ALA   6  19.547 -47.679  24.872
   38    HA   ALA   6           HA       ALA   6  17.478 -48.178  26.871
   39    HB1  ALA   6           HB1      ALA   6  19.988 -46.518  27.122
   40    HB2  ALA   6           HB2      ALA   6  19.874 -48.232  27.519
   41    HB3  ALA   6           HB3      ALA   6  18.936 -47.051  28.435
   42    H    GLU   7           HN       GLU   7  15.732 -47.003  26.742
   43    HA   GLU   7           HA       GLU   7  14.358 -45.221  26.939
   44    HB2  GLU   7           HB2      GLU   7  16.843 -43.506  26.917
   45    HB3  GLU   7           HB1      GLU   7  15.228 -43.000  27.403
   46    HG2  GLU   7           HG2      GLU   7  16.917 -45.085  28.775
   47    HG3  GLU   7           HG1      GLU   7  16.659 -43.427  29.323
   48    H    GLU   8           HN       GLU   8  13.077 -44.405  25.442
   49    HA   GLU   8           HA       GLU   8  14.055 -43.905  22.766
   50    HB2  GLU   8           HB2      GLU   8  11.891 -44.995  23.011
   51    HB3  GLU   8           HB1      GLU   8  11.294 -43.663  23.988
   52    HG2  GLU   8           HG2      GLU   8  10.420 -43.570  21.724
   53    HG3  GLU   8           HG1      GLU   8  11.431 -42.171  22.080
   54    H    ALA   9           HN       ALA   9  14.604 -41.957  21.992
   55    HA   ALA   9           HA       ALA   9  13.720 -39.562  23.414
   56    HB1  ALA   9           HB1      ALA   9  15.852 -40.190  24.452
   57    HB2  ALA   9           HB2      ALA   9  15.994 -38.675  23.559
   58    HB3  ALA   9           HB3      ALA   9  16.631 -40.169  22.871
   59    H    GLU  10           HN       GLU  10  13.733 -41.069  20.605
   60    HA   GLU  10           HA       GLU  10  14.685 -39.093  18.792
   61    HB2  GLU  10           HB2      GLU  10  14.304 -41.401  18.077
   62    HB3  GLU  10           HB1      GLU  10  12.589 -41.253  18.429
   63    HG2  GLU  10           HG2      GLU  10  13.006 -41.115  16.051
   64    HG3  GLU  10           HG1      GLU  10  12.363 -39.593  16.661
   65    H    GLN  11           HN       GLN  11  11.486 -39.840  20.114
   66    HA   GLN  11           HA       GLN  11  10.691 -37.066  19.545
   67    HB2  GLN  11           HB2      GLN  11   8.904 -39.503  19.474
   68    HB3  GLN  11           HB1      GLN  11   8.367 -37.843  19.275
   69    HG2  GLN  11           HG2      GLN  11   9.777 -37.691  17.243
   70    HG3  GLN  11           HG1      GLN  11  10.148 -39.407  17.425
   71   HE21  GLN  11          HE21      GLN  11   7.469 -40.008  18.446
   72   HE22  GLN  11          HE22      GLN  11   6.406 -39.950  17.078
   73    HA   PRO  12           HA       PRO  12  10.411 -37.519  24.073
   74    HB2  PRO  12           HB2      PRO  12  10.552 -34.586  23.961
   75    HB3  PRO  12           HB1      PRO  12  11.604 -35.724  24.806
   76    HG2  PRO  12           HG2      PRO  12  12.433 -34.362  22.640
   77    HG3  PRO  12           HG1      PRO  12  12.983 -36.014  22.984
   78    HD2  PRO  12           HD2      PRO  12  10.884 -35.075  21.057
   79    HD3  PRO  12           HD1      PRO  12  12.139 -36.315  20.840
   80    H    GLY  13           HN       GLY  13   8.277 -38.124  24.192
   81    HA2  GLY  13           HA2      GLY  13   6.355 -35.922  24.411
   82    HA3  GLY  13           HA1      GLY  13   5.978 -37.233  23.302
   83    H    ALA  14           HN       ALA  14   4.068 -37.344  24.755
   84    HA   ALA  14           HA       ALA  14   4.248 -39.580  26.472
   85    HB1  ALA  14           HB1      ALA  14   3.777 -36.919  27.838
   86    HB2  ALA  14           HB2      ALA  14   5.194 -37.952  28.052
   87    HB3  ALA  14           HB3      ALA  14   3.607 -38.506  28.588
   88    H    LEU  15           HN       LEU  15   2.036 -39.799  27.688
   89    HA   LEU  15           HA       LEU  15  -0.073 -39.351  25.795
   90    HB2  LEU  15           HB2      LEU  15  -0.036 -41.349  27.207
   91    HB3  LEU  15           HB1      LEU  15  -0.159 -40.356  28.648
   92    HG   LEU  15           HG       LEU  15  -2.400 -39.600  27.911
   93   HD11  LEU  15          HD11      LEU  15  -2.033 -41.635  25.712
   94   HD12  LEU  15          HD12      LEU  15  -2.109 -39.885  25.498
   95   HD13  LEU  15          HD13      LEU  15  -3.522 -40.765  26.080
   96   HD21  LEU  15          HD21      LEU  15  -2.037 -42.589  28.093
   97   HD22  LEU  15          HD22      LEU  15  -3.558 -41.729  28.328
   98   HD23  LEU  15          HD23      LEU  15  -2.217 -41.472  29.445
   99    H    ALA  16           HN       ALA  16   0.067 -38.458  29.232
  100    HA   ALA  16           HA       ALA  16  -0.583 -36.617  30.396
  101    HB1  ALA  16           HB1      ALA  16   1.381 -35.748  29.212
  102    HB2  ALA  16           HB2      ALA  16   0.176 -34.490  29.498
  103    HB3  ALA  16           HB3      ALA  16   0.340 -35.208  27.896
  104    H    ARG  17           HN       ARG  17  -2.676 -37.828  28.614
  105    HA   ARG  17           HA       ARG  17  -4.317 -35.447  28.124
  106    HB2  ARG  17           HB2      ARG  17  -3.992 -36.912  26.184
  107    HB3  ARG  17           HB1      ARG  17  -4.634 -38.273  27.087
  108    HG2  ARG  17           HG2      ARG  17  -6.217 -37.247  25.453
  109    HG3  ARG  17           HG1      ARG  17  -6.822 -37.341  27.107
  110    HD2  ARG  17           HD2      ARG  17  -7.360 -35.189  26.089
  111    HD3  ARG  17           HD1      ARG  17  -6.265 -34.998  27.458
  112    HE   ARG  17           HE       ARG  17  -4.482 -34.952  25.572
  113   HH11  ARG  17          HH11      ARG  17  -7.697 -33.591  25.391
  114   HH12  ARG  17          HH12      ARG  17  -7.246 -32.334  24.280
  115   HH21  ARG  17          HH21      ARG  17  -3.869 -33.253  24.138
  116   HH22  ARG  17          HH22      ARG  17  -5.083 -32.133  23.596
  117    H    GLU  18           HN       GLU  18  -3.854 -37.875  30.369
  118    HA   GLU  18           HA       GLU  18  -6.597 -38.255  31.121
  119    HB2  GLU  18           HB2      GLU  18  -4.755 -39.930  31.526
  120    HB3  GLU  18           HB1      GLU  18  -4.136 -38.854  32.773
  121    HG2  GLU  18           HG2      GLU  18  -6.256 -39.049  33.980
  122    HG3  GLU  18           HG1      GLU  18  -6.855 -40.144  32.735
  123    H    PHE  19           HN       PHE  19  -7.664 -36.550  31.801
  124    HA   PHE  19           HA       PHE  19  -8.387 -34.898  33.155
  125    HB2  PHE  19           HB2      PHE  19  -7.804 -35.806  35.176
  126    HB3  PHE  19           HB1      PHE  19  -6.096 -35.916  34.766
  127    HD1  PHE  19           HD1      PHE  19  -8.782 -33.590  35.785
  128    HD2  PHE  19           HD2      PHE  19  -4.588 -34.224  35.422
  129    HE1  PHE  19           HE1      PHE  19  -8.364 -31.571  37.122
  130    HE2  PHE  19           HE2      PHE  19  -4.162 -32.199  36.756
  131    HZ   PHE  19           HZ       PHE  19  -6.007 -30.830  37.525
  132    H    LEU  20           HN       LEU  20  -5.016 -34.735  32.196
  133    HA   LEU  20           HA       LEU  20  -4.739 -31.937  32.544
  134    HB2  LEU  20           HB2      LEU  20  -3.186 -33.924  30.900
  135    HB3  LEU  20           HB1      LEU  20  -2.738 -32.236  31.047
  136    HG   LEU  20           HG       LEU  20  -2.990 -34.090  33.418
  137   HD11  LEU  20          HD11      LEU  20  -1.231 -34.917  31.933
  138   HD12  LEU  20          HD12      LEU  20  -0.537 -34.201  33.386
  139   HD13  LEU  20          HD13      LEU  20  -0.517 -33.307  31.868
  140   HD21  LEU  20          HD21      LEU  20  -3.215 -31.702  33.890
  141   HD22  LEU  20          HD22      LEU  20  -1.686 -31.390  33.071
  142   HD23  LEU  20          HD23      LEU  20  -1.714 -32.348  34.552
  143    H    ALA  21           HN       ALA  21  -6.412 -30.882  31.596
  144    HA   ALA  21           HA       ALA  21  -6.712 -31.076  28.689
  145    HB1  ALA  21           HB1      ALA  21  -8.765 -29.781  28.989
  146    HB2  ALA  21           HB2      ALA  21  -8.419 -29.608  30.710
  147    HB3  ALA  21           HB3      ALA  21  -8.769 -31.201  30.037
  148    H    ALA  22           HN       ALA  22  -7.088 -28.926  27.567
  149    HA   ALA  22           HA       ALA  22  -5.146 -26.954  28.582
  150    HB1  ALA  22           HB1      ALA  22  -4.256 -28.231  26.684
  151    HB2  ALA  22           HB2      ALA  22  -4.478 -26.529  26.276
  152    HB3  ALA  22           HB3      ALA  22  -5.636 -27.731  25.709
  153    H    MET  23           HN       MET  23  -5.407 -24.824  27.223
  154    HA   MET  23           HA       MET  23  -8.256 -24.207  26.811
  155    HB2  MET  23           HB2      MET  23  -7.704 -23.357  29.045
  156    HB3  MET  23           HB1      MET  23  -6.301 -22.518  28.396
  157    HG2  MET  23           HG2      MET  23  -7.845 -21.169  26.982
  158    HG3  MET  23           HG1      MET  23  -9.195 -21.925  27.826
  159    HE1  MET  23           HE1      MET  23  -8.102 -22.163  30.792
  160    HE2  MET  23           HE2      MET  23  -9.715 -21.549  30.438
  161    HE3  MET  23           HE3      MET  23  -8.641 -20.646  31.508
  162    H    GLU  24           HN       GLU  24  -5.282 -22.327  26.840
  163    HA   GLU  24           HA       GLU  24  -4.200 -21.100  25.266
  164    HB2  GLU  24           HB2      GLU  24  -4.636 -23.776  23.985
  165    HB3  GLU  24           HB1      GLU  24  -3.734 -22.517  23.156
  166    HG2  GLU  24           HG2      GLU  24  -2.372 -24.199  24.442
  167    HG3  GLU  24           HG1      GLU  24  -2.043 -22.505  24.787
  168    HA   PRO  25           HA       PRO  25  -7.935 -19.328  23.284
  169    HB2  PRO  25           HB2      PRO  25  -6.713 -16.846  23.045
  170    HB3  PRO  25           HB1      PRO  25  -7.706 -17.364  24.410
  171    HG2  PRO  25           HG2      PRO  25  -4.732 -17.334  24.134
  172    HG3  PRO  25           HG1      PRO  25  -5.734 -16.930  25.541
  173    HD2  PRO  25           HD2      PRO  25  -4.462 -19.276  25.382
  174    HD3  PRO  25           HD1      PRO  25  -6.087 -19.160  26.083
  175    H    GLU  26           HN       GLU  26  -8.083 -20.013  21.246
  176    HA   GLU  26           HA       GLU  26  -5.957 -19.973  19.371
  177    HB2  GLU  26           HB2      GLU  26  -8.933 -20.262  18.928
  178    HB3  GLU  26           HB1      GLU  26  -7.693 -20.599  17.726
  179    HG2  GLU  26           HG2      GLU  26  -6.801 -22.378  19.142
  180    HG3  GLU  26           HG1      GLU  26  -8.028 -22.027  20.356
  181    HA   PRO  27           HA       PRO  27  -6.265 -15.689  18.179
  182    HB2  PRO  27           HB2      PRO  27  -4.506 -16.418  15.958
  183    HB3  PRO  27           HB1      PRO  27  -4.177 -15.375  17.344
  184    HG2  PRO  27           HG2      PRO  27  -3.019 -17.798  17.048
  185    HG3  PRO  27           HG1      PRO  27  -3.399 -17.107  18.636
  186    HD2  PRO  27           HD2      PRO  27  -4.890 -19.175  17.061
  187    HD3  PRO  27           HD1      PRO  27  -4.544 -19.120  18.803
  188    H    ALA  28           HN       ALA  28  -7.074 -14.440  16.458
  189    HA   ALA  28           HA       ALA  28  -8.468 -15.990  14.372
  190    HB1  ALA  28           HB1      ALA  28 -10.078 -15.134  15.986
  191    HB2  ALA  28           HB2      ALA  28 -10.266 -14.327  14.424
  192    HB3  ALA  28           HB3      ALA  28  -9.457 -13.496  15.755
  193    HA   PRO  29           HA       PRO  29  -6.285 -13.426  11.417
  194    HB2  PRO  29           HB2      PRO  29  -8.156 -13.825   9.412
  195    HB3  PRO  29           HB1      PRO  29  -6.763 -14.864   9.719
  196    HG2  PRO  29           HG2      PRO  29  -9.614 -15.217  10.512
  197    HG3  PRO  29           HG1      PRO  29  -8.426 -16.435  10.013
  198    HD2  PRO  29           HD2      PRO  29  -9.123 -16.098  12.590
  199    HD3  PRO  29           HD1      PRO  29  -7.473 -16.548  12.114
  200    H    ALA  30           HN       ALA  30  -6.534 -11.356  10.626
  201    HA   ALA  30           HA       ALA  30  -9.081 -10.069  11.338
  202    HB1  ALA  30           HB1      ALA  30  -6.346  -8.814  11.469
  203    HB2  ALA  30           HB2      ALA  30  -7.242  -9.446  12.850
  204    HB3  ALA  30           HB3      ALA  30  -7.871  -8.070  11.943
  205    HA   PRO  31           HA       PRO  31  -8.663  -9.286   6.776
  206    HB2  PRO  31           HB2      PRO  31 -11.403  -9.415   6.485
  207    HB3  PRO  31           HB1      PRO  31 -10.310 -10.775   6.219
  208    HG2  PRO  31           HG2      PRO  31 -11.947 -10.104   8.626
  209    HG3  PRO  31           HG1      PRO  31 -11.662 -11.683   7.868
  210    HD2  PRO  31           HD2      PRO  31 -10.342 -10.954  10.091
  211    HD3  PRO  31           HD1      PRO  31  -9.549 -11.893   8.814
  212    H    ALA  32           HN       ALA  32  -8.498  -7.191   6.327
  213    HA   ALA  32           HA       ALA  32  -9.756  -5.277   8.114
  214    HB1  ALA  32           HB1      ALA  32  -7.389  -5.008   7.584
  215    HB2  ALA  32           HB2      ALA  32  -8.324  -3.621   7.025
  216    HB3  ALA  32           HB3      ALA  32  -7.788  -4.841   5.871
  217    HA   PRO  33           HA       PRO  33 -12.861  -4.440   4.988
  218    HB2  PRO  33           HB2      PRO  33 -14.551  -3.093   6.555
  219    HB3  PRO  33           HB1      PRO  33 -14.340  -4.841   6.729
  220    HG2  PRO  33           HG2      PRO  33 -13.244  -2.619   8.397
  221    HG3  PRO  33           HG1      PRO  33 -13.835  -4.210   8.901
  222    HD2  PRO  33           HD2      PRO  33 -11.162  -3.501   8.550
  223    HD3  PRO  33           HD1      PRO  33 -11.790  -5.157   8.624
  224    H    GLU  34           HN       GLU  34 -10.700  -2.361   6.466
  225    HA   GLU  34           HA       GLU  34 -11.885   0.138   5.697
  226    HB2  GLU  34           HB2      GLU  34  -9.149  -0.547   6.782
  227    HB3  GLU  34           HB1      GLU  34  -9.704   1.089   6.471
  228    HG2  GLU  34           HG2      GLU  34 -10.991  -0.837   8.385
  229    HG3  GLU  34           HG1      GLU  34  -9.891   0.469   8.832
  230    H    GLU  35           HN       GLU  35 -11.875   0.864   3.723
  231    HA   GLU  35           HA       GLU  35  -9.967  -0.007   1.746
  232    HB2  GLU  35           HB2      GLU  35 -12.392   0.477   1.265
  233    HB3  GLU  35           HB1      GLU  35 -12.044   2.177   1.544
  234    HG2  GLU  35           HG2      GLU  35 -12.046   1.843  -0.788
  235    HG3  GLU  35           HG1      GLU  35 -10.364   2.049  -0.301
  236    H    TRP  36           HN       TRP  36  -7.935   0.780   2.104
  237    HA   TRP  36           HA       TRP  36  -7.496   3.470   3.038
  238    HB2  TRP  36           HB2      TRP  36  -5.436   1.721   1.746
  239    HB3  TRP  36           HB1      TRP  36  -5.186   2.988   2.929
  240    HD1  TRP  36           HD1      TRP  36  -7.596   1.609   4.888
  241    HE1  TRP  36           HE1      TRP  36  -6.837  -0.413   6.302
  242    HE3  TRP  36           HE3      TRP  36  -3.364   0.334   2.283
  243    HZ2  TRP  36           HZ2      TRP  36  -4.720  -2.273   6.297
  244    HZ3  TRP  36           HZ3      TRP  36  -2.049  -1.560   3.062
  245    HH2  TRP  36           HH2      TRP  36  -2.700  -2.850   5.011
  246    H    LEU  37           HN       LEU  37  -5.285   4.208   1.530
  247    HA   LEU  37           HA       LEU  37  -6.524   5.290  -0.830
  248    HB2  LEU  37           HB2      LEU  37  -4.987   6.602   0.598
  249    HB3  LEU  37           HB1      LEU  37  -3.687   5.516   0.167
  250    HG   LEU  37           HG       LEU  37  -3.860   6.230  -2.182
  251   HD11  LEU  37          HD11      LEU  37  -6.229   6.819  -2.216
  252   HD12  LEU  37          HD12      LEU  37  -5.225   8.156  -2.778
  253   HD13  LEU  37          HD13      LEU  37  -5.906   8.192  -1.151
  254   HD21  LEU  37          HD21      LEU  37  -3.553   8.492  -0.210
  255   HD22  LEU  37          HD22      LEU  37  -2.957   8.483  -1.870
  256   HD23  LEU  37          HD23      LEU  37  -2.296   7.352  -0.690
  257    H    ASP  38           HN       ASP  38  -6.737   4.026  -2.542
  258    HA   ASP  38           HA       ASP  38  -5.046   1.912  -3.292
  259    HB2  ASP  38           HB2      ASP  38  -6.133   2.285  -5.583
  260    HB3  ASP  38           HB1      ASP  38  -7.195   1.886  -4.240
  261    H    ILE  39           HN       ILE  39  -3.040   2.012  -3.869
  262    HA   ILE  39           HA       ILE  39  -1.688   4.416  -4.471
  263    HB   ILE  39           HB       ILE  39  -0.820   1.545  -4.790
  264   HG12  ILE  39          HG12      ILE  39  -0.492   3.587  -2.596
  265   HG13  ILE  39          HG11      ILE  39  -1.308   2.037  -2.509
  266   HG21  ILE  39          HG21      ILE  39   1.467   2.369  -4.895
  267   HG22  ILE  39          HG22      ILE  39   0.885   4.032  -4.841
  268   HG23  ILE  39          HG23      ILE  39   0.514   3.012  -6.232
  269   HD11  ILE  39          HD11      ILE  39   0.841   2.009  -1.359
  270   HD12  ILE  39          HD12      ILE  39   1.648   2.423  -2.873
  271   HD13  ILE  39          HD13      ILE  39   0.805   0.883  -2.717
  272    H    LEU  40           HN       LEU  40  -2.733   1.706  -6.472
  273    HA   LEU  40           HA       LEU  40  -2.064   3.282  -8.867
  274    HB2  LEU  40           HB2      LEU  40  -2.398   0.295  -8.562
  275    HB3  LEU  40           HB1      LEU  40  -2.067   1.118 -10.073
  276    HG   LEU  40           HG       LEU  40  -0.227   1.027  -7.680
  277   HD11  LEU  40          HD11      LEU  40  -0.400  -1.107  -8.853
  278   HD12  LEU  40          HD12      LEU  40   1.178  -0.359  -9.105
  279   HD13  LEU  40          HD13      LEU  40  -0.040  -0.300 -10.379
  280   HD21  LEU  40          HD21      LEU  40  -0.025   3.126  -8.910
  281   HD22  LEU  40          HD22      LEU  40   0.164   2.233 -10.418
  282   HD23  LEU  40          HD23      LEU  40   1.392   2.105  -9.159
  283    H    GLY  41           HN       GLY  41  -4.524   2.936  -6.977
  284    HA2  GLY  41           HA2      GLY  41  -6.765   3.364  -7.288
  285    HA3  GLY  41           HA1      GLY  41  -6.487   3.356  -9.021
  286    H    ASN  42           HN       ASN  42  -5.158   0.615  -7.932
  287    HA   ASN  42           HA       ASN  42  -7.321  -0.901  -9.049
  288    HB2  ASN  42           HB2      ASN  42  -5.723  -2.823  -8.857
  289    HB3  ASN  42           HB1      ASN  42  -5.172  -1.471  -9.833
  290   HD21  ASN  42          HD21      ASN  42  -5.072  -1.306  -6.331
  291   HD22  ASN  42          HD22      ASN  42  -3.349  -1.400  -6.215
  292    H    GLY  43           HN       GLY  43  -6.205  -0.206  -5.854
  293    HA2  GLY  43           HA2      GLY  43  -7.325  -0.713  -3.872
  294    HA3  GLY  43           HA1      GLY  43  -8.367  -1.808  -4.766
  295    H    LEU  44           HN       LEU  44  -5.884  -3.071  -5.932
  296    HA   LEU  44           HA       LEU  44  -5.556  -5.182  -4.060
  297    HB2  LEU  44           HB2      LEU  44  -4.203  -4.399  -6.631
  298    HB3  LEU  44           HB1      LEU  44  -3.551  -5.697  -5.657
  299    HG   LEU  44           HG       LEU  44  -5.564  -6.987  -5.943
  300   HD11  LEU  44          HD11      LEU  44  -7.424  -6.242  -7.289
  301   HD12  LEU  44          HD12      LEU  44  -6.612  -4.709  -7.608
  302   HD13  LEU  44          HD13      LEU  44  -7.153  -5.094  -5.974
  303   HD21  LEU  44          HD21      LEU  44  -4.596  -5.856  -8.557
  304   HD22  LEU  44          HD22      LEU  44  -5.455  -7.382  -8.346
  305   HD23  LEU  44          HD23      LEU  44  -3.847  -7.173  -7.653
  306    H    LEU  45           HN       LEU  45  -3.934  -2.295  -4.872
  307    HA   LEU  45           HA       LEU  45  -1.869  -2.787  -2.840
  308    HB2  LEU  45           HB2      LEU  45  -0.811  -2.885  -4.929
  309    HB3  LEU  45           HB1      LEU  45  -1.722  -1.540  -5.557
  310    HG   LEU  45           HG       LEU  45  -0.452   0.002  -4.137
  311   HD11  LEU  45          HD11      LEU  45  -0.046  -1.562  -2.275
  312   HD12  LEU  45          HD12      LEU  45   1.419  -0.737  -2.816
  313   HD13  LEU  45          HD13      LEU  45   1.127  -2.415  -3.280
  314   HD21  LEU  45          HD21      LEU  45   0.378  -0.545  -6.381
  315   HD22  LEU  45          HD22      LEU  45   1.330  -1.864  -5.701
  316   HD23  LEU  45          HD23      LEU  45   1.696  -0.194  -5.265
  317    H    ARG  46           HN       ARG  46  -2.203  -1.524  -1.136
  318    HA   ARG  46           HA       ARG  46  -3.028   1.280  -1.513
  319    HB2  ARG  46           HB2      ARG  46  -4.314  -0.446   0.589
  320    HB3  ARG  46           HB1      ARG  46  -4.802   1.144   0.030
  321    HG2  ARG  46           HG2      ARG  46  -5.500   0.185  -2.110
  322    HG3  ARG  46           HG1      ARG  46  -4.991  -1.407  -1.548
  323    HD2  ARG  46           HD2      ARG  46  -7.146   0.298  -0.310
  324    HD3  ARG  46           HD1      ARG  46  -7.399  -1.134  -1.313
  325    HE   ARG  46           HE       ARG  46  -5.741  -1.741   0.901
  326   HH11  ARG  46          HH11      ARG  46  -9.081  -1.172   0.020
  327   HH12  ARG  46          HH12      ARG  46  -9.711  -2.117   1.349
  328   HH21  ARG  46          HH21      ARG  46  -6.580  -2.931   2.668
  329   HH22  ARG  46          HH22      ARG  46  -8.295  -3.069   2.863
  330    H    LYS  47           HN       LYS  47  -2.218   2.669   0.080
  331    HA   LYS  47           HA       LYS  47  -0.486   1.426   2.133
  332    HB2  LYS  47           HB2      LYS  47   0.616   2.965   0.390
  333    HB3  LYS  47           HB1      LYS  47  -0.266   4.279   1.154
  334    HG2  LYS  47           HG2      LYS  47   0.826   3.448   3.341
  335    HG3  LYS  47           HG1      LYS  47   1.938   2.599   2.277
  336    HD2  LYS  47           HD2      LYS  47   2.969   4.654   2.855
  337    HD3  LYS  47           HD1      LYS  47   2.427   4.804   1.185
  338    HE2  LYS  47           HE2      LYS  47   0.681   6.251   1.761
  339    HE3  LYS  47           HE1      LYS  47   0.700   5.747   3.450
  340    HZ1  LYS  47           HZ1      LYS  47   1.633   7.975   3.145
  341    HZ2  LYS  47           HZ2      LYS  47   2.823   7.356   2.119
  342    HZ3  LYS  47           HZ3      LYS  47   2.801   6.907   3.760
  343    H    LYS  48           HN       LYS  48  -0.910   1.827   4.240
  344    HA   LYS  48           HA       LYS  48  -2.765   4.033   4.876
  345    HB2  LYS  48           HB2      LYS  48  -3.836   1.816   5.205
  346    HB3  LYS  48           HB1      LYS  48  -2.557   1.387   6.331
  347    HG2  LYS  48           HG2      LYS  48  -3.250   3.139   7.845
  348    HG3  LYS  48           HG1      LYS  48  -4.469   3.683   6.694
  349    HD2  LYS  48           HD2      LYS  48  -5.598   2.376   8.312
  350    HD3  LYS  48           HD1      LYS  48  -5.484   1.389   6.853
  351    HE2  LYS  48           HE2      LYS  48  -4.989   0.039   8.786
  352    HE3  LYS  48           HE1      LYS  48  -3.528   0.233   7.823
  353    HZ1  LYS  48           HZ1      LYS  48  -2.697   1.815   9.364
  354    HZ2  LYS  48           HZ2      LYS  48  -3.242   0.495  10.284
  355    HZ3  LYS  48           HZ3      LYS  48  -4.173   1.909  10.187
  356    H    THR  49           HN       THR  49  -2.006   5.497   6.260
  357    HA   THR  49           HA       THR  49   0.683   5.185   7.259
  358    HB   THR  49           HB       THR  49   0.334   7.516   8.139
  359    HG1  THR  49           HG1      THR  49  -1.848   8.031   6.600
  360   HG21  THR  49          HG21      THR  49  -0.258   7.075   5.212
  361   HG22  THR  49          HG22      THR  49   1.344   7.124   5.946
  362   HG23  THR  49          HG23      THR  49   0.339   8.570   5.927
  363    H    LEU  50           HN       LEU  50   1.075   4.127   9.059
  364    HA   LEU  50           HA       LEU  50  -0.742   3.991  11.291
  365    HB2  LEU  50           HB2      LEU  50   2.230   3.587  11.486
  366    HB3  LEU  50           HB1      LEU  50   0.954   2.759  12.355
  367    HG   LEU  50           HG       LEU  50   1.418   2.380   9.405
  368   HD11  LEU  50          HD11      LEU  50   2.602   0.329   9.999
  369   HD12  LEU  50          HD12      LEU  50   2.505   0.771  11.705
  370   HD13  LEU  50          HD13      LEU  50   3.439   1.767  10.582
  371   HD21  LEU  50          HD21      LEU  50   0.158   0.325   9.774
  372   HD22  LEU  50          HD22      LEU  50  -0.782   1.749  10.221
  373   HD23  LEU  50          HD23      LEU  50  -0.043   0.751  11.475
  374    H    VAL  51           HN       VAL  51   2.322   5.504  10.549
  375    HA   VAL  51           HA       VAL  51   1.490   7.964  11.936
  376    HB   VAL  51           HB       VAL  51   4.267   6.777  11.886
  377   HG11  VAL  51          HG11      VAL  51   4.348   9.194  11.745
  378   HG12  VAL  51          HG12      VAL  51   4.895   8.666  13.335
  379   HG13  VAL  51          HG13      VAL  51   3.276   9.332  13.139
  380   HG21  VAL  51          HG21      VAL  51   2.377   7.156  14.198
  381   HG22  VAL  51          HG22      VAL  51   4.047   6.606  14.328
  382   HG23  VAL  51          HG23      VAL  51   2.855   5.618  13.482
  383    HA   PRO  52           HA       PRO  52   2.886   9.175   7.845
  384    HB2  PRO  52           HB2      PRO  52   1.193  11.171   7.545
  385    HB3  PRO  52           HB1      PRO  52   0.595   9.531   7.836
  386    HG2  PRO  52           HG2      PRO  52   0.686  11.851   9.695
  387    HG3  PRO  52           HG1      PRO  52  -0.482  10.521   9.616
  388    HD2  PRO  52           HD2      PRO  52   1.879  10.738  11.276
  389    HD3  PRO  52           HD1      PRO  52   0.675   9.430  11.243
  390    H    GLY  53           HN       GLY  53   4.936   9.774   9.341
  391    HA2  GLY  53           HA2      GLY  53   6.745  11.155   9.387
  392    HA3  GLY  53           HA1      GLY  53   5.903  12.174   8.238
  393    HA   PRO  54           HA       PRO  54   5.901  14.490  12.279
  394    HB2  PRO  54           HB2      PRO  54   8.179  15.878  12.170
  395    HB3  PRO  54           HB1      PRO  54   8.154  14.220  12.783
  396    HG2  PRO  54           HG2      PRO  54   9.049  15.248  10.132
  397    HG3  PRO  54           HG1      PRO  54   9.738  13.949  11.121
  398    HD2  PRO  54           HD2      PRO  54   8.023  13.607   8.941
  399    HD3  PRO  54           HD1      PRO  54   8.384  12.390  10.179
  400    HA   PRO  55           HA       PRO  55   4.594  18.217  10.164
  401    HB2  PRO  55           HB2      PRO  55   5.469  20.244  11.759
  402    HB3  PRO  55           HB1      PRO  55   4.078  19.229  12.149
  403    HG2  PRO  55           HG2      PRO  55   6.897  19.040  13.136
  404    HG3  PRO  55           HG1      PRO  55   5.381  18.881  14.045
  405    HD2  PRO  55           HD2      PRO  55   6.820  16.737  13.271
  406    HD3  PRO  55           HD1      PRO  55   5.047  16.703  13.340
  407    H    GLY  56           HN       GLY  56   6.538  17.395   8.682
  408    HA2  GLY  56           HA2      GLY  56   7.511  19.250   7.135
  409    HA3  GLY  56           HA1      GLY  56   8.582  19.495   8.505
  410    H    SER  57           HN       SER  57   7.357  16.601   6.781
  411    HA   SER  57           HA       SER  57  10.081  15.581   6.680
  412    HB2  SER  57           HB2      SER  57   8.669  13.550   5.776
  413    HB3  SER  57           HB1      SER  57   8.717  13.900   7.503
  414    HG   SER  57           HG       SER  57   6.639  14.117   5.684
  415    H    SER  58           HN       SER  58  10.079  13.989   4.545
  416    HA   SER  58           HA       SER  58   9.157  15.443   2.204
  417    HB2  SER  58           HB2      SER  58  11.476  16.278   2.711
  418    HB3  SER  58           HB1      SER  58  12.057  14.620   2.545
  419    HG   SER  58           HG       SER  58  11.325  16.452   0.610
  420    H    ARG  59           HN       ARG  59   9.084  14.027   0.318
  421    HA   ARG  59           HA       ARG  59   9.121  11.204   1.109
  422    HB2  ARG  59           HB2      ARG  59   7.764  12.385  -1.320
  423    HB3  ARG  59           HB1      ARG  59   7.576  10.757  -0.672
  424    HG2  ARG  59           HG2      ARG  59   6.750  11.970   1.458
  425    HG3  ARG  59           HG1      ARG  59   6.518  13.343   0.379
  426    HD2  ARG  59           HD2      ARG  59   5.240  10.620   0.204
  427    HD3  ARG  59           HD1      ARG  59   4.452  12.167   0.500
  428    HE   ARG  59           HE       ARG  59   5.545  11.235  -2.058
  429   HH11  ARG  59          HH11      ARG  59   3.696  13.568  -0.214
  430   HH12  ARG  59          HH12      ARG  59   2.911  14.253  -1.603
  431   HH21  ARG  59          HH21      ARG  59   4.550  12.154  -3.906
  432   HH22  ARG  59          HH22      ARG  59   3.389  13.434  -3.723
  433    HA   PRO  60           HA       PRO  60  13.037  10.634  -0.986
  434    HB2  PRO  60           HB2      PRO  60  11.626   8.003  -1.192
  435    HB3  PRO  60           HB1      PRO  60  13.319   8.341  -0.814
  436    HG2  PRO  60           HG2      PRO  60  11.523   7.788   1.102
  437    HG3  PRO  60           HG1      PRO  60  12.859   8.920   1.359
  438    HD2  PRO  60           HD2      PRO  60   9.988   9.454   1.154
  439    HD3  PRO  60           HD1      PRO  60  11.285  10.482   1.783
  440    H    VAL  61           HN       VAL  61  13.612  10.839  -3.052
  441    HA   VAL  61           HA       VAL  61  11.537  10.702  -5.099
  442    HB   VAL  61           HB       VAL  61  14.411  11.548  -5.444
  443   HG11  VAL  61          HG11      VAL  61  11.951  12.166  -7.066
  444   HG12  VAL  61          HG12      VAL  61  13.250  11.065  -7.519
  445   HG13  VAL  61          HG13      VAL  61  13.569  12.793  -7.374
  446   HG21  VAL  61          HG21      VAL  61  12.058  13.309  -4.790
  447   HG22  VAL  61          HG22      VAL  61  13.704  13.849  -5.123
  448   HG23  VAL  61          HG23      VAL  61  13.363  12.890  -3.682
  449    H    LYS  62           HN       LYS  62  11.802   9.413  -6.997
  450    HA   LYS  62           HA       LYS  62  12.939   6.880  -6.510
  451    HB2  LYS  62           HB2      LYS  62  11.775   8.099  -8.987
  452    HB3  LYS  62           HB1      LYS  62  12.439   6.465  -8.957
  453    HG2  LYS  62           HG2      LYS  62  10.857   6.194  -6.891
  454    HG3  LYS  62           HG1      LYS  62  10.006   7.554  -7.626
  455    HD2  LYS  62           HD2      LYS  62   9.681   6.338  -9.650
  456    HD3  LYS  62           HD1      LYS  62  10.717   5.024  -9.091
  457    HE2  LYS  62           HE2      LYS  62   9.068   4.760  -7.166
  458    HE3  LYS  62           HE1      LYS  62   7.990   5.803  -8.101
  459    HZ1  LYS  62           HZ1      LYS  62   9.068   3.151  -8.881
  460    HZ2  LYS  62           HZ2      LYS  62   8.251   4.190  -9.959
  461    HZ3  LYS  62           HZ3      LYS  62   7.451   3.573  -8.602
  462    H    GLY  63           HN       GLY  63  14.936   6.597  -6.277
  463    HA2  GLY  63           HA2      GLY  63  16.942   6.323  -7.880
  464    HA3  GLY  63           HA1      GLY  63  16.863   8.082  -7.885
  465    H    GLN  64           HN       GLN  64  15.840   8.025  -5.090
  466    HA   GLN  64           HA       GLN  64  18.425   8.112  -3.826
  467    HB2  GLN  64           HB2      GLN  64  15.822   8.246  -2.332
  468    HB3  GLN  64           HB1      GLN  64  17.367   8.994  -1.931
  469    HG2  GLN  64           HG2      GLN  64  15.418   9.819  -4.061
  470    HG3  GLN  64           HG1      GLN  64  15.820  10.678  -2.584
  471   HE21  GLN  64          HE21      GLN  64  18.165   9.246  -4.820
  472   HE22  GLN  64          HE22      GLN  64  18.893  10.756  -5.267
  473    H    VAL  65           HN       VAL  65  19.314   6.721  -2.485
  474    HA   VAL  65           HA       VAL  65  18.159   4.083  -2.253
  475    HB   VAL  65           HB       VAL  65  20.812   5.219  -1.350
  476   HG11  VAL  65          HG11      VAL  65  19.842   2.371  -1.186
  477   HG12  VAL  65          HG12      VAL  65  20.110   3.445   0.184
  478   HG13  VAL  65          HG13      VAL  65  21.471   2.930  -0.812
  479   HG21  VAL  65          HG21      VAL  65  20.575   4.956  -3.750
  480   HG22  VAL  65          HG22      VAL  65  20.047   3.287  -3.528
  481   HG23  VAL  65          HG23      VAL  65  21.698   3.753  -3.113
  482    H    VAL  66           HN       VAL  66  16.902   3.539  -0.615
  483    HA   VAL  66           HA       VAL  66  16.872   5.246   1.785
  484    HB   VAL  66           HB       VAL  66  14.430   5.021   1.843
  485   HG11  VAL  66          HG11      VAL  66  13.894   6.442  -0.126
  486   HG12  VAL  66          HG12      VAL  66  15.521   6.142  -0.739
  487   HG13  VAL  66          HG13      VAL  66  15.294   7.004   0.780
  488   HG21  VAL  66          HG21      VAL  66  14.692   3.758  -0.884
  489   HG22  VAL  66          HG22      VAL  66  13.198   4.112  -0.017
  490   HG23  VAL  66          HG23      VAL  66  14.300   2.882   0.601
  491    H    THR  67           HN       THR  67  16.241   4.315   3.708
  492    HA   THR  67           HA       THR  67  16.543   1.398   3.756
  493    HB   THR  67           HB       THR  67  17.063   1.689   6.166
  494    HG1  THR  67           HG1      THR  67  17.653   4.026   6.655
  495   HG21  THR  67          HG21      THR  67  18.784   3.327   4.302
  496   HG22  THR  67          HG22      THR  67  18.873   1.583   4.535
  497   HG23  THR  67          HG23      THR  67  19.292   2.668   5.859
  498    H    VAL  68           HN       VAL  68  14.632   0.382   3.798
  499    HA   VAL  68           HA       VAL  68  12.546   1.552   5.499
  500    HB   VAL  68           HB       VAL  68  10.929   0.069   4.351
  501   HG11  VAL  68          HG11      VAL  68  10.803   1.328   2.270
  502   HG12  VAL  68          HG12      VAL  68  12.469   1.867   2.471
  503   HG13  VAL  68          HG13      VAL  68  11.229   2.388   3.610
  504   HG21  VAL  68          HG21      VAL  68  13.302  -0.613   2.614
  505   HG22  VAL  68          HG22      VAL  68  11.628  -0.969   2.189
  506   HG23  VAL  68          HG23      VAL  68  12.353  -1.709   3.617
  507    H    HIS  69           HN       HIS  69  11.642   0.346   7.112
  508    HA   HIS  69           HA       HIS  69  12.810  -2.330   7.532
  509    HB2  HIS  69           HB2      HIS  69  12.953  -0.867   9.506
  510    HB3  HIS  69           HB1      HIS  69  11.213  -0.577   9.436
  511    HD1  HIS  69           HD1      HIS  69  12.892  -2.052  11.855
  512    HD2  HIS  69           HD2      HIS  69  10.443  -3.812   8.993
  513    HE1  HIS  69           HE1      HIS  69  12.050  -4.219  12.854
  514    HE2  HIS  69           HE2      HIS  69  10.492  -5.164  11.183
  515    H    LEU  70           HN       LEU  70  11.598  -3.916   6.631
  516    HA   LEU  70           HA       LEU  70   8.705  -3.484   6.780
  517    HB2  LEU  70           HB2      LEU  70   8.292  -4.245   4.720
  518    HB3  LEU  70           HB1      LEU  70   9.922  -3.679   4.424
  519    HG   LEU  70           HG       LEU  70   9.311  -6.528   5.158
  520   HD11  LEU  70          HD11      LEU  70   9.562  -5.328   2.394
  521   HD12  LEU  70          HD12      LEU  70   8.081  -5.954   3.117
  522   HD13  LEU  70          HD13      LEU  70   9.421  -7.045   2.770
  523   HD21  LEU  70          HD21      LEU  70  11.624  -5.800   5.449
  524   HD22  LEU  70          HD22      LEU  70  11.662  -5.216   3.784
  525   HD23  LEU  70          HD23      LEU  70  11.486  -6.940   4.113
  526    H    GLN  71           HN       GLN  71   7.560  -4.855   7.809
  527    HA   GLN  71           HA       GLN  71   8.460  -7.650   7.993
  528    HB2  GLN  71           HB2      GLN  71   6.635  -6.669  10.086
  529    HB3  GLN  71           HB1      GLN  71   7.905  -7.877  10.199
  530    HG2  GLN  71           HG2      GLN  71   8.854  -6.302  11.480
  531    HG3  GLN  71           HG1      GLN  71   9.437  -5.745   9.918
  532   HE21  GLN  71          HE21      GLN  71   6.667  -4.876   9.243
  533   HE22  GLN  71          HE22      GLN  71   6.509  -3.359  10.056
  534    H    THR  72           HN       THR  72   7.155  -8.781   6.906
  535    HA   THR  72           HA       THR  72   4.673  -7.519   6.056
  536    HB   THR  72           HB       THR  72   6.316  -9.683   4.772
  537    HG1  THR  72           HG1      THR  72   7.197  -8.074   3.583
  538   HG21  THR  72          HG21      THR  72   3.955  -9.799   4.196
  539   HG22  THR  72          HG22      THR  72   4.922  -9.267   2.819
  540   HG23  THR  72          HG23      THR  72   3.980  -8.095   3.745
  541    H    SER  73           HN       SER  73   2.821  -8.364   6.541
  542    HA   SER  73           HA       SER  73   2.701 -11.061   7.675
  543    HB2  SER  73           HB2      SER  73   0.401  -9.143   7.778
  544    HB3  SER  73           HB1      SER  73   0.915 -10.337   8.968
  545    HG   SER  73           HG       SER  73   1.941  -7.762   8.476
  546    H    LEU  74           HN       LEU  74   1.170 -12.477   6.877
  547    HA   LEU  74           HA       LEU  74   0.352 -12.189   4.170
  548    HB2  LEU  74           HB2      LEU  74  -0.250 -14.170   6.337
  549    HB3  LEU  74           HB1      LEU  74  -0.933 -14.314   4.734
  550    HG   LEU  74           HG       LEU  74   1.858 -14.721   5.668
  551   HD11  LEU  74          HD11      LEU  74   0.173 -16.124   3.607
  552   HD12  LEU  74          HD12      LEU  74   0.362 -16.616   5.289
  553   HD13  LEU  74          HD13      LEU  74   1.750 -16.640   4.202
  554   HD21  LEU  74          HD21      LEU  74   1.144 -13.823   2.880
  555   HD22  LEU  74          HD22      LEU  74   2.702 -14.487   3.370
  556   HD23  LEU  74          HD23      LEU  74   2.143 -12.954   4.051
  557    H    GLU  75           HN       GLU  75  -1.926 -12.365   3.494
  558    HA   GLU  75           HA       GLU  75  -3.606 -10.424   4.513
  559    HB2  GLU  75           HB2      GLU  75  -5.426 -11.744   3.295
  560    HB3  GLU  75           HB1      GLU  75  -4.049 -11.199   2.349
  561    HG2  GLU  75           HG2      GLU  75  -3.063 -13.411   2.466
  562    HG3  GLU  75           HG1      GLU  75  -4.412 -13.973   3.453
  563    H    ASN  76           HN       ASN  76  -2.857 -13.461   5.797
  564    HA   ASN  76           HA       ASN  76  -5.328 -13.830   7.283
  565    HB2  ASN  76           HB2      ASN  76  -2.941 -15.434   7.991
  566    HB3  ASN  76           HB1      ASN  76  -4.592 -15.951   7.707
  567   HD21  ASN  76          HD21      ASN  76  -4.880 -14.942   5.064
  568   HD22  ASN  76          HD22      ASN  76  -3.823 -15.837   4.030
  569    H    GLY  77           HN       GLY  77  -2.367 -12.214   7.605
  570    HA2  GLY  77           HA2      GLY  77  -1.957 -10.730   9.459
  571    HA3  GLY  77           HA1      GLY  77  -2.761 -11.888  10.507
  572    H    THR  78           HN       THR  78  -0.993 -13.760   8.537
  573    HA   THR  78           HA       THR  78   0.942 -14.259  10.591
  574    HB   THR  78           HB       THR  78   0.706 -15.615   7.911
  575    HG1  THR  78           HG1      THR  78  -0.459 -17.199   9.376
  576   HG21  THR  78          HG21      THR  78   2.801 -16.064   9.113
  577   HG22  THR  78          HG22      THR  78   1.777 -17.498   9.049
  578   HG23  THR  78          HG23      THR  78   1.879 -16.555  10.534
  579    H    ARG  79           HN       ARG  79   2.702 -13.036  10.733
  580    HA   ARG  79           HA       ARG  79   3.851 -11.712   8.475
  581    HB2  ARG  79           HB2      ARG  79   4.794 -12.041  11.312
  582    HB3  ARG  79           HB1      ARG  79   5.681 -11.124  10.092
  583    HG2  ARG  79           HG2      ARG  79   3.251 -10.046   9.789
  584    HG3  ARG  79           HG1      ARG  79   3.169 -10.496  11.497
  585    HD2  ARG  79           HD2      ARG  79   5.191  -9.256  11.966
  586    HD3  ARG  79           HD1      ARG  79   5.399  -8.882  10.249
  587    HE   ARG  79           HE       ARG  79   2.918  -7.894  10.921
  588   HH11  ARG  79          HH11      ARG  79   6.186  -7.402  12.069
  589   HH12  ARG  79          HH12      ARG  79   5.929  -5.733  12.466
  590   HH21  ARG  79          HH21      ARG  79   2.570  -5.673  11.474
  591   HH22  ARG  79          HH22      ARG  79   3.902  -4.738  12.107
  592    H    VAL  80           HN       VAL  80   5.283 -12.359   7.117
  593    HA   VAL  80           HA       VAL  80   6.355 -15.071   7.474
  594    HB   VAL  80           HB       VAL  80   6.382 -15.157   5.000
  595   HG11  VAL  80          HG11      VAL  80   3.734 -14.503   6.260
  596   HG12  VAL  80          HG12      VAL  80   4.521 -16.080   6.247
  597   HG13  VAL  80          HG13      VAL  80   3.956 -15.363   4.739
  598   HG21  VAL  80          HG21      VAL  80   5.102 -13.455   3.754
  599   HG22  VAL  80          HG22      VAL  80   6.565 -12.804   4.493
  600   HG23  VAL  80          HG23      VAL  80   4.995 -12.496   5.231
  601    H    GLN  81           HN       GLN  81   7.266 -11.835   7.175
  602    HA   GLN  81           HA       GLN  81  10.061 -12.521   6.975
  603    HB2  GLN  81           HB2      GLN  81  10.470 -11.061   5.015
  604    HB3  GLN  81           HB1      GLN  81   9.460 -12.441   4.616
  605    HG2  GLN  81           HG2      GLN  81   7.474 -10.925   4.887
  606    HG3  GLN  81           HG1      GLN  81   8.610  -9.584   4.958
  607   HE21  GLN  81          HE21      GLN  81   7.118 -11.983   2.974
  608   HE22  GLN  81          HE22      GLN  81   7.641 -11.353   1.452
  609    H    GLU  82           HN       GLU  82  11.312 -11.001   8.000
  610    HA   GLU  82           HA       GLU  82  10.150  -8.400   8.586
  611    HB2  GLU  82           HB2      GLU  82   9.406  -9.796  10.459
  612    HB3  GLU  82           HB1      GLU  82  11.059 -10.318  10.741
  613    HG2  GLU  82           HG2      GLU  82  11.711  -8.224  11.536
  614    HG3  GLU  82           HG1      GLU  82  10.282  -7.443  10.866
  615    H    GLU  83           HN       GLU  83  11.645  -7.166   7.726
  616    HA   GLU  83           HA       GLU  83  14.464  -7.717   8.369
  617    HB2  GLU  83           HB2      GLU  83  13.653  -6.149   5.940
  618    HB3  GLU  83           HB1      GLU  83  15.128  -7.061   6.226
  619    HG2  GLU  83           HG2      GLU  83  12.405  -8.246   5.730
  620    HG3  GLU  83           HG1      GLU  83  13.679  -8.073   4.523
  621    HA   PRO  84           HA       PRO  84  13.969  -3.887  10.498
  622    HB2  PRO  84           HB2      PRO  84  16.865  -3.948  10.903
  623    HB3  PRO  84           HB1      PRO  84  15.569  -4.096  12.091
  624    HG2  PRO  84           HG2      PRO  84  17.154  -6.180  11.393
  625    HG3  PRO  84           HG1      PRO  84  15.464  -6.385  11.888
  626    HD2  PRO  84           HD2      PRO  84  16.653  -6.392   9.142
  627    HD3  PRO  84           HD1      PRO  84  15.374  -7.420   9.823
  628    H    GLU  85           HN       GLU  85  16.011  -4.346   7.766
  629    HA   GLU  85           HA       GLU  85  15.730  -1.649   6.971
  630    HB2  GLU  85           HB2      GLU  85  17.540  -1.569   8.782
  631    HB3  GLU  85           HB1      GLU  85  18.569  -2.410   7.630
  632    HG2  GLU  85           HG2      GLU  85  18.640  -0.603   6.181
  633    HG3  GLU  85           HG1      GLU  85  17.192   0.133   6.869
  634    H    LEU  86           HN       LEU  86  15.015  -2.428   5.181
  635    HA   LEU  86           HA       LEU  86  16.808  -3.839   3.372
  636    HB2  LEU  86           HB2      LEU  86  14.535  -4.665   3.459
  637    HB3  LEU  86           HB1      LEU  86  13.894  -3.054   3.225
  638    HG   LEU  86           HG       LEU  86  14.833  -3.013   0.971
  639   HD11  LEU  86          HD11      LEU  86  16.694  -4.554   1.235
  640   HD12  LEU  86          HD12      LEU  86  15.624  -5.120  -0.050
  641   HD13  LEU  86          HD13      LEU  86  15.573  -5.882   1.538
  642   HD21  LEU  86          HD21      LEU  86  13.257  -4.647  -0.010
  643   HD22  LEU  86          HD22      LEU  86  12.532  -3.676   1.271
  644   HD23  LEU  86          HD23      LEU  86  13.025  -5.338   1.596
  645    H    VAL  87           HN       VAL  87  18.248  -2.383   2.584
  646    HA   VAL  87           HA       VAL  87  17.269   0.273   1.837
  647    HB   VAL  87           HB       VAL  87  19.360  -0.042   3.247
  648   HG11  VAL  87          HG11      VAL  87  20.561  -0.865   0.608
  649   HG12  VAL  87          HG12      VAL  87  20.377  -1.892   2.033
  650   HG13  VAL  87          HG13      VAL  87  21.456  -0.498   2.083
  651   HG21  VAL  87          HG21      VAL  87  18.859   2.070   2.206
  652   HG22  VAL  87          HG22      VAL  87  19.579   1.520   0.694
  653   HG23  VAL  87          HG23      VAL  87  20.591   1.752   2.116
  654    H    PHE  88           HN       PHE  88  17.213   0.979  -0.277
  655    HA   PHE  88           HA       PHE  88  18.283  -0.650  -2.427
  656    HB2  PHE  88           HB2      PHE  88  16.170  -1.238  -3.422
  657    HB3  PHE  88           HB1      PHE  88  16.229  -1.864  -1.777
  658    HD1  PHE  88           HD2      PHE  88  15.011  -0.577   0.036
  659    HD2  PHE  88           HD1      PHE  88  14.438   0.152  -4.116
  660    HE1  PHE  88           HE2      PHE  88  12.863   0.498   0.528
  661    HE2  PHE  88           HE1      PHE  88  12.283   1.230  -3.634
  662    HZ   PHE  88           HZ       PHE  88  11.480   1.391  -1.321
  663    H    THR  89           HN       THR  89  17.612   0.211  -4.571
  664    HA   THR  89           HA       THR  89  17.618   3.116  -4.520
  665    HB   THR  89           HB       THR  89  17.648   1.386  -6.982
  666    HG1  THR  89           HG1      THR  89  19.514   0.631  -6.381
  667   HG21  THR  89          HG21      THR  89  19.015   3.240  -7.864
  668   HG22  THR  89          HG22      THR  89  18.829   4.088  -6.330
  669   HG23  THR  89          HG23      THR  89  17.421   3.780  -7.346
  670    H    LEU  90           HN       LEU  90  15.733   4.128  -4.470
  671    HA   LEU  90           HA       LEU  90  13.235   2.937  -4.985
  672    HB2  LEU  90           HB2      LEU  90  13.798   5.015  -3.613
  673    HB3  LEU  90           HB1      LEU  90  13.798   5.879  -5.112
  674    HG   LEU  90           HG       LEU  90  11.467   5.313  -5.500
  675   HD11  LEU  90          HD11      LEU  90  11.670   3.898  -2.845
  676   HD12  LEU  90          HD12      LEU  90  11.421   3.143  -4.419
  677   HD13  LEU  90          HD13      LEU  90  10.176   4.188  -3.737
  678   HD21  LEU  90          HD21      LEU  90  11.884   6.407  -2.721
  679   HD22  LEU  90          HD22      LEU  90  10.513   6.711  -3.791
  680   HD23  LEU  90          HD23      LEU  90  12.112   7.330  -4.206
  681    H    GLY  91           HN       GLY  91  12.138   2.599  -6.835
  682    HA2  GLY  91           HA2      GLY  91  11.335   3.075  -8.967
  683    HA3  GLY  91           HA1      GLY  91  12.514   4.370  -9.103
  684    H    ASP  92           HN       ASP  92  14.024   1.634  -7.987
  685    HA   ASP  92           HA       ASP  92  15.021   1.026 -10.682
  686    HB2  ASP  92           HB2      ASP  92  16.711   1.762  -9.032
  687    HB3  ASP  92           HB1      ASP  92  16.248   0.431  -7.978
  688    H    CYS  93           HN       CYS  93  12.757  -0.018  -8.628
  689    HA   CYS  93           HA       CYS  93  11.693  -1.978  -8.185
  690    HB2  CYS  93           HB2      CYS  93  13.006  -2.935 -10.736
  691    HB3  CYS  93           HB1      CYS  93  11.552  -3.588  -9.988
  692    HG   CYS  93           HG       CYS  93   9.921  -2.117 -11.320
  693    H    ASP  94           HN       ASP  94  14.295  -1.553  -7.053
  694    HA   ASP  94           HA       ASP  94  15.832  -3.949  -7.185
  695    HB2  ASP  94           HB2      ASP  94  16.674  -1.661  -6.476
  696    HB3  ASP  94           HB1      ASP  94  15.809  -1.894  -4.964
  697    H    VAL  95           HN       VAL  95  12.930  -3.174  -5.968
  698    HA   VAL  95           HA       VAL  95  12.873  -5.327  -3.967
  699    HB   VAL  95           HB       VAL  95  11.226  -3.888  -2.709
  700   HG11  VAL  95          HG11      VAL  95  12.934  -2.571  -1.611
  701   HG12  VAL  95          HG12      VAL  95  14.003  -2.761  -3.001
  702   HG13  VAL  95          HG13      VAL  95  13.573  -4.164  -2.020
  703   HG21  VAL  95          HG21      VAL  95  12.296  -1.801  -4.604
  704   HG22  VAL  95          HG22      VAL  95  11.375  -1.445  -3.140
  705   HG23  VAL  95          HG23      VAL  95  10.624  -2.347  -4.457
  706    H    ILE  96           HN       ILE  96  10.172  -5.100  -3.345
  707    HA   ILE  96           HA       ILE  96   8.902  -6.080  -5.715
  708    HB   ILE  96           HB       ILE  96   6.912  -6.339  -4.294
  709   HG12  ILE  96          HG12      ILE  96   8.620  -5.107  -2.118
  710   HG13  ILE  96          HG11      ILE  96   7.231  -4.340  -2.879
  711   HG21  ILE  96          HG21      ILE  96   7.834  -7.987  -2.734
  712   HG22  ILE  96          HG22      ILE  96   9.447  -7.324  -2.994
  713   HG23  ILE  96          HG23      ILE  96   8.591  -8.107  -4.323
  714   HD11  ILE  96          HD11      ILE  96   6.675  -5.248  -0.693
  715   HD12  ILE  96          HD12      ILE  96   7.173  -6.855  -1.227
  716   HD13  ILE  96          HD13      ILE  96   5.777  -6.072  -1.969
  717    H    GLN  97           HN       GLN  97   7.357  -5.000  -6.883
  718    HA   GLN  97           HA       GLN  97   7.850  -2.268  -7.176
  719    HB2  GLN  97           HB2      GLN  97   6.823  -4.010  -8.854
  720    HB3  GLN  97           HB1      GLN  97   5.297  -3.405  -8.217
  721    HG2  GLN  97           HG2      GLN  97   5.730  -2.112 -10.122
  722    HG3  GLN  97           HG1      GLN  97   6.141  -1.079  -8.754
  723   HE21  GLN  97          HE21      GLN  97   8.394  -0.660  -8.320
  724   HE22  GLN  97          HE22      GLN  97   9.568  -0.876  -9.566
  725    H    ALA  98           HN       ALA  98   5.409  -3.963  -5.319
  726    HA   ALA  98           HA       ALA  98   3.683  -1.853  -4.692
  727    HB1  ALA  98           HB1      ALA  98   4.630  -4.143  -2.973
  728    HB2  ALA  98           HB2      ALA  98   3.188  -4.106  -3.985
  729    HB3  ALA  98           HB3      ALA  98   3.291  -3.075  -2.563
  730    H    LEU  99           HN       LEU  99   6.784  -2.781  -3.307
  731    HA   LEU  99           HA       LEU  99   6.691  -0.786  -1.248
  732    HB2  LEU  99           HB2      LEU  99   7.994  -2.877  -1.015
  733    HB3  LEU  99           HB1      LEU  99   9.058  -2.317  -2.298
  734    HG   LEU  99           HG       LEU  99   9.747  -0.414  -0.903
  735   HD11  LEU  99          HD11      LEU  99   9.119  -0.340   1.457
  736   HD12  LEU  99          HD12      LEU  99   7.990  -1.669   1.188
  737   HD13  LEU  99          HD13      LEU  99   7.734  -0.116   0.392
  738   HD21  LEU  99          HD21      LEU  99  11.044  -1.647   0.741
  739   HD22  LEU  99          HD22      LEU  99  11.042  -2.475  -0.817
  740   HD23  LEU  99          HD23      LEU  99  10.024  -3.067   0.496
  741    H    ASP 100           HN       ASP 100   8.128  -1.119  -4.396
  742    HA   ASP 100           HA       ASP 100   9.887   1.069  -4.305
  743    HB2  ASP 100           HB2      ASP 100  10.016  -0.774  -5.938
  744    HB3  ASP 100           HB1      ASP 100   8.524  -0.230  -6.677
  745    H    LEU 101           HN       LEU 101   6.499   0.769  -4.945
  746    HA   LEU 101           HA       LEU 101   6.242   3.524  -5.790
  747    HB2  LEU 101           HB2      LEU 101   4.133   1.430  -5.306
  748    HB3  LEU 101           HB1      LEU 101   3.901   2.960  -6.100
  749    HG   LEU 101           HG       LEU 101   5.559   0.666  -7.125
  750   HD11  LEU 101          HD11      LEU 101   3.871   0.507  -8.866
  751   HD12  LEU 101          HD12      LEU 101   2.963   1.828  -8.130
  752   HD13  LEU 101          HD13      LEU 101   3.148   0.297  -7.273
  753   HD21  LEU 101          HD21      LEU 101   6.572   2.761  -7.778
  754   HD22  LEU 101          HD22      LEU 101   5.019   3.363  -8.360
  755   HD23  LEU 101          HD23      LEU 101   5.797   2.004  -9.170
  756    H    SER 102           HN       SER 102   5.612   1.580  -2.918
  757    HA   SER 102           HA       SER 102   3.801   3.483  -1.790
  758    HB2  SER 102           HB2      SER 102   4.050   2.047   0.292
  759    HB3  SER 102           HB1      SER 102   3.442   1.225  -1.146
  760    HG   SER 102           HG       SER 102   5.241   0.107  -1.296
  761    H    VAL 103           HN       VAL 103   7.190   3.011  -1.787
  762    HA   VAL 103           HA       VAL 103   7.828   4.386   0.590
  763    HB   VAL 103           HB       VAL 103   9.395   3.757  -1.872
  764   HG11  VAL 103          HG11      VAL 103  10.229   5.897  -0.880
  765   HG12  VAL 103          HG12      VAL 103  11.402   4.585  -0.809
  766   HG13  VAL 103          HG13      VAL 103  10.504   5.039   0.640
  767   HG21  VAL 103          HG21      VAL 103   9.099   1.823  -0.628
  768   HG22  VAL 103          HG22      VAL 103   9.202   2.678   0.909
  769   HG23  VAL 103          HG23      VAL 103  10.654   2.419  -0.048
  770    HA   PRO 104           HA       PRO 104   8.485   8.323  -2.201
  771    HB2  PRO 104           HB2      PRO 104   7.155   8.245  -4.606
  772    HB3  PRO 104           HB1      PRO 104   8.876   7.883  -4.406
  773    HG2  PRO 104           HG2      PRO 104   6.553   5.994  -4.560
  774    HG3  PRO 104           HG1      PRO 104   8.133   5.889  -5.355
  775    HD2  PRO 104           HD2      PRO 104   7.629   4.454  -3.187
  776    HD3  PRO 104           HD1      PRO 104   9.214   5.221  -3.424
  777    H    LEU 105           HN       LEU 105   5.605   6.364  -2.117
  778    HA   LEU 105           HA       LEU 105   3.827   8.629  -1.859
  779    HB2  LEU 105           HB2      LEU 105   3.552   5.663  -1.600
  780    HB3  LEU 105           HB1      LEU 105   2.261   6.719  -1.035
  781    HG   LEU 105           HG       LEU 105   3.283   6.390  -3.843
  782   HD11  LEU 105          HD11      LEU 105   0.570   6.051  -2.586
  783   HD12  LEU 105          HD12      LEU 105   1.649   4.760  -3.117
  784   HD13  LEU 105          HD13      LEU 105   0.940   5.858  -4.300
  785   HD21  LEU 105          HD21      LEU 105   1.361   8.474  -2.818
  786   HD22  LEU 105          HD22      LEU 105   1.749   8.171  -4.512
  787   HD23  LEU 105          HD23      LEU 105   2.991   8.780  -3.415
  788    H    MET 106           HN       MET 106   5.864   6.858   0.228
  789    HA   MET 106           HA       MET 106   4.458   7.764   2.621
  790    HB2  MET 106           HB2      MET 106   5.075   5.541   2.895
  791    HB3  MET 106           HB1      MET 106   6.606   5.752   2.063
  792    HG2  MET 106           HG2      MET 106   7.669   6.547   3.916
  793    HG3  MET 106           HG1      MET 106   6.179   7.168   4.633
  794    HE1  MET 106           HE1      MET 106   8.250   3.917   3.823
  795    HE2  MET 106           HE2      MET 106   6.657   3.506   3.187
  796    HE3  MET 106           HE3      MET 106   7.272   2.680   4.615
  797    H    ASP 107           HN       ASP 107   5.326   9.207   4.117
  798    HA   ASP 107           HA       ASP 107   7.376  10.983   3.070
  799    HB2  ASP 107           HB2      ASP 107   5.321  11.140   5.198
  800    HB3  ASP 107           HB1      ASP 107   6.813  12.009   5.520
  801    H    VAL 108           HN       VAL 108   9.284  11.538   4.142
  802    HA   VAL 108           HA       VAL 108  10.695   9.436   5.332
  803    HB   VAL 108           HB       VAL 108  11.206  12.373   5.057
  804   HG11  VAL 108          HG11      VAL 108  12.910  10.529   6.731
  805   HG12  VAL 108          HG12      VAL 108  11.963  11.892   7.334
  806   HG13  VAL 108          HG13      VAL 108  13.331  12.174   6.254
  807   HG21  VAL 108          HG21      VAL 108  12.761   9.904   4.305
  808   HG22  VAL 108          HG22      VAL 108  13.200  11.565   3.898
  809   HG23  VAL 108          HG23      VAL 108  11.732  10.849   3.226
  810    H    GLY 109           HN       GLY 109  10.513   8.598   7.241
  811    HA2  GLY 109           HA2      GLY 109  10.837   8.755   9.589
  812    HA3  GLY 109           HA1      GLY 109  10.141  10.365   9.546
  813    H    GLU 110           HN       GLU 110   8.368   8.125   7.694
  814    HA   GLU 110           HA       GLU 110   6.505   7.789   9.935
  815    HB2  GLU 110           HB2      GLU 110   4.660   7.896   8.499
  816    HB3  GLU 110           HB1      GLU 110   5.696   9.227   8.011
  817    HG2  GLU 110           HG2      GLU 110   6.398   8.060   6.077
  818    HG3  GLU 110           HG1      GLU 110   5.631   6.575   6.625
  819    H    THR 111           HN       THR 111   5.006   5.903   9.609
  820    HA   THR 111           HA       THR 111   6.415   3.660   8.375
  821    HB   THR 111           HB       THR 111   4.940   3.444  10.986
  822    HG1  THR 111           HG1      THR 111   7.343   4.515  10.545
  823   HG21  THR 111          HG21      THR 111   6.093   1.295  11.170
  824   HG22  THR 111          HG22      THR 111   6.889   1.585   9.622
  825   HG23  THR 111          HG23      THR 111   5.139   1.370   9.687
  826    H    ALA 112           HN       ALA 112   5.169   2.683   6.967
  827    HA   ALA 112           HA       ALA 112   2.285   3.237   7.079
  828    HB1  ALA 112           HB1      ALA 112   4.107   3.034   4.693
  829    HB2  ALA 112           HB2      ALA 112   3.331   4.491   5.317
  830    HB3  ALA 112           HB3      ALA 112   2.353   3.202   4.613
  831    H    MET 113           HN       MET 113   0.935   1.575   6.901
  832    HA   MET 113           HA       MET 113   2.088  -1.087   6.441
  833    HB2  MET 113           HB2      MET 113   0.746  -1.172   8.380
  834    HB3  MET 113           HB1      MET 113  -0.481  -0.113   7.693
  835    HG2  MET 113           HG2      MET 113  -1.158  -1.891   6.162
  836    HG3  MET 113           HG1      MET 113   0.075  -2.950   6.845
  837    HE1  MET 113           HE1      MET 113  -0.194  -4.370   8.848
  838    HE2  MET 113           HE2      MET 113  -1.224  -3.990  10.230
  839    HE3  MET 113           HE3      MET 113   0.095  -2.904   9.787
  840    H    VAL 114           HN       VAL 114   1.949  -1.820   4.433
  841    HA   VAL 114           HA       VAL 114  -0.128  -0.674   2.678
  842    HB   VAL 114           HB       VAL 114   2.430  -1.919   1.747
  843   HG11  VAL 114          HG11      VAL 114   2.075  -0.617  -0.266
  844   HG12  VAL 114          HG12      VAL 114   0.600   0.058   0.429
  845   HG13  VAL 114          HG13      VAL 114   0.699  -1.669   0.072
  846   HG21  VAL 114          HG21      VAL 114   1.987   0.975   2.375
  847   HG22  VAL 114          HG22      VAL 114   3.415   0.298   1.588
  848   HG23  VAL 114          HG23      VAL 114   3.035  -0.135   3.256
  849    H    THR 115           HN       THR 115  -1.510  -2.074   1.777
  850    HA   THR 115           HA       THR 115  -0.763  -4.903   1.896
  851    HB   THR 115           HB       THR 115  -3.560  -3.760   1.729
  852    HG1  THR 115           HG1      THR 115  -1.914  -4.254   3.801
  853   HG21  THR 115          HG21      THR 115  -2.579  -6.597   1.999
  854   HG22  THR 115          HG22      THR 115  -3.285  -5.893   0.543
  855   HG23  THR 115          HG23      THR 115  -4.265  -6.083   2.000
  856    H    ALA 116           HN       ALA 116  -0.093  -5.646   0.150
  857    HA   ALA 116           HA       ALA 116  -1.130  -4.633  -2.426
  858    HB1  ALA 116           HB1      ALA 116   1.695  -5.473  -1.835
  859    HB2  ALA 116           HB2      ALA 116   1.139  -3.805  -1.947
  860    HB3  ALA 116           HB3      ALA 116   1.076  -4.853  -3.363
  861    H    ASP 117           HN       ASP 117  -1.796  -6.161  -3.831
  862    HA   ASP 117           HA       ASP 117  -2.027  -8.856  -3.274
  863    HB2  ASP 117           HB2      ASP 117  -3.035  -7.572  -5.264
  864    HB3  ASP 117           HB1      ASP 117  -1.481  -7.785  -6.027
  865    H    SER 118           HN       SER 118  -0.775 -10.648  -3.768
  866    HA   SER 118           HA       SER 118   1.946 -10.488  -3.323
  867    HB2  SER 118           HB2      SER 118   0.287 -12.506  -3.236
  868    HB3  SER 118           HB1      SER 118   0.770 -12.734  -4.920
  869    HG   SER 118           HG       SER 118   2.000 -13.773  -3.016
  870    H    LYS 119           HN       LYS 119   0.150 -10.251  -6.298
  871    HA   LYS 119           HA       LYS 119   2.155 -10.632  -8.176
  872    HB2  LYS 119           HB2      LYS 119   0.850  -8.977  -9.560
  873    HB3  LYS 119           HB1      LYS 119  -0.070 -10.346  -8.936
  874    HG2  LYS 119           HG2      LYS 119  -1.051  -8.960  -7.254
  875    HG3  LYS 119           HG1      LYS 119   0.031  -7.625  -7.666
  876    HD2  LYS 119           HD2      LYS 119  -2.153  -7.237  -8.610
  877    HD3  LYS 119           HD1      LYS 119  -0.981  -7.511  -9.898
  878    HE2  LYS 119           HE2      LYS 119  -1.765  -9.974  -9.745
  879    HE3  LYS 119           HE1      LYS 119  -3.167  -9.297  -8.911
  880    HZ1  LYS 119           HZ1      LYS 119  -2.244  -8.600 -11.653
  881    HZ2  LYS 119           HZ2      LYS 119  -3.521  -7.834 -10.844
  882    HZ3  LYS 119           HZ3      LYS 119  -3.643  -9.475 -11.250
  883    H    TYR 120           HN       TYR 120   1.551  -7.838  -6.085
  884    HA   TYR 120           HA       TYR 120   3.756  -6.404  -7.363
  885    HB2  TYR 120           HB2      TYR 120   1.963  -5.550  -5.088
  886    HB3  TYR 120           HB1      TYR 120   3.145  -4.536  -5.910
  887    HD1  TYR 120           HD1      TYR 120   2.745  -3.775  -8.188
  888    HD2  TYR 120           HD2      TYR 120  -0.149  -6.015  -6.037
  889    HE1  TYR 120           HE1      TYR 120   1.040  -3.051  -9.793
  890    HE2  TYR 120           HE2      TYR 120  -1.886  -5.312  -7.638
  891    HH   TYR 120           HH       TYR 120  -1.258  -4.040 -10.601
  892    H    CYS 121           HN       CYS 121   3.512  -8.787  -5.294
  893    HA   CYS 121           HA       CYS 121   5.739  -7.874  -3.614
  894    HB2  CYS 121           HB2      CYS 121   3.441  -9.688  -2.878
  895    HB3  CYS 121           HB1      CYS 121   4.828  -9.368  -1.844
  896    HG   CYS 121           HG       CYS 121   3.916  -6.434  -2.469
  897    H    TYR 122           HN       TYR 122   4.413 -11.159  -3.600
  898    HA   TYR 122           HA       TYR 122   6.617 -12.026  -5.326
  899    HB2  TYR 122           HB2      TYR 122   6.152 -13.444  -2.710
  900    HB3  TYR 122           HB1      TYR 122   7.510 -13.581  -3.807
  901    HD1  TYR 122           HD2      TYR 122   9.296 -11.910  -3.820
  902    HD2  TYR 122           HD1      TYR 122   6.041 -11.630  -1.094
  903    HE1  TYR 122           HE2      TYR 122  10.547 -10.269  -2.500
  904    HE2  TYR 122           HE1      TYR 122   7.286  -9.975   0.227
  905    HH   TYR 122           HH       TYR 122  10.190  -8.510  -0.905
  906    H    GLY 123           HN       GLY 123   3.794 -12.003  -5.917
  907    HA2  GLY 123           HA2      GLY 123   2.374 -14.304  -5.504
  908    HA3  GLY 123           HA1      GLY 123   2.340 -13.410  -7.012
  909    HA   PRO 124           HA       PRO 124   4.238 -17.023  -8.816
  910    HB2  PRO 124           HB2      PRO 124   5.142 -15.488 -11.091
  911    HB3  PRO 124           HB1      PRO 124   3.767 -16.590 -10.988
  912    HG2  PRO 124           HG2      PRO 124   3.521 -13.880 -11.323
  913    HG3  PRO 124           HG1      PRO 124   2.280 -14.906 -10.585
  914    HD2  PRO 124           HD2      PRO 124   4.315 -13.149  -9.266
  915    HD3  PRO 124           HD1      PRO 124   2.605 -13.406  -8.850
  916    H    GLN 125           HN       GLN 125   5.806 -14.769  -7.280
  917    HA   GLN 125           HA       GLN 125   8.459 -15.172  -8.480
  918    HB2  GLN 125           HB2      GLN 125   7.606 -13.094  -6.449
  919    HB3  GLN 125           HB1      GLN 125   9.121 -13.138  -7.349
  920    HG2  GLN 125           HG2      GLN 125   8.009 -12.651  -9.385
  921    HG3  GLN 125           HG1      GLN 125   6.429 -12.882  -8.652
  922   HE21  GLN 125          HE21      GLN 125   5.563 -11.283  -7.372
  923   HE22  GLN 125          HE22      GLN 125   6.206  -9.685  -7.283
  924    H    GLY 126           HN       GLY 126   6.712 -15.071  -5.432
  925    HA2  GLY 126           HA2      GLY 126   7.000 -16.224  -3.492
  926    HA3  GLY 126           HA1      GLY 126   8.312 -17.120  -4.245
  927    H    SER 127           HN       SER 127   8.000 -15.800  -1.630
  928    HA   SER 127           HA       SER 127   9.873 -13.633  -1.750
  929    HB2  SER 127           HB2      SER 127   8.057 -13.149  -0.333
  930    HB3  SER 127           HB1      SER 127   8.094 -14.740   0.400
  931    HG   SER 127           HG       SER 127   9.142 -12.586   1.377
  932    H    ARG 128           HN       ARG 128  11.805 -13.504  -0.643
  933    HA   ARG 128           HA       ARG 128  13.487 -15.665  -0.973
  934    HB2  ARG 128           HB2      ARG 128  15.177 -14.381   0.288
  935    HB3  ARG 128           HB1      ARG 128  14.360 -13.428  -0.935
  936    HG2  ARG 128           HG2      ARG 128  13.457 -13.348   1.912
  937    HG3  ARG 128           HG1      ARG 128  14.832 -12.389   1.368
  938    HD2  ARG 128           HD2      ARG 128  11.989 -12.253   0.372
  939    HD3  ARG 128           HD1      ARG 128  12.869 -11.021   1.278
  940    HE   ARG 128           HE       ARG 128  13.497 -11.820  -1.498
  941   HH11  ARG 128          HH11      ARG 128  13.369  -9.406   1.043
  942   HH12  ARG 128          HH12      ARG 128  13.898  -8.117   0.015
  943   HH21  ARG 128          HH21      ARG 128  14.164 -10.113  -2.858
  944   HH22  ARG 128          HH22      ARG 128  14.375  -8.512  -2.199
  945    H    SER 129           HN       SER 129  11.623 -14.823   1.878
  946    HA   SER 129           HA       SER 129  12.931 -16.982   3.329
  947    HB2  SER 129           HB2      SER 129  12.395 -14.890   4.556
  948    HB3  SER 129           HB1      SER 129  10.684 -15.169   4.249
  949    HG   SER 129           HG       SER 129  11.165 -15.955   6.273
  950    HA   PRO 130           HA       PRO 130   8.905 -19.094   2.256
  951    HB2  PRO 130           HB2      PRO 130   6.523 -17.702   2.480
  952    HB3  PRO 130           HB1      PRO 130   7.321 -18.522   3.814
  953    HG2  PRO 130           HG2      PRO 130   6.913 -15.735   3.536
  954    HG3  PRO 130           HG1      PRO 130   7.894 -16.549   4.765
  955    HD2  PRO 130           HD2      PRO 130   8.744 -15.309   2.179
  956    HD3  PRO 130           HD1      PRO 130   9.589 -15.352   3.739
  957    H    TYR 131           HN       TYR 131   8.752 -19.528   0.034
  958    HA   TYR 131           HA       TYR 131   8.053 -17.762  -1.972
  959    HB2  TYR 131           HB2      TYR 131   8.687 -19.903  -2.709
  960    HB3  TYR 131           HB1      TYR 131   7.566 -20.714  -1.621
  961    HD1  TYR 131           HD2      TYR 131   7.511 -18.375  -4.558
  962    HD2  TYR 131           HD1      TYR 131   5.649 -21.616  -2.523
  963    HE1  TYR 131           HE2      TYR 131   5.869 -18.579  -6.385
  964    HE2  TYR 131           HE1      TYR 131   4.012 -21.826  -4.345
  965    HH   TYR 131           HH       TYR 131   4.410 -20.320  -7.342
  966    H    ILE 132           HN       ILE 132   6.537 -16.287  -1.459
  967    HA   ILE 132           HA       ILE 132   4.168 -16.841  -0.041
  968    HB   ILE 132           HB       ILE 132   4.663 -14.539  -1.929
  969   HG12  ILE 132          HG12      ILE 132   6.467 -14.450  -0.400
  970   HG13  ILE 132          HG11      ILE 132   5.288 -13.243   0.106
  971   HG21  ILE 132          HG21      ILE 132   3.019 -13.367  -0.580
  972   HG22  ILE 132          HG22      ILE 132   2.850 -14.784   0.460
  973   HG23  ILE 132          HG23      ILE 132   2.337 -14.862  -1.230
  974   HD11  ILE 132          HD11      ILE 132   6.313 -14.482   1.948
  975   HD12  ILE 132          HD12      ILE 132   5.570 -15.964   1.340
  976   HD13  ILE 132          HD13      ILE 132   4.555 -14.630   1.900
  977    HA   PRO 133           HA       PRO 133   1.884 -18.885  -3.318
  978    HB2  PRO 133           HB2      PRO 133  -0.614 -18.215  -2.247
  979    HB3  PRO 133           HB1      PRO 133   0.308 -19.679  -1.884
  980    HG2  PRO 133           HG2      PRO 133   0.096 -17.134  -0.344
  981    HG3  PRO 133           HG1      PRO 133   0.217 -18.801   0.250
  982    HD2  PRO 133           HD2      PRO 133   2.318 -17.140   0.315
  983    HD3  PRO 133           HD1      PRO 133   2.521 -18.868  -0.048
  984    HA   PRO 134           HA       PRO 134   1.204 -15.456  -6.038
  985    HB2  PRO 134           HB2      PRO 134  -0.636 -17.391  -7.354
  986    HB3  PRO 134           HB1      PRO 134   0.654 -16.399  -8.057
  987    HG2  PRO 134           HG2      PRO 134   1.017 -19.007  -7.648
  988    HG3  PRO 134           HG1      PRO 134   2.325 -17.855  -7.312
  989    HD2  PRO 134           HD2      PRO 134   0.488 -19.254  -5.405
  990    HD3  PRO 134           HD1      PRO 134   2.216 -18.880  -5.235
  991    H    HIS 135           HN       HIS 135  -0.046 -13.828  -5.777
  992    HA   HIS 135           HA       HIS 135  -1.859 -12.489  -5.567
  993    HB2  HIS 135           HB2      HIS 135  -3.327 -15.063  -6.037
  994    HB3  HIS 135           HB1      HIS 135  -4.196 -13.605  -5.565
  995    HD1  HIS 135           HD1      HIS 135  -3.820 -11.501  -7.228
  996    HD2  HIS 135           HD2      HIS 135  -2.842 -15.276  -8.681
  997    HE1  HIS 135           HE1      HIS 135  -3.743 -11.274  -9.732
  998    HE2  HIS 135           HE2      HIS 135  -3.319 -13.607 -10.594
  999    H    ALA 136           HN       ALA 136  -0.709 -14.401  -3.270
 1000    HA   ALA 136           HA       ALA 136  -2.703 -14.064  -1.247
 1001    HB1  ALA 136           HB1      ALA 136  -0.879 -14.496   0.350
 1002    HB2  ALA 136           HB2      ALA 136   0.287 -14.410  -0.973
 1003    HB3  ALA 136           HB3      ALA 136  -0.917 -15.698  -0.938
 1004    H    ALA 137           HN       ALA 137  -3.315 -12.180  -0.371
 1005    HA   ALA 137           HA       ALA 137  -2.018  -9.783  -1.273
 1006    HB1  ALA 137           HB1      ALA 137  -3.760  -8.599  -0.058
 1007    HB2  ALA 137           HB2      ALA 137  -4.246 -10.092   0.737
 1008    HB3  ALA 137           HB3      ALA 137  -4.453  -9.918  -1.001
 1009    H    LEU 138           HN       LEU 138  -0.284  -8.985  -0.413
 1010    HA   LEU 138           HA       LEU 138   0.601  -9.904   2.171
 1011    HB2  LEU 138           HB2      LEU 138   1.828  -9.117  -0.265
 1012    HB3  LEU 138           HB1      LEU 138   2.425  -8.069   1.011
 1013    HG   LEU 138           HG       LEU 138   3.205  -9.944   2.281
 1014   HD11  LEU 138          HD11      LEU 138   2.002 -11.682   0.154
 1015   HD12  LEU 138          HD12      LEU 138   1.416 -11.493   1.808
 1016   HD13  LEU 138          HD13      LEU 138   2.990 -12.232   1.505
 1017   HD21  LEU 138          HD21      LEU 138   3.982 -10.234  -0.607
 1018   HD22  LEU 138          HD22      LEU 138   4.876 -10.876   0.771
 1019   HD23  LEU 138          HD23      LEU 138   4.704  -9.134   0.565
 1020    H    CYS 139           HN       CYS 139   0.640  -8.715   3.965
 1021    HA   CYS 139           HA       CYS 139   0.002  -5.849   3.753
 1022    HB2  CYS 139           HB2      CYS 139  -1.632  -7.482   4.932
 1023    HB3  CYS 139           HB1      CYS 139  -0.419  -7.529   6.202
 1024    HG   CYS 139           HG       CYS 139  -2.705  -5.221   5.566
 1025    H    LEU 140           HN       LEU 140   1.951  -4.915   3.814
 1026    HA   LEU 140           HA       LEU 140   3.878  -5.913   5.793
 1027    HB2  LEU 140           HB2      LEU 140   5.596  -4.897   4.290
 1028    HB3  LEU 140           HB1      LEU 140   4.746  -6.287   3.640
 1029    HG   LEU 140           HG       LEU 140   3.277  -4.069   2.785
 1030   HD11  LEU 140          HD11      LEU 140   5.153  -2.641   3.419
 1031   HD12  LEU 140          HD12      LEU 140   4.986  -2.709   1.660
 1032   HD13  LEU 140          HD13      LEU 140   6.247  -3.645   2.468
 1033   HD21  LEU 140          HD21      LEU 140   3.602  -6.110   1.521
 1034   HD22  LEU 140          HD22      LEU 140   5.327  -5.769   1.361
 1035   HD23  LEU 140          HD23      LEU 140   4.144  -4.727   0.567
 1036    H    GLU 141           HN       GLU 141   4.710  -4.613   7.241
 1037    HA   GLU 141           HA       GLU 141   3.823  -1.821   7.297
 1038    HB2  GLU 141           HB2      GLU 141   3.253  -3.120   9.248
 1039    HB3  GLU 141           HB1      GLU 141   4.899  -3.713   9.393
 1040    HG2  GLU 141           HG2      GLU 141   5.662  -1.468   9.991
 1041    HG3  GLU 141           HG1      GLU 141   4.002  -0.873   9.839
 1042    H    VAL 142           HN       VAL 142   5.253  -0.382   6.502
 1043    HA   VAL 142           HA       VAL 142   8.103  -1.084   6.652
 1044    HB   VAL 142           HB       VAL 142   8.289   0.521   4.618
 1045   HG11  VAL 142          HG11      VAL 142   7.920  -1.351   3.102
 1046   HG12  VAL 142          HG12      VAL 142   7.007  -2.193   4.354
 1047   HG13  VAL 142          HG13      VAL 142   8.731  -1.886   4.575
 1048   HG21  VAL 142          HG21      VAL 142   5.994   1.351   4.673
 1049   HG22  VAL 142          HG22      VAL 142   5.390  -0.291   4.447
 1050   HG23  VAL 142          HG23      VAL 142   6.318   0.490   3.168
 1051    H    THR 143           HN       THR 143   9.228   0.100   7.959
 1052    HA   THR 143           HA       THR 143   8.558   2.855   8.635
 1053    HB   THR 143           HB       THR 143  11.100   1.371   9.325
 1054    HG1  THR 143           HG1      THR 143   8.649   1.358  10.807
 1055   HG21  THR 143          HG21      THR 143  10.988   2.810  11.354
 1056   HG22  THR 143          HG22      THR 143   9.587   3.624  10.654
 1057   HG23  THR 143          HG23      THR 143  11.157   3.721   9.849
 1058    H    LEU 144           HN       LEU 144   9.171   4.490   7.333
 1059    HA   LEU 144           HA       LEU 144  11.572   4.150   5.694
 1060    HB2  LEU 144           HB2      LEU 144   9.512   5.151   4.701
 1061    HB3  LEU 144           HB1      LEU 144   9.646   6.480   5.834
 1062    HG   LEU 144           HG       LEU 144  11.771   7.154   4.811
 1063   HD11  LEU 144          HD11      LEU 144  12.530   4.937   4.094
 1064   HD12  LEU 144          HD12      LEU 144  12.558   6.092   2.765
 1065   HD13  LEU 144          HD13      LEU 144  11.264   4.901   2.868
 1066   HD21  LEU 144          HD21      LEU 144   9.677   8.086   3.972
 1067   HD22  LEU 144          HD22      LEU 144   9.548   6.765   2.811
 1068   HD23  LEU 144          HD23      LEU 144  10.869   7.927   2.681
 1069    H    LYS 145           HN       LYS 145  13.225   4.240   7.036
 1070    HA   LYS 145           HA       LYS 145  13.228   6.100   9.258
 1071    HB2  LYS 145           HB2      LYS 145  15.340   4.093   8.427
 1072    HB3  LYS 145           HB1      LYS 145  15.257   4.951   9.957
 1073    HG2  LYS 145           HG2      LYS 145  14.296   3.069  10.671
 1074    HG3  LYS 145           HG1      LYS 145  12.876   3.796   9.949
 1075    HD2  LYS 145           HD2      LYS 145  13.140   1.445   9.313
 1076    HD3  LYS 145           HD1      LYS 145  13.182   2.532   7.927
 1077    HE2  LYS 145           HE2      LYS 145  14.882   0.897   7.642
 1078    HE3  LYS 145           HE1      LYS 145  15.672   2.431   8.006
 1079    HZ1  LYS 145           HZ1      LYS 145  16.800   0.974   9.361
 1080    HZ2  LYS 145           HZ2      LYS 145  15.436   0.014   9.667
 1081    HZ3  LYS 145           HZ3      LYS 145  15.592   1.513  10.427
 1082    H    THR 146           HN       THR 146  14.630   5.761   6.116
 1083    HA   THR 146           HA       THR 146  16.110   8.217   6.410
 1084    HB   THR 146           HB       THR 146  17.486   5.573   6.010
 1085    HG1  THR 146           HG1      THR 146  17.019   7.134   8.223
 1086   HG21  THR 146          HG21      THR 146  18.634   8.368   6.042
 1087   HG22  THR 146          HG22      THR 146  18.609   7.250   4.678
 1088   HG23  THR 146          HG23      THR 146  19.594   6.892   6.096
 1089    H    ALA 147           HN       ALA 147  16.580   9.152   4.466
 1090    HA   ALA 147           HA       ALA 147  16.530   7.483   2.067
 1091    HB1  ALA 147           HB1      ALA 147  14.368   8.579   2.123
 1092    HB2  ALA 147           HB2      ALA 147  15.355   9.295   0.849
 1093    HB3  ALA 147           HB3      ALA 147  15.137  10.142   2.380
 1094    H    VAL 148           HN       VAL 148  18.323   7.814   0.841
 1095    HA   VAL 148           HA       VAL 148  19.720  10.390   1.174
 1096    HB   VAL 148           HB       VAL 148  21.884   9.361   1.276
 1097   HG11  VAL 148          HG11      VAL 148  20.073   7.916   3.211
 1098   HG12  VAL 148          HG12      VAL 148  20.655   9.570   3.403
 1099   HG13  VAL 148          HG13      VAL 148  21.800   8.228   3.415
 1100   HG21  VAL 148          HG21      VAL 148  22.222   6.942   1.339
 1101   HG22  VAL 148          HG22      VAL 148  21.498   7.451  -0.187
 1102   HG23  VAL 148          HG23      VAL 148  20.501   6.690   1.054
 1103    H    ASP 149           HN       ASP 149  20.836  11.103  -0.694
 1104    HA   ASP 149           HA       ASP 149  19.687   9.978  -3.100
 1105    HB2  ASP 149           HB2      ASP 149  19.589  12.311  -3.146
 1106    HB3  ASP 149           HB1      ASP 149  21.238  12.496  -2.531
 1107    H    LEU 150           HN       LEU 150  20.670   8.437  -4.171
 1108    HA   LEU 150           HA       LEU 150  23.581   8.542  -4.465
 1109    HB2  LEU 150           HB2      LEU 150  22.701   6.849  -2.683
 1110    HB3  LEU 150           HB1      LEU 150  22.186   5.905  -4.069
 1111    HG   LEU 150           HG       LEU 150  24.523   5.820  -4.859
 1112   HD11  LEU 150          HD11      LEU 150  25.319   7.894  -3.920
 1113   HD12  LEU 150          HD12      LEU 150  26.304   6.556  -3.325
 1114   HD13  LEU 150          HD13      LEU 150  25.075   7.281  -2.285
 1115   HD21  LEU 150          HD21      LEU 150  23.659   4.010  -3.494
 1116   HD22  LEU 150          HD22      LEU 150  24.079   4.887  -2.023
 1117   HD23  LEU 150          HD23      LEU 150  25.349   4.307  -3.101
 1118    H    GLU 151           HN       GLU 151  20.982   9.069  -5.936
 1119    HA   GLU 151           HA       GLU 151  20.825   7.210  -8.107
 1120    HB2  GLU 151           HB2      GLU 151  19.054   8.902  -7.164
 1121    HB3  GLU 151           HB1      GLU 151  19.866  10.063  -8.200
 1122    HG2  GLU 151           HG2      GLU 151  18.511   7.522  -9.096
 1123    HG3  GLU 151           HG1      GLU 151  17.886   9.162  -9.255
 1124    H    HIS 152           HN       HIS 152  22.310  10.317  -7.486
 1125    HA   HIS 152           HA       HIS 152  23.227  10.705 -10.178
 1126    HB2  HIS 152           HB2      HIS 152  24.033  12.211  -7.677
 1127    HB3  HIS 152           HB1      HIS 152  24.230  12.747  -9.342
 1128    HD1  HIS 152           HD1      HIS 152  22.141  13.333  -6.556
 1129    HD2  HIS 152           HD2      HIS 152  21.417  12.774 -10.621
 1130    HE1  HIS 152           HE1      HIS 152  19.875  14.334  -6.986
 1131    HE2  HIS 152           HE2      HIS 152  19.425  13.933  -9.429
 1132    H    HIS 153           HN       HIS 153  24.160   8.437  -9.904
 1133    HA   HIS 153           HA       HIS 153  26.647   8.132  -8.568
 1134    HB2  HIS 153           HB2      HIS 153  25.408   6.153  -8.935
 1135    HB3  HIS 153           HB1      HIS 153  25.160   6.525 -10.635
 1136    HD1  HIS 153           HD1      HIS 153  27.834   5.273  -8.266
 1137    HD2  HIS 153           HD2      HIS 153  27.053   5.549 -12.345
 1138    HE1  HIS 153           HE1      HIS 153  29.655   3.950  -9.400
 1139    HE2  HIS 153           HE2      HIS 153  29.265   4.293 -11.873
 1140    H    HIS 154           HN       HIS 154  28.622   8.654  -9.206
 1141    HA   HIS 154           HA       HIS 154  29.133   9.079 -12.054
 1142    HB2  HIS 154           HB2      HIS 154  30.585  11.052 -11.470
 1143    HB3  HIS 154           HB1      HIS 154  28.858  11.321 -11.282
 1144    HD1  HIS 154           HD1      HIS 154  28.203  12.409  -9.175
 1145    HD2  HIS 154           HD2      HIS 154  31.863  10.453  -8.824
 1146    HE1  HIS 154           HE1      HIS 154  29.029  12.915  -6.851
 1147    HE2  HIS 154           HE2      HIS 154  31.280  11.795  -6.687
 1148    H    HIS 155           HN       HIS 155  31.231   8.684 -12.723
 1149    HA   HIS 155           HA       HIS 155  32.651   6.740 -11.172
 1150    HB2  HIS 155           HB2      HIS 155  32.614   6.421 -13.533
 1151    HB3  HIS 155           HB1      HIS 155  33.156   8.065 -13.839
 1152    HD1  HIS 155           HD1      HIS 155  35.540   8.288 -14.378
 1153    HD2  HIS 155           HD2      HIS 155  34.760   4.817 -12.220
 1154    HE1  HIS 155           HE1      HIS 155  37.742   7.078 -14.214
 1155    HE2  HIS 155           HE2      HIS 155  37.175   4.877 -13.137
 1156    H    HIS 156           HN       HIS 156  34.320   7.012  -9.853
 1157    HA   HIS 156           HA       HIS 156  35.857   9.514 -10.026
 1158    HB2  HIS 156           HB2      HIS 156  35.768   9.929  -7.764
 1159    HB3  HIS 156           HB1      HIS 156  34.203   9.160  -7.966
 1160    HD1  HIS 156           HD1      HIS 156  33.957   6.704  -7.033
 1161    HD2  HIS 156           HD2      HIS 156  37.560   8.593  -6.144
 1162    HE1  HIS 156           HE1      HIS 156  35.030   5.317  -5.222
 1163    HE2  HIS 156           HE2      HIS 156  37.204   6.483  -4.695
 1164    H    HIS 157           HN       HIS 157  38.070   9.260  -9.094
 1165    HA   HIS 157           HA       HIS 157  39.035   6.494  -9.283
 1166    HB2  HIS 157           HB2      HIS 157  39.535   7.627 -11.397
 1167    HB3  HIS 157           HB1      HIS 157  40.320   8.940 -10.527
 1168    HD1  HIS 157           HD1      HIS 157  40.750   5.198 -11.089
 1169    HD2  HIS 157           HD2      HIS 157  42.981   8.583 -10.139
 1170    HE1  HIS 157           HE1      HIS 157  43.161   4.451 -11.082
 1171    HE2  HIS 157           HE2      HIS 157  44.455   6.462 -10.290
  Start of MODEL   11
    1    H1   MET   1           HT1      MET   1  32.202 -17.988  67.707
    2    H2   MET   1           HT2      MET   1  30.793 -17.658  68.584
    3    H3   MET   1           HT3      MET   1  32.034 -18.576  69.284
    4    HA   MET   1           HA       MET   1  31.970 -16.295  70.126
    5    HB2  MET   1           HB2      MET   1  34.070 -17.618  70.059
    6    HB3  MET   1           HB1      MET   1  34.420 -16.949  68.475
    7    HG2  MET   1           HG2      MET   1  34.543 -14.716  69.419
    8    HG3  MET   1           HG1      MET   1  34.146 -15.354  71.011
    9    HE1  MET   1           HE1      MET   1  37.290 -17.695  71.626
   10    HE2  MET   1           HE2      MET   1  35.775 -18.129  70.837
   11    HE3  MET   1           HE3      MET   1  35.756 -17.149  72.300
   12    H    GLY   2           HN       GLY   2  33.454 -16.237  66.889
   13    HA2  GLY   2           HA2      GLY   2  32.131 -13.635  66.459
   14    HA3  GLY   2           HA1      GLY   2  33.652 -14.119  65.710
   15    H    GLN   3           HN       GLN   3  31.540 -13.179  64.184
   16    HA   GLN   3           HA       GLN   3  30.393 -13.650  62.293
   17    HB2  GLN   3           HB2      GLN   3  32.127 -16.072  62.516
   18    HB3  GLN   3           HB1      GLN   3  30.809 -16.091  61.353
   19    HG2  GLN   3           HG2      GLN   3  32.908 -13.940  61.461
   20    HG3  GLN   3           HG1      GLN   3  33.012 -15.371  60.434
   21   HE21  GLN   3          HE21      GLN   3  30.129 -15.421  59.951
   22   HE22  GLN   3          HE22      GLN   3  29.817 -14.141  58.821
   23    HA   PRO   4           HA       PRO   4  27.059 -15.627  64.720
   24    HB2  PRO   4           HB2      PRO   4  25.173 -13.810  64.082
   25    HB3  PRO   4           HB1      PRO   4  26.380 -13.507  65.339
   26    HG2  PRO   4           HG2      PRO   4  26.346 -12.594  62.485
   27    HG3  PRO   4           HG1      PRO   4  26.733 -11.666  63.945
   28    HD2  PRO   4           HD2      PRO   4  28.636 -12.704  62.314
   29    HD3  PRO   4           HD1      PRO   4  28.872 -12.512  64.065
   30    HA   PRO   5           HA       PRO   5  25.131 -17.712  61.288
   31    HB2  PRO   5           HB2      PRO   5  22.856 -18.268  63.044
   32    HB3  PRO   5           HB1      PRO   5  24.022 -19.392  62.343
   33    HG2  PRO   5           HG2      PRO   5  23.967 -18.823  64.984
   34    HG3  PRO   5           HG1      PRO   5  25.472 -19.206  64.124
   35    HD2  PRO   5           HD2      PRO   5  24.380 -16.539  64.947
   36    HD3  PRO   5           HD1      PRO   5  26.051 -17.141  65.011
   37    H    ALA   6           HN       ALA   6  23.643 -17.270  59.749
   38    HA   ALA   6           HA       ALA   6  21.945 -16.298  58.598
   39    HB1  ALA   6           HB1      ALA   6  20.024 -15.339  59.737
   40    HB2  ALA   6           HB2      ALA   6  20.906 -15.354  61.264
   41    HB3  ALA   6           HB3      ALA   6  20.483 -16.874  60.478
   42    H    GLU   7           HN       GLU   7  22.962 -14.847  57.406
   43    HA   GLU   7           HA       GLU   7  23.514 -12.197  58.530
   44    HB2  GLU   7           HB2      GLU   7  24.873 -11.850  56.481
   45    HB3  GLU   7           HB1      GLU   7  25.419 -13.220  57.440
   46    HG2  GLU   7           HG2      GLU   7  24.061 -14.674  55.876
   47    HG3  GLU   7           HG1      GLU   7  23.904 -13.252  54.849
   48    H    GLU   8           HN       GLU   8  23.153 -10.373  56.810
   49    HA   GLU   8           HA       GLU   8  20.590 -10.821  55.452
   50    HB2  GLU   8           HB2      GLU   8  19.713  -8.703  56.364
   51    HB3  GLU   8           HB1      GLU   8  20.028  -9.886  57.627
   52    HG2  GLU   8           HG2      GLU   8  22.112  -8.760  58.178
   53    HG3  GLU   8           HG1      GLU   8  21.826  -7.585  56.895
   54    H    ALA   9           HN       ALA   9  19.991  -8.705  54.231
   55    HA   ALA   9           HA       ALA   9  22.240  -7.169  53.273
   56    HB1  ALA   9           HB1      ALA   9  20.714  -8.978  51.388
   57    HB2  ALA   9           HB2      ALA   9  22.404  -9.163  51.860
   58    HB3  ALA   9           HB3      ALA   9  21.901  -7.764  50.908
   59    H    GLU  10           HN       GLU  10  21.486  -5.424  51.792
   60    HA   GLU  10           HA       GLU  10  18.851  -4.521  52.634
   61    HB2  GLU  10           HB2      GLU  10  20.909  -3.078  50.953
   62    HB3  GLU  10           HB1      GLU  10  19.456  -2.376  51.653
   63    HG2  GLU  10           HG2      GLU  10  20.352  -2.798  53.897
   64    HG3  GLU  10           HG1      GLU  10  21.818  -3.461  53.174
   65    H    GLN  11           HN       GLN  11  20.461  -4.052  49.521
   66    HA   GLN  11           HA       GLN  11  17.995  -4.974  48.202
   67    HB2  GLN  11           HB2      GLN  11  20.044  -3.006  47.184
   68    HB3  GLN  11           HB1      GLN  11  18.577  -3.489  46.347
   69    HG2  GLN  11           HG2      GLN  11  17.240  -2.469  48.119
   70    HG3  GLN  11           HG1      GLN  11  18.720  -1.985  48.948
   71   HE21  GLN  11          HE21      GLN  11  19.978  -0.333  48.102
   72   HE22  GLN  11          HE22      GLN  11  19.396   0.736  46.864
   73    HA   PRO  12           HA       PRO  12  20.613  -8.136  46.295
   74    HB2  PRO  12           HB2      PRO  12  18.150  -8.408  44.669
   75    HB3  PRO  12           HB1      PRO  12  19.069  -9.643  45.532
   76    HG2  PRO  12           HG2      PRO  12  16.704  -8.782  46.441
   77    HG3  PRO  12           HG1      PRO  12  18.023  -9.204  47.549
   78    HD2  PRO  12           HD2      PRO  12  17.048  -6.513  46.690
   79    HD3  PRO  12           HD1      PRO  12  17.640  -7.044  48.280
   80    H    GLY  13           HN       GLY  13  18.710  -5.563  44.864
   81    HA2  GLY  13           HA2      GLY  13  19.596  -3.980  43.356
   82    HA3  GLY  13           HA1      GLY  13  20.829  -5.142  42.887
   83    H    ALA  14           HN       ALA  14  17.408  -5.821  43.113
   84    HA   ALA  14           HA       ALA  14  15.957  -6.756  41.656
   85    HB1  ALA  14           HB1      ALA  14  15.923  -4.476  40.751
   86    HB2  ALA  14           HB2      ALA  14  15.683  -5.679  39.486
   87    HB3  ALA  14           HB3      ALA  14  17.249  -4.889  39.665
   88    H    LEU  15           HN       LEU  15  18.046  -6.272  38.948
   89    HA   LEU  15           HA       LEU  15  19.769  -8.406  39.034
   90    HB2  LEU  15           HB2      LEU  15  17.685  -9.790  39.107
   91    HB3  LEU  15           HB1      LEU  15  17.258  -9.157  37.529
   92    HG   LEU  15           HG       LEU  15  19.340 -10.169  36.603
   93   HD11  LEU  15          HD11      LEU  15  19.543 -11.389  39.353
   94   HD12  LEU  15          HD12      LEU  15  20.670 -10.238  38.633
   95   HD13  LEU  15          HD13      LEU  15  20.508 -11.857  37.953
   96   HD21  LEU  15          HD21      LEU  15  17.195 -11.325  36.435
   97   HD22  LEU  15          HD22      LEU  15  17.481 -12.081  38.002
   98   HD23  LEU  15          HD23      LEU  15  18.525 -12.469  36.635
   99    H    ALA  16           HN       ALA  16  17.592  -8.067  36.327
  100    HA   ALA  16           HA       ALA  16  18.638  -5.984  34.873
  101    HB1  ALA  16           HB1      ALA  16  20.073  -8.568  34.192
  102    HB2  ALA  16           HB2      ALA  16  20.818  -7.167  34.960
  103    HB3  ALA  16           HB3      ALA  16  20.204  -7.047  33.311
  104    H    ARG  17           HN       ARG  17  17.676  -9.351  34.746
  105    HA   ARG  17           HA       ARG  17  15.764  -8.734  32.599
  106    HB2  ARG  17           HB2      ARG  17  17.560 -10.125  31.738
  107    HB3  ARG  17           HB1      ARG  17  17.385 -11.248  33.076
  108    HG2  ARG  17           HG2      ARG  17  16.424 -12.180  31.086
  109    HG3  ARG  17           HG1      ARG  17  15.144 -11.835  32.252
  110    HD2  ARG  17           HD2      ARG  17  14.638  -9.756  31.080
  111    HD3  ARG  17           HD1      ARG  17  15.916 -10.099  29.913
  112    HE   ARG  17           HE       ARG  17  13.486 -11.746  30.231
  113   HH11  ARG  17          HH11      ARG  17  16.003 -10.331  28.251
  114   HH12  ARG  17          HH12      ARG  17  15.408 -11.034  26.780
  115   HH21  ARG  17          HH21      ARG  17  12.707 -12.664  28.285
  116   HH22  ARG  17          HH22      ARG  17  13.548 -12.345  26.793
  117    H    GLU  18           HN       GLU  18  13.742  -8.814  33.400
  118    HA   GLU  18           HA       GLU  18  13.202 -10.688  35.586
  119    HB2  GLU  18           HB2      GLU  18  11.082  -9.399  35.881
  120    HB3  GLU  18           HB1      GLU  18  12.541  -8.457  36.148
  121    HG2  GLU  18           HG2      GLU  18  12.255  -7.235  34.190
  122    HG3  GLU  18           HG1      GLU  18  11.170  -8.436  33.490
  123    H    PHE  19           HN       PHE  19  11.841  -9.612  32.485
  124    HA   PHE  19           HA       PHE  19  10.900 -12.295  31.967
  125    HB2  PHE  19           HB2      PHE  19   9.059 -11.234  33.263
  126    HB3  PHE  19           HB1      PHE  19   8.947  -9.985  32.027
  127    HD1  PHE  19           HD1      PHE  19   8.850 -13.697  32.368
  128    HD2  PHE  19           HD2      PHE  19   7.416 -10.247  30.335
  129    HE1  PHE  19           HE1      PHE  19   7.276 -15.101  31.099
  130    HE2  PHE  19           HE2      PHE  19   5.841 -11.641  29.062
  131    HZ   PHE  19           HZ       PHE  19   5.791 -14.093  29.443
  132    H    LEU  20           HN       LEU  20  10.387  -8.955  30.786
  133    HA   LEU  20           HA       LEU  20  11.377  -9.864  28.167
  134    HB2  LEU  20           HB2      LEU  20   9.225  -7.832  28.756
  135    HB3  LEU  20           HB1      LEU  20   9.923  -8.090  27.171
  136    HG   LEU  20           HG       LEU  20   8.344 -10.129  28.746
  137   HD11  LEU  20          HD11      LEU  20   6.966  -8.307  27.897
  138   HD12  LEU  20          HD12      LEU  20   6.644  -9.801  27.016
  139   HD13  LEU  20          HD13      LEU  20   7.636  -8.539  26.283
  140   HD21  LEU  20          HD21      LEU  20  10.074 -11.169  27.368
  141   HD22  LEU  20          HD22      LEU  20   9.510 -10.268  25.963
  142   HD23  LEU  20          HD23      LEU  20   8.471 -11.483  26.707
  143    H    ALA  21           HN       ALA  21  11.761  -7.611  26.851
  144    HA   ALA  21           HA       ALA  21  13.780  -6.167  28.399
  145    HB1  ALA  21           HB1      ALA  21  14.465  -7.147  26.247
  146    HB2  ALA  21           HB2      ALA  21  14.589  -5.387  26.213
  147    HB3  ALA  21           HB3      ALA  21  13.232  -6.192  25.422
  148    H    ALA  22           HN       ALA  22  13.820  -3.786  26.889
  149    HA   ALA  22           HA       ALA  22  11.170  -2.610  27.223
  150    HB1  ALA  22           HB1      ALA  22  11.981  -0.814  28.642
  151    HB2  ALA  22           HB2      ALA  22  13.603  -1.505  28.628
  152    HB3  ALA  22           HB3      ALA  22  12.283  -2.371  29.416
  153    H    MET  23           HN       MET  23  11.000  -0.474  26.313
  154    HA   MET  23           HA       MET  23  11.396   1.223  24.872
  155    HB2  MET  23           HB2      MET  23  14.241   0.246  24.983
  156    HB3  MET  23           HB1      MET  23  13.736   1.661  24.070
  157    HG2  MET  23           HG2      MET  23  13.430   1.293  27.043
  158    HG3  MET  23           HG1      MET  23  14.669   2.259  26.240
  159    HE1  MET  23           HE1      MET  23  12.593   3.323  28.536
  160    HE2  MET  23           HE2      MET  23  12.300   4.936  27.888
  161    HE3  MET  23           HE3      MET  23  13.924   4.253  27.853
  162    H    GLU  24           HN       GLU  24  11.374  -1.893  24.094
  163    HA   GLU  24           HA       GLU  24  11.090  -1.222  21.254
  164    HB2  GLU  24           HB2      GLU  24  12.278  -3.802  22.309
  165    HB3  GLU  24           HB1      GLU  24  11.908  -3.466  20.627
  166    HG2  GLU  24           HG2      GLU  24  13.539  -1.578  20.728
  167    HG3  GLU  24           HG1      GLU  24  13.995  -2.139  22.336
  168    HA   PRO  25           HA       PRO  25   7.216  -3.034  22.810
  169    HB2  PRO  25           HB2      PRO  25   5.536  -1.351  21.596
  170    HB3  PRO  25           HB1      PRO  25   6.459  -0.855  23.018
  171    HG2  PRO  25           HG2      PRO  25   6.952  -0.247  20.135
  172    HG3  PRO  25           HG1      PRO  25   7.130   0.806  21.547
  173    HD2  PRO  25           HD2      PRO  25   9.201  -0.541  20.286
  174    HD3  PRO  25           HD1      PRO  25   9.256   0.090  21.943
  175    H    GLU  26           HN       GLU  26   5.621  -4.285  21.839
  176    HA   GLU  26           HA       GLU  26   6.160  -5.021  19.069
  177    HB2  GLU  26           HB2      GLU  26   4.845  -7.042  19.542
  178    HB3  GLU  26           HB1      GLU  26   6.172  -6.850  20.674
  179    HG2  GLU  26           HG2      GLU  26   4.516  -5.868  22.291
  180    HG3  GLU  26           HG1      GLU  26   3.250  -6.367  21.170
  181    HA   PRO  27           HA       PRO  27   2.704  -2.840  17.536
  182    HB2  PRO  27           HB2      PRO  27   2.276  -4.987  15.568
  183    HB3  PRO  27           HB1      PRO  27   2.746  -3.307  15.312
  184    HG2  PRO  27           HG2      PRO  27   4.473  -5.328  14.953
  185    HG3  PRO  27           HG1      PRO  27   4.989  -3.750  15.578
  186    HD2  PRO  27           HD2      PRO  27   4.477  -6.305  17.061
  187    HD3  PRO  27           HD1      PRO  27   5.779  -5.116  17.281
  188    H    ALA  28           HN       ALA  28   0.597  -2.700  17.995
  189    HA   ALA  28           HA       ALA  28  -0.796  -5.031  19.027
  190    HB1  ALA  28           HB1      ALA  28  -2.577  -3.456  19.606
  191    HB2  ALA  28           HB2      ALA  28  -1.717  -2.167  18.765
  192    HB3  ALA  28           HB3      ALA  28  -1.016  -2.901  20.205
  193    HA   PRO  29           HA       PRO  29  -2.704  -6.082  15.177
  194    HB2  PRO  29           HB2      PRO  29  -4.945  -7.084  16.816
  195    HB3  PRO  29           HB1      PRO  29  -3.912  -7.954  15.679
  196    HG2  PRO  29           HG2      PRO  29  -3.689  -8.319  18.323
  197    HG3  PRO  29           HG1      PRO  29  -2.268  -8.338  17.259
  198    HD2  PRO  29           HD2      PRO  29  -3.255  -6.167  19.069
  199    HD3  PRO  29           HD1      PRO  29  -1.589  -6.695  18.747
  200    H    ALA  30           HN       ALA  30  -3.778  -4.759  13.883
  201    HA   ALA  30           HA       ALA  30  -6.358  -3.708  14.728
  202    HB1  ALA  30           HB1      ALA  30  -5.851  -1.439  13.984
  203    HB2  ALA  30           HB2      ALA  30  -4.185  -1.914  13.651
  204    HB3  ALA  30           HB3      ALA  30  -4.790  -1.924  15.307
  205    HA   PRO  31           HA       PRO  31  -6.216  -5.379  10.310
  206    HB2  PRO  31           HB2      PRO  31  -8.696  -6.609  11.383
  207    HB3  PRO  31           HB1      PRO  31  -7.443  -7.318  10.358
  208    HG2  PRO  31           HG2      PRO  31  -7.646  -7.957  12.944
  209    HG3  PRO  31           HG1      PRO  31  -6.069  -7.806  12.149
  210    HD2  PRO  31           HD2      PRO  31  -7.443  -5.922  14.011
  211    HD3  PRO  31           HD1      PRO  31  -5.720  -6.303  13.861
  212    H    ALA  32           HN       ALA  32  -6.965  -3.829   9.008
  213    HA   ALA  32           HA       ALA  32  -9.336  -2.316   9.822
  214    HB1  ALA  32           HB1      ALA  32  -7.294  -1.666   7.697
  215    HB2  ALA  32           HB2      ALA  32  -7.296  -1.036   9.344
  216    HB3  ALA  32           HB3      ALA  32  -8.607  -0.621   8.240
  217    HA   PRO  33           HA       PRO  33 -11.503  -4.552   6.568
  218    HB2  PRO  33           HB2      PRO  33 -13.885  -3.262   7.590
  219    HB3  PRO  33           HB1      PRO  33 -13.434  -4.964   7.682
  220    HG2  PRO  33           HG2      PRO  33 -13.563  -3.326   9.860
  221    HG3  PRO  33           HG1      PRO  33 -12.488  -4.732   9.762
  222    HD2  PRO  33           HD2      PRO  33 -11.867  -1.835   9.346
  223    HD3  PRO  33           HD1      PRO  33 -10.923  -3.080  10.194
  224    H    GLU  34           HN       GLU  34 -10.805  -1.367   6.956
  225    HA   GLU  34           HA       GLU  34 -12.614  -0.383   4.882
  226    HB2  GLU  34           HB2      GLU  34 -10.675   1.235   6.545
  227    HB3  GLU  34           HB1      GLU  34 -12.040   1.827   5.609
  228    HG2  GLU  34           HG2      GLU  34 -12.196   0.141   8.100
  229    HG3  GLU  34           HG1      GLU  34 -12.511   1.870   7.995
  230    H    GLU  35           HN       GLU  35 -11.795   0.582   2.996
  231    HA   GLU  35           HA       GLU  35  -9.214  -0.446   2.186
  232    HB2  GLU  35           HB2      GLU  35 -11.249   1.151   0.618
  233    HB3  GLU  35           HB1      GLU  35  -9.835   0.343  -0.049
  234    HG2  GLU  35           HG2      GLU  35 -10.822  -1.797   0.907
  235    HG3  GLU  35           HG1      GLU  35 -12.311  -0.876   1.111
  236    H    TRP  36           HN       TRP  36  -7.407   0.670   2.388
  237    HA   TRP  36           HA       TRP  36  -7.433   3.481   3.036
  238    HB2  TRP  36           HB2      TRP  36  -4.887   2.121   2.308
  239    HB3  TRP  36           HB1      TRP  36  -5.217   3.263   3.602
  240    HD1  TRP  36           HD1      TRP  36  -7.368   1.748   5.273
  241    HE1  TRP  36           HE1      TRP  36  -6.772  -0.432   6.504
  242    HE3  TRP  36           HE3      TRP  36  -3.239   0.379   2.561
  243    HZ2  TRP  36           HZ2      TRP  36  -4.785  -2.461   6.346
  244    HZ3  TRP  36           HZ3      TRP  36  -2.079  -1.675   3.166
  245    HH2  TRP  36           HH2      TRP  36  -2.825  -3.072   5.000
  246    H    LEU  37           HN       LEU  37  -5.195   4.439   1.779
  247    HA   LEU  37           HA       LEU  37  -6.208   5.164  -0.788
  248    HB2  LEU  37           HB2      LEU  37  -4.899   6.685   0.645
  249    HB3  LEU  37           HB1      LEU  37  -3.501   5.658   0.455
  250    HG   LEU  37           HG       LEU  37  -3.525   6.137  -1.987
  251   HD11  LEU  37          HD11      LEU  37  -4.855   8.001  -2.809
  252   HD12  LEU  37          HD12      LEU  37  -5.648   8.138  -1.241
  253   HD13  LEU  37          HD13      LEU  37  -5.882   6.694  -2.224
  254   HD21  LEU  37          HD21      LEU  37  -2.602   8.372  -1.800
  255   HD22  LEU  37          HD22      LEU  37  -2.090   7.384  -0.432
  256   HD23  LEU  37          HD23      LEU  37  -3.370   8.580  -0.226
  257    H    ASP  38           HN       ASP  38  -6.169   3.685  -2.403
  258    HA   ASP  38           HA       ASP  38  -4.042   1.817  -2.689
  259    HB2  ASP  38           HB2      ASP  38  -6.406   1.496  -3.566
  260    HB3  ASP  38           HB1      ASP  38  -5.939   2.560  -4.893
  261    H    ILE  39           HN       ILE  39  -2.201   2.003  -3.598
  262    HA   ILE  39           HA       ILE  39  -1.059   4.406  -4.377
  263    HB   ILE  39           HB       ILE  39  -0.205   1.596  -5.066
  264   HG12  ILE  39          HG12      ILE  39   0.170   3.337  -2.651
  265   HG13  ILE  39          HG11      ILE  39  -0.430   1.691  -2.733
  266   HG21  ILE  39          HG21      ILE  39   2.022   2.463  -5.326
  267   HG22  ILE  39          HG22      ILE  39   1.481   4.087  -4.904
  268   HG23  ILE  39          HG23      ILE  39   0.932   3.335  -6.403
  269   HD11  ILE  39          HD11      ILE  39   2.412   2.558  -3.187
  270   HD12  ILE  39          HD12      ILE  39   1.808   0.906  -3.309
  271   HD13  ILE  39          HD13      ILE  39   1.775   1.742  -1.757
  272    H    LEU  40           HN       LEU  40  -2.627   1.907  -6.276
  273    HA   LEU  40           HA       LEU  40  -2.103   3.486  -8.705
  274    HB2  LEU  40           HB2      LEU  40  -2.846   0.572  -8.469
  275    HB3  LEU  40           HB1      LEU  40  -2.493   1.422  -9.961
  276    HG   LEU  40           HG       LEU  40  -0.535   0.873  -7.725
  277   HD11  LEU  40          HD11      LEU  40  -0.755  -0.253 -10.515
  278   HD12  LEU  40          HD12      LEU  40  -1.078  -1.114  -9.009
  279   HD13  LEU  40          HD13      LEU  40   0.556  -0.565  -9.376
  280   HD21  LEU  40          HD21      LEU  40   1.136   1.794  -9.265
  281   HD22  LEU  40          HD22      LEU  40  -0.066   2.997  -8.800
  282   HD23  LEU  40          HD23      LEU  40  -0.151   2.235 -10.387
  283    H    GLY  41           HN       GLY  41  -4.338   3.074  -6.436
  284    HA2  GLY  41           HA2      GLY  41  -6.609   3.252  -6.269
  285    HA3  GLY  41           HA1      GLY  41  -6.568   3.996  -7.857
  286    H    ASN  42           HN       ASN  42  -5.318   0.795  -7.340
  287    HA   ASN  42           HA       ASN  42  -7.419  -0.209  -9.110
  288    HB2  ASN  42           HB2      ASN  42  -6.008  -1.990  -9.716
  289    HB3  ASN  42           HB1      ASN  42  -4.993  -0.568  -9.678
  290   HD21  ASN  42          HD21      ASN  42  -4.646  -0.630  -6.741
  291   HD22  ASN  42          HD22      ASN  42  -3.578  -1.946  -6.448
  292    H    GLY  43           HN       GLY  43  -6.225  -0.633  -5.849
  293    HA2  GLY  43           HA2      GLY  43  -7.938  -1.170  -4.203
  294    HA3  GLY  43           HA1      GLY  43  -8.607  -2.321  -5.357
  295    H    LEU  44           HN       LEU  44  -5.492  -2.696  -5.808
  296    HA   LEU  44           HA       LEU  44  -5.409  -5.062  -4.093
  297    HB2  LEU  44           HB2      LEU  44  -3.904  -4.261  -6.581
  298    HB3  LEU  44           HB1      LEU  44  -3.462  -5.660  -5.628
  299    HG   LEU  44           HG       LEU  44  -5.708  -6.612  -6.075
  300   HD11  LEU  44          HD11      LEU  44  -6.004  -4.312  -7.988
  301   HD12  LEU  44          HD12      LEU  44  -6.943  -4.560  -6.516
  302   HD13  LEU  44          HD13      LEU  44  -7.088  -5.698  -7.855
  303   HD21  LEU  44          HD21      LEU  44  -3.820  -7.292  -7.397
  304   HD22  LEU  44          HD22      LEU  44  -4.057  -5.919  -8.481
  305   HD23  LEU  44          HD23      LEU  44  -5.264  -7.204  -8.405
  306    H    LEU  45           HN       LEU  45  -3.798  -2.049  -4.682
  307    HA   LEU  45           HA       LEU  45  -1.640  -2.779  -2.819
  308    HB2  LEU  45           HB2      LEU  45  -0.658  -2.843  -4.934
  309    HB3  LEU  45           HB1      LEU  45  -1.557  -1.459  -5.500
  310    HG   LEU  45           HG       LEU  45  -0.178   0.012  -4.096
  311   HD11  LEU  45          HD11      LEU  45   1.330  -2.513  -3.440
  312   HD12  LEU  45          HD12      LEU  45   0.367  -1.553  -2.318
  313   HD13  LEU  45          HD13      LEU  45   1.833  -0.872  -3.025
  314   HD21  LEU  45          HD21      LEU  45   1.357  -1.839  -5.907
  315   HD22  LEU  45          HD22      LEU  45   1.874  -0.226  -5.406
  316   HD23  LEU  45          HD23      LEU  45   0.428  -0.420  -6.401
  317    H    ARG  46           HN       ARG  46  -2.181  -1.638  -0.984
  318    HA   ARG  46           HA       ARG  46  -2.880   1.226  -1.307
  319    HB2  ARG  46           HB2      ARG  46  -4.239  -0.693   0.589
  320    HB3  ARG  46           HB1      ARG  46  -4.660   0.988   0.307
  321    HG2  ARG  46           HG2      ARG  46  -5.425   0.510  -1.896
  322    HG3  ARG  46           HG1      ARG  46  -4.797  -1.136  -1.811
  323    HD2  ARG  46           HD2      ARG  46  -7.031   0.011  -0.142
  324    HD3  ARG  46           HD1      ARG  46  -7.213  -1.090  -1.509
  325    HE   ARG  46           HE       ARG  46  -5.479  -2.190   0.456
  326   HH11  ARG  46          HH11      ARG  46  -8.856  -1.753  -0.364
  327   HH12  ARG  46          HH12      ARG  46  -9.400  -3.018   0.698
  328   HH21  ARG  46          HH21      ARG  46  -6.199  -3.848   1.834
  329   HH22  ARG  46          HH22      ARG  46  -7.892  -4.200   1.944
  330    H    LYS  47           HN       LYS  47  -2.095   2.591   0.294
  331    HA   LYS  47           HA       LYS  47  -0.300   1.330   2.280
  332    HB2  LYS  47           HB2      LYS  47   0.581   2.936   0.386
  333    HB3  LYS  47           HB1      LYS  47  -0.061   4.203   1.420
  334    HG2  LYS  47           HG2      LYS  47   1.353   2.951   3.259
  335    HG3  LYS  47           HG1      LYS  47   2.247   2.378   1.847
  336    HD2  LYS  47           HD2      LYS  47   3.251   4.376   2.843
  337    HD3  LYS  47           HD1      LYS  47   2.723   4.634   1.194
  338    HE2  LYS  47           HE2      LYS  47   0.890   5.957   1.864
  339    HE3  LYS  47           HE1      LYS  47   1.004   5.397   3.532
  340    HZ1  LYS  47           HZ1      LYS  47   1.837   7.684   3.178
  341    HZ2  LYS  47           HZ2      LYS  47   3.068   7.073   2.200
  342    HZ3  LYS  47           HZ3      LYS  47   3.004   6.656   3.847
  343    H    LYS  48           HN       LYS  48  -0.942   1.513   4.357
  344    HA   LYS  48           HA       LYS  48  -2.819   3.664   5.063
  345    HB2  LYS  48           HB2      LYS  48  -3.369   1.284   5.726
  346    HB3  LYS  48           HB1      LYS  48  -1.970   1.333   6.795
  347    HG2  LYS  48           HG2      LYS  48  -3.172   3.533   7.657
  348    HG3  LYS  48           HG1      LYS  48  -4.593   2.698   7.040
  349    HD2  LYS  48           HD2      LYS  48  -2.649   1.652   9.094
  350    HD3  LYS  48           HD1      LYS  48  -4.278   2.246   9.412
  351    HE2  LYS  48           HE2      LYS  48  -5.026   0.401   7.773
  352    HE3  LYS  48           HE1      LYS  48  -3.411  -0.262   8.031
  353    HZ1  LYS  48           HZ1      LYS  48  -5.447   0.261  10.134
  354    HZ2  LYS  48           HZ2      LYS  48  -3.871  -0.304  10.429
  355    HZ3  LYS  48           HZ3      LYS  48  -4.964  -1.258   9.559
  356    H    THR  49           HN       THR  49  -2.020   5.427   5.991
  357    HA   THR  49           HA       THR  49   0.633   5.523   7.063
  358    HB   THR  49           HB       THR  49  -0.186   7.856   7.815
  359    HG1  THR  49           HG1      THR  49  -2.442   7.331   7.581
  360   HG21  THR  49          HG21      THR  49   1.279   7.532   5.912
  361   HG22  THR  49          HG22      THR  49   0.052   8.734   5.519
  362   HG23  THR  49          HG23      THR  49  -0.093   7.094   4.896
  363    H    LEU  50           HN       LEU  50   0.852   4.233   8.846
  364    HA   LEU  50           HA       LEU  50  -0.908   4.294  11.097
  365    HB2  LEU  50           HB2      LEU  50   2.059   3.792  11.230
  366    HB3  LEU  50           HB1      LEU  50   0.796   3.103  12.236
  367    HG   LEU  50           HG       LEU  50   1.063   2.488   9.302
  368   HD11  LEU  50          HD11      LEU  50   2.156   0.406   9.994
  369   HD12  LEU  50          HD12      LEU  50   2.209   1.003  11.656
  370   HD13  LEU  50          HD13      LEU  50   3.111   1.837  10.385
  371   HD21  LEU  50          HD21      LEU  50  -0.300   0.541   9.894
  372   HD22  LEU  50          HD22      LEU  50  -1.121   2.055  10.267
  373   HD23  LEU  50          HD23      LEU  50  -0.384   1.113  11.561
  374    H    VAL  51           HN       VAL  51   2.287   5.580  10.526
  375    HA   VAL  51           HA       VAL  51   1.493   8.176  11.674
  376    HB   VAL  51           HB       VAL  51   4.234   6.923  11.764
  377   HG11  VAL  51          HG11      VAL  51   3.236   9.513  12.942
  378   HG12  VAL  51          HG12      VAL  51   4.301   9.344  11.545
  379   HG13  VAL  51          HG13      VAL  51   4.858   8.849  13.144
  380   HG21  VAL  51          HG21      VAL  51   2.255   7.373  13.988
  381   HG22  VAL  51          HG22      VAL  51   3.924   6.849  14.214
  382   HG23  VAL  51          HG23      VAL  51   2.785   5.818  13.347
  383    HA   PRO  52           HA       PRO  52   3.005   8.998   7.534
  384    HB2  PRO  52           HB2      PRO  52   1.431  11.039   7.028
  385    HB3  PRO  52           HB1      PRO  52   0.730   9.462   7.437
  386    HG2  PRO  52           HG2      PRO  52   0.970  11.912   9.132
  387    HG3  PRO  52           HG1      PRO  52  -0.338  10.716   9.069
  388    HD2  PRO  52           HD2      PRO  52   1.893  10.792  10.867
  389    HD3  PRO  52           HD1      PRO  52   0.634   9.542  10.756
  390    H    GLY  53           HN       GLY  53   5.021   9.643   9.149
  391    HA2  GLY  53           HA2      GLY  53   6.898  10.960   9.058
  392    HA3  GLY  53           HA1      GLY  53   6.048  12.023   7.949
  393    HA   PRO  54           HA       PRO  54   6.237  13.928  12.335
  394    HB2  PRO  54           HB2      PRO  54   8.569  15.331  12.100
  395    HB3  PRO  54           HB1      PRO  54   8.470  13.750  12.882
  396    HG2  PRO  54           HG2      PRO  54   9.376  14.446  10.121
  397    HG3  PRO  54           HG1      PRO  54  10.057  13.271  11.262
  398    HD2  PRO  54           HD2      PRO  54   8.467  12.547   9.188
  399    HD3  PRO  54           HD1      PRO  54   8.509  11.657  10.720
  400    HA   PRO  55           HA       PRO  55   4.614  17.606  10.456
  401    HB2  PRO  55           HB2      PRO  55   5.706  19.580  12.084
  402    HB3  PRO  55           HB1      PRO  55   4.214  18.694  12.412
  403    HG2  PRO  55           HG2      PRO  55   6.970  18.233  13.470
  404    HG3  PRO  55           HG1      PRO  55   5.409  18.082  14.300
  405    HD2  PRO  55           HD2      PRO  55   6.756  15.923  13.470
  406    HD3  PRO  55           HD1      PRO  55   4.984  15.995  13.380
  407    H    GLY  56           HN       GLY  56   5.669  17.637   8.490
  408    HA2  GLY  56           HA2      GLY  56   6.841  18.991   6.953
  409    HA3  GLY  56           HA1      GLY  56   7.842  19.580   8.270
  410    H    SER  57           HN       SER  57   7.106  16.275   7.120
  411    HA   SER  57           HA       SER  57   9.890  15.574   7.133
  412    HB2  SER  57           HB2      SER  57   8.645  13.452   6.021
  413    HB3  SER  57           HB1      SER  57   8.669  13.731   7.766
  414    HG   SER  57           HG       SER  57   6.609  14.052   5.898
  415    H    SER  58           HN       SER  58   9.973  13.889   4.884
  416    HA   SER  58           HA       SER  58   9.358  15.469   2.536
  417    HB2  SER  58           HB2      SER  58  11.543  16.373   3.357
  418    HB3  SER  58           HB1      SER  58  12.228  14.754   3.217
  419    HG   SER  58           HG       SER  58  11.015  16.124   1.047
  420    H    ARG  59           HN       ARG  59   8.787  14.063   0.945
  421    HA   ARG  59           HA       ARG  59   9.360  11.251   1.401
  422    HB2  ARG  59           HB2      ARG  59   7.847  11.063  -0.735
  423    HB3  ARG  59           HB1      ARG  59   7.147  11.356   0.850
  424    HG2  ARG  59           HG2      ARG  59   7.020  13.756   0.330
  425    HG3  ARG  59           HG1      ARG  59   7.677  13.427  -1.276
  426    HD2  ARG  59           HD2      ARG  59   5.779  12.281  -1.955
  427    HD3  ARG  59           HD1      ARG  59   5.250  11.980  -0.301
  428    HE   ARG  59           HE       ARG  59   5.257  14.746  -0.771
  429   HH11  ARG  59          HH11      ARG  59   3.505  11.864  -1.700
  430   HH12  ARG  59          HH12      ARG  59   2.000  12.696  -1.933
  431   HH21  ARG  59          HH21      ARG  59   3.276  15.841  -1.060
  432   HH22  ARG  59          HH22      ARG  59   1.857  14.948  -1.531
  433    HA   PRO  60           HA       PRO  60  12.948  11.223  -1.193
  434    HB2  PRO  60           HB2      PRO  60  12.735   8.472  -1.673
  435    HB3  PRO  60           HB1      PRO  60  13.628   9.238  -0.358
  436    HG2  PRO  60           HG2      PRO  60  10.879   8.077  -0.356
  437    HG3  PRO  60           HG1      PRO  60  12.134   8.003   0.898
  438    HD2  PRO  60           HD2      PRO  60  10.080   9.658   1.176
  439    HD3  PRO  60           HD1      PRO  60  11.717  10.191   1.610
  440    H    VAL  61           HN       VAL  61  13.503  10.978  -3.313
  441    HA   VAL  61           HA       VAL  61  11.291  10.695  -5.217
  442    HB   VAL  61           HB       VAL  61  14.090  11.717  -5.739
  443   HG11  VAL  61          HG11      VAL  61  13.090  12.742  -7.734
  444   HG12  VAL  61          HG12      VAL  61  11.550  11.977  -7.338
  445   HG13  VAL  61          HG13      VAL  61  12.948  10.983  -7.750
  446   HG21  VAL  61          HG21      VAL  61  11.602  13.303  -5.135
  447   HG22  VAL  61          HG22      VAL  61  13.160  13.970  -5.617
  448   HG23  VAL  61          HG23      VAL  61  13.002  13.126  -4.078
  449    H    LYS  62           HN       LYS  62  11.632   9.395  -7.136
  450    HA   LYS  62           HA       LYS  62  12.830   6.899  -6.633
  451    HB2  LYS  62           HB2      LYS  62  11.785   8.123  -9.175
  452    HB3  LYS  62           HB1      LYS  62  12.421   6.484  -9.092
  453    HG2  LYS  62           HG2      LYS  62  10.730   5.992  -7.333
  454    HG3  LYS  62           HG1      LYS  62  10.035   7.586  -7.636
  455    HD2  LYS  62           HD2      LYS  62   9.616   6.975  -9.958
  456    HD3  LYS  62           HD1      LYS  62  10.348   5.393  -9.678
  457    HE2  LYS  62           HE2      LYS  62   8.613   4.923  -7.984
  458    HE3  LYS  62           HE1      LYS  62   7.857   6.471  -8.357
  459    HZ1  LYS  62           HZ1      LYS  62   7.746   5.595 -10.728
  460    HZ2  LYS  62           HZ2      LYS  62   6.674   4.920  -9.604
  461    HZ3  LYS  62           HZ3      LYS  62   8.070   4.067 -10.065
  462    H    GLY  63           HN       GLY  63  14.883   6.622  -6.406
  463    HA2  GLY  63           HA2      GLY  63  16.913   6.515  -8.004
  464    HA3  GLY  63           HA1      GLY  63  16.760   8.269  -7.941
  465    H    GLN  64           HN       GLN  64  15.749   8.057  -5.138
  466    HA   GLN  64           HA       GLN  64  18.378   8.099  -3.887
  467    HB2  GLN  64           HB2      GLN  64  15.882   8.317  -2.268
  468    HB3  GLN  64           HB1      GLN  64  17.414   9.176  -2.092
  469    HG2  GLN  64           HG2      GLN  64  15.299   9.701  -4.164
  470    HG3  GLN  64           HG1      GLN  64  15.599  10.658  -2.721
  471   HE21  GLN  64          HE21      GLN  64  18.109   9.363  -4.865
  472   HE22  GLN  64          HE22      GLN  64  18.653  10.907  -5.420
  473    H    VAL  65           HN       VAL  65  19.206   6.561  -2.540
  474    HA   VAL  65           HA       VAL  65  17.733   4.083  -2.311
  475    HB   VAL  65           HB       VAL  65  19.634   3.078  -1.363
  476   HG11  VAL  65          HG11      VAL  65  20.639   5.127  -3.326
  477   HG12  VAL  65          HG12      VAL  65  19.915   3.567  -3.712
  478   HG13  VAL  65          HG13      VAL  65  21.467   3.633  -2.880
  479   HG21  VAL  65          HG21      VAL  65  20.180   4.556   0.401
  480   HG22  VAL  65          HG22      VAL  65  20.655   5.833  -0.726
  481   HG23  VAL  65          HG23      VAL  65  21.624   4.365  -0.596
  482    H    VAL  66           HN       VAL  66  16.684   3.395  -0.549
  483    HA   VAL  66           HA       VAL  66  16.607   5.196   1.763
  484    HB   VAL  66           HB       VAL  66  14.147   4.702   1.933
  485   HG11  VAL  66          HG11      VAL  66  13.505   6.270   0.090
  486   HG12  VAL  66          HG12      VAL  66  15.172   6.188  -0.482
  487   HG13  VAL  66          HG13      VAL  66  14.819   6.849   1.114
  488   HG21  VAL  66          HG21      VAL  66  12.969   3.839   0.065
  489   HG22  VAL  66          HG22      VAL  66  14.278   2.711   0.412
  490   HG23  VAL  66          HG23      VAL  66  14.420   3.845  -0.934
  491    H    THR  67           HN       THR  67  16.424   4.275   3.727
  492    HA   THR  67           HA       THR  67  16.637   1.369   3.848
  493    HB   THR  67           HB       THR  67  17.055   1.741   6.277
  494    HG1  THR  67           HG1      THR  67  15.880   3.885   6.105
  495   HG21  THR  67          HG21      THR  67  18.942   1.638   4.709
  496   HG22  THR  67          HG22      THR  67  19.264   2.729   6.057
  497   HG23  THR  67          HG23      THR  67  18.836   3.384   4.474
  498    H    VAL  68           HN       VAL  68  14.711   0.337   3.859
  499    HA   VAL  68           HA       VAL  68  12.632   1.535   5.541
  500    HB   VAL  68           HB       VAL  68  10.998   0.018   4.398
  501   HG11  VAL  68          HG11      VAL  68  12.508   1.893   2.575
  502   HG12  VAL  68          HG12      VAL  68  11.239   2.351   3.711
  503   HG13  VAL  68          HG13      VAL  68  10.859   1.315   2.335
  504   HG21  VAL  68          HG21      VAL  68  12.499  -1.702   3.619
  505   HG22  VAL  68          HG22      VAL  68  13.364  -0.545   2.608
  506   HG23  VAL  68          HG23      VAL  68  11.695  -0.971   2.231
  507    H    HIS  69           HN       HIS  69  11.776   0.396   7.199
  508    HA   HIS  69           HA       HIS  69  12.906  -2.283   7.667
  509    HB2  HIS  69           HB2      HIS  69  13.091  -0.779   9.601
  510    HB3  HIS  69           HB1      HIS  69  11.373  -0.422   9.524
  511    HD1  HIS  69           HD1      HIS  69  13.126  -2.004  11.914
  512    HD2  HIS  69           HD2      HIS  69  10.333  -3.507   9.250
  513    HE1  HIS  69           HE1      HIS  69  12.213  -4.157  12.930
  514    HE2  HIS  69           HE2      HIS  69  10.359  -4.830  11.452
  515    H    LEU  70           HN       LEU  70  11.661  -3.902   6.888
  516    HA   LEU  70           HA       LEU  70   8.779  -3.439   7.030
  517    HB2  LEU  70           HB2      LEU  70   8.320  -4.373   4.992
  518    HB3  LEU  70           HB1      LEU  70   9.809  -3.515   4.655
  519    HG   LEU  70           HG       LEU  70   9.892  -6.387   5.438
  520   HD11  LEU  70          HD11      LEU  70   8.255  -6.219   3.611
  521   HD12  LEU  70          HD12      LEU  70   9.733  -7.030   3.096
  522   HD13  LEU  70          HD13      LEU  70   9.441  -5.351   2.635
  523   HD21  LEU  70          HD21      LEU  70  11.618  -4.579   3.745
  524   HD22  LEU  70          HD22      LEU  70  11.888  -6.311   3.939
  525   HD23  LEU  70          HD23      LEU  70  12.002  -5.239   5.335
  526    H    GLN  71           HN       GLN  71   7.622  -4.910   7.945
  527    HA   GLN  71           HA       GLN  71   8.561  -7.688   8.083
  528    HB2  GLN  71           HB2      GLN  71   6.773  -6.840  10.263
  529    HB3  GLN  71           HB1      GLN  71   8.100  -7.988  10.298
  530    HG2  GLN  71           HG2      GLN  71   8.961  -6.417  11.648
  531    HG3  GLN  71           HG1      GLN  71   9.557  -5.827  10.102
  532   HE21  GLN  71          HE21      GLN  71   6.793  -4.949   9.395
  533   HE22  GLN  71          HE22      GLN  71   6.611  -3.456  10.234
  534    H    THR  72           HN       THR  72   7.233  -8.809   7.006
  535    HA   THR  72           HA       THR  72   4.786  -7.464   6.160
  536    HB   THR  72           HB       THR  72   6.434  -9.572   4.796
  537    HG1  THR  72           HG1      THR  72   7.047  -7.801   3.442
  538   HG21  THR  72          HG21      THR  72   4.116  -9.685   4.143
  539   HG22  THR  72          HG22      THR  72   5.079  -9.010   2.831
  540   HG23  THR  72          HG23      THR  72   4.094  -7.947   3.836
  541    H    SER  73           HN       SER  73   2.904  -8.346   6.504
  542    HA   SER  73           HA       SER  73   2.822 -11.044   7.631
  543    HB2  SER  73           HB2      SER  73   1.869  -8.943   8.861
  544    HB3  SER  73           HB1      SER  73   0.565  -9.044   7.678
  545    HG   SER  73           HG       SER  73   0.301 -10.204   9.766
  546    H    LEU  74           HN       LEU  74   0.633 -12.079   7.111
  547    HA   LEU  74           HA       LEU  74   0.308 -11.997   4.207
  548    HB2  LEU  74           HB2      LEU  74  -0.220 -14.104   6.275
  549    HB3  LEU  74           HB1      LEU  74  -0.853 -14.237   4.651
  550    HG   LEU  74           HG       LEU  74   1.977 -14.374   5.602
  551   HD11  LEU  74          HD11      LEU  74   0.743 -16.449   5.449
  552   HD12  LEU  74          HD12      LEU  74   2.009 -16.387   4.221
  553   HD13  LEU  74          HD13      LEU  74   0.327 -16.099   3.772
  554   HD21  LEU  74          HD21      LEU  74   1.079 -13.812   2.792
  555   HD22  LEU  74          HD22      LEU  74   2.719 -14.237   3.280
  556   HD23  LEU  74          HD23      LEU  74   1.994 -12.730   3.845
  557    H    GLU  75           HN       GLU  75  -1.940 -12.372   3.414
  558    HA   GLU  75           HA       GLU  75  -3.777 -10.575   4.434
  559    HB2  GLU  75           HB2      GLU  75  -5.458 -11.763   3.061
  560    HB3  GLU  75           HB1      GLU  75  -3.970 -11.428   2.188
  561    HG2  GLU  75           HG2      GLU  75  -3.258 -13.738   2.505
  562    HG3  GLU  75           HG1      GLU  75  -4.748 -14.075   3.390
  563    H    ASN  76           HN       ASN  76  -3.006 -13.768   5.466
  564    HA   ASN  76           HA       ASN  76  -5.427 -14.103   7.030
  565    HB2  ASN  76           HB2      ASN  76  -4.433 -16.275   7.677
  566    HB3  ASN  76           HB1      ASN  76  -4.518 -16.059   5.940
  567   HD21  ASN  76          HD21      ASN  76  -2.730 -16.204   4.747
  568   HD22  ASN  76          HD22      ASN  76  -1.144 -16.422   5.398
  569    H    GLY  77           HN       GLY  77  -2.481 -12.557   7.446
  570    HA2  GLY  77           HA2      GLY  77  -2.118 -11.246   9.390
  571    HA3  GLY  77           HA1      GLY  77  -3.010 -12.433  10.325
  572    H    THR  78           HN       THR  78  -0.819 -13.958   8.257
  573    HA   THR  78           HA       THR  78   1.017 -14.327  10.496
  574    HB   THR  78           HB       THR  78   0.774 -15.884   7.930
  575    HG1  THR  78           HG1      THR  78  -0.883 -16.598   9.088
  576   HG21  THR  78          HG21      THR  78   2.286 -17.502   8.948
  577   HG22  THR  78          HG22      THR  78   2.456 -16.471  10.370
  578   HG23  THR  78          HG23      THR  78   3.071 -15.928   8.807
  579    H    ARG  79           HN       ARG  79   2.692 -13.011  10.616
  580    HA   ARG  79           HA       ARG  79   3.851 -11.692   8.360
  581    HB2  ARG  79           HB2      ARG  79   4.759 -12.001  11.215
  582    HB3  ARG  79           HB1      ARG  79   5.665 -11.095  10.003
  583    HG2  ARG  79           HG2      ARG  79   3.314  -9.964   9.628
  584    HG3  ARG  79           HG1      ARG  79   3.080 -10.460  11.307
  585    HD2  ARG  79           HD2      ARG  79   5.090  -9.279  11.966
  586    HD3  ARG  79           HD1      ARG  79   5.419  -8.848  10.281
  587    HE   ARG  79           HE       ARG  79   2.896  -7.852  10.881
  588   HH11  ARG  79          HH11      ARG  79   6.136  -7.390  12.127
  589   HH12  ARG  79          HH12      ARG  79   5.899  -5.705  12.477
  590   HH21  ARG  79          HH21      ARG  79   2.575  -5.621  11.382
  591   HH22  ARG  79          HH22      ARG  79   3.907  -4.698  12.036
  592    H    VAL  80           HN       VAL  80   5.351 -12.302   7.043
  593    HA   VAL  80           HA       VAL  80   6.370 -15.029   7.380
  594    HB   VAL  80           HB       VAL  80   6.476 -15.075   4.909
  595   HG11  VAL  80          HG11      VAL  80   4.546 -15.964   6.108
  596   HG12  VAL  80          HG12      VAL  80   4.072 -15.259   4.562
  597   HG13  VAL  80          HG13      VAL  80   3.785 -14.373   6.060
  598   HG21  VAL  80          HG21      VAL  80   5.070 -12.416   5.104
  599   HG22  VAL  80          HG22      VAL  80   5.336 -13.337   3.622
  600   HG23  VAL  80          HG23      VAL  80   6.709 -12.674   4.512
  601    H    GLN  81           HN       GLN  81   7.334 -11.774   7.032
  602    HA   GLN  81           HA       GLN  81  10.118 -12.572   6.853
  603    HB2  GLN  81           HB2      GLN  81  10.548 -10.969   4.990
  604    HB3  GLN  81           HB1      GLN  81   9.552 -12.338   4.520
  605    HG2  GLN  81           HG2      GLN  81   7.554 -10.839   4.897
  606    HG3  GLN  81           HG1      GLN  81   8.694  -9.499   4.991
  607   HE21  GLN  81          HE21      GLN  81   7.094 -11.776   3.000
  608   HE22  GLN  81          HE22      GLN  81   7.591 -11.128   1.476
  609    H    GLU  82           HN       GLU  82  11.229 -11.454   8.310
  610    HA   GLU  82           HA       GLU  82  10.226  -8.783   9.037
  611    HB2  GLU  82           HB2      GLU  82  10.012 -10.555  10.814
  612    HB3  GLU  82           HB1      GLU  82  11.766 -10.636  10.848
  613    HG2  GLU  82           HG2      GLU  82  11.987  -8.638  11.901
  614    HG3  GLU  82           HG1      GLU  82  10.517  -7.976  11.186
  615    H    GLU  83           HN       GLU  83  11.503  -7.212   8.460
  616    HA   GLU  83           HA       GLU  83  14.390  -7.648   8.292
  617    HB2  GLU  83           HB2      GLU  83  13.590  -8.013   6.056
  618    HB3  GLU  83           HB1      GLU  83  12.551  -6.601   6.139
  619    HG2  GLU  83           HG2      GLU  83  14.368  -6.032   4.763
  620    HG3  GLU  83           HG1      GLU  83  14.624  -5.209   6.305
  621    HA   PRO  84           HA       PRO  84  13.919  -3.852  10.626
  622    HB2  PRO  84           HB2      PRO  84  16.807  -4.144  11.063
  623    HB3  PRO  84           HB1      PRO  84  15.491  -4.127  12.239
  624    HG2  PRO  84           HG2      PRO  84  16.872  -6.373  11.652
  625    HG3  PRO  84           HG1      PRO  84  15.157  -6.397  12.103
  626    HD2  PRO  84           HD2      PRO  84  16.406  -6.605   9.389
  627    HD3  PRO  84           HD1      PRO  84  15.023  -7.494  10.064
  628    H    GLU  85           HN       GLU  85  16.014  -4.507   7.927
  629    HA   GLU  85           HA       GLU  85  15.820  -1.787   7.119
  630    HB2  GLU  85           HB2      GLU  85  17.589  -1.572   8.817
  631    HB3  GLU  85           HB1      GLU  85  18.554  -2.767   7.967
  632    HG2  GLU  85           HG2      GLU  85  19.020  -1.328   6.211
  633    HG3  GLU  85           HG1      GLU  85  17.662  -0.271   6.591
  634    H    LEU  86           HN       LEU  86  15.361  -2.020   5.179
  635    HA   LEU  86           HA       LEU  86  17.086  -3.609   3.421
  636    HB2  LEU  86           HB2      LEU  86  14.844  -4.541   3.493
  637    HB3  LEU  86           HB1      LEU  86  14.141  -2.962   3.228
  638    HG   LEU  86           HG       LEU  86  15.184  -2.894   1.017
  639   HD11  LEU  86          HD11      LEU  86  15.912  -5.767   1.580
  640   HD12  LEU  86          HD12      LEU  86  17.039  -4.421   1.402
  641   HD13  LEU  86          HD13      LEU  86  16.072  -4.947   0.025
  642   HD21  LEU  86          HD21      LEU  86  13.378  -5.257   1.520
  643   HD22  LEU  86          HD22      LEU  86  13.637  -4.477  -0.037
  644   HD23  LEU  86          HD23      LEU  86  12.869  -3.588   1.274
  645    H    VAL  87           HN       VAL  87  18.423  -2.179   2.451
  646    HA   VAL  87           HA       VAL  87  17.371   0.471   1.735
  647    HB   VAL  87           HB       VAL  87  19.507   0.366   3.015
  648   HG11  VAL  87          HG11      VAL  87  20.647  -0.834   0.501
  649   HG12  VAL  87          HG12      VAL  87  20.412  -1.685   2.028
  650   HG13  VAL  87          HG13      VAL  87  21.556  -0.345   1.932
  651   HG21  VAL  87          HG21      VAL  87  20.747   1.944   1.589
  652   HG22  VAL  87          HG22      VAL  87  19.023   2.307   1.667
  653   HG23  VAL  87          HG23      VAL  87  19.693   1.519   0.239
  654    H    PHE  88           HN       PHE  88  17.177   1.099  -0.362
  655    HA   PHE  88           HA       PHE  88  18.330  -0.402  -2.550
  656    HB2  PHE  88           HB2      PHE  88  16.255  -1.120  -3.550
  657    HB3  PHE  88           HB1      PHE  88  16.334  -1.760  -1.912
  658    HD1  PHE  88           HD2      PHE  88  15.000  -0.668  -0.107
  659    HD2  PHE  88           HD1      PHE  88  14.515   0.312  -4.224
  660    HE1  PHE  88           HE2      PHE  88  12.809   0.330   0.392
  661    HE2  PHE  88           HE1      PHE  88  12.323   1.302  -3.733
  662    HZ   PHE  88           HZ       PHE  88  11.462   1.305  -1.439
  663    H    THR  89           HN       THR  89  17.980   0.613  -4.593
  664    HA   THR  89           HA       THR  89  17.612   3.457  -4.444
  665    HB   THR  89           HB       THR  89  17.841   1.722  -6.914
  666    HG1  THR  89           HG1      THR  89  19.650   1.359  -5.630
  667   HG21  THR  89          HG21      THR  89  17.069   4.020  -7.329
  668   HG22  THR  89          HG22      THR  89  18.687   3.759  -7.972
  669   HG23  THR  89          HG23      THR  89  18.475   4.647  -6.465
  670    H    LEU  90           HN       LEU  90  15.686   4.400  -4.437
  671    HA   LEU  90           HA       LEU  90  13.242   3.103  -4.922
  672    HB2  LEU  90           HB2      LEU  90  13.701   5.250  -3.633
  673    HB3  LEU  90           HB1      LEU  90  13.706   6.057  -5.164
  674    HG   LEU  90           HG       LEU  90  11.405   5.409  -5.579
  675   HD11  LEU  90          HD11      LEU  90  11.511   4.139  -2.849
  676   HD12  LEU  90          HD12      LEU  90  11.514   3.257  -4.373
  677   HD13  LEU  90          HD13      LEU  90  10.112   4.224  -3.919
  678   HD21  LEU  90          HD21      LEU  90  10.348   6.780  -3.871
  679   HD22  LEU  90          HD22      LEU  90  11.886   7.493  -4.353
  680   HD23  LEU  90          HD23      LEU  90  11.762   6.608  -2.833
  681    H    GLY  91           HN       GLY  91  12.091   2.737  -6.751
  682    HA2  GLY  91           HA2      GLY  91  11.296   3.127  -8.908
  683    HA3  GLY  91           HA1      GLY  91  12.487   4.403  -9.099
  684    H    ASP  92           HN       ASP  92  14.202   1.946  -7.882
  685    HA   ASP  92           HA       ASP  92  15.315   1.299 -10.481
  686    HB2  ASP  92           HB2      ASP  92  16.790   1.838  -8.556
  687    HB3  ASP  92           HB1      ASP  92  16.183   0.407  -7.724
  688    H    CYS  93           HN       CYS  93  13.005   0.122  -8.396
  689    HA   CYS  93           HA       CYS  93  11.840  -1.807  -8.195
  690    HB2  CYS  93           HB2      CYS  93  13.076  -2.635 -10.826
  691    HB3  CYS  93           HB1      CYS  93  11.554  -3.193 -10.129
  692    HG   CYS  93           HG       CYS  93  11.836   0.122 -10.739
  693    H    ASP  94           HN       ASP  94  14.548  -1.504  -7.211
  694    HA   ASP  94           HA       ASP  94  15.997  -3.906  -7.351
  695    HB2  ASP  94           HB2      ASP  94  16.891  -1.783  -6.409
  696    HB3  ASP  94           HB1      ASP  94  15.789  -1.945  -5.049
  697    H    VAL  95           HN       VAL  95  13.165  -2.928  -5.831
  698    HA   VAL  95           HA       VAL  95  13.003  -5.295  -4.083
  699    HB   VAL  95           HB       VAL  95  11.329  -3.877  -2.830
  700   HG11  VAL  95          HG11      VAL  95  13.652  -4.184  -2.095
  701   HG12  VAL  95          HG12      VAL  95  13.035  -2.582  -1.687
  702   HG13  VAL  95          HG13      VAL  95  14.125  -2.785  -3.059
  703   HG21  VAL  95          HG21      VAL  95  12.472  -1.741  -4.640
  704   HG22  VAL  95          HG22      VAL  95  11.473  -1.432  -3.215
  705   HG23  VAL  95          HG23      VAL  95  10.797  -2.299  -4.594
  706    H    ILE  96           HN       ILE  96  10.267  -4.936  -3.514
  707    HA   ILE  96           HA       ILE  96   9.038  -5.926  -5.926
  708    HB   ILE  96           HB       ILE  96   7.060  -6.287  -4.499
  709   HG12  ILE  96          HG12      ILE  96   8.785  -5.172  -2.265
  710   HG13  ILE  96          HG11      ILE  96   7.386  -4.365  -2.970
  711   HG21  ILE  96          HG21      ILE  96   9.636  -7.312  -3.321
  712   HG22  ILE  96          HG22      ILE  96   8.742  -8.024  -4.665
  713   HG23  ILE  96          HG23      ILE  96   8.039  -8.005  -3.046
  714   HD11  ILE  96          HD11      ILE  96   7.349  -6.973  -1.463
  715   HD12  ILE  96          HD12      ILE  96   5.949  -6.170  -2.173
  716   HD13  ILE  96          HD13      ILE  96   6.829  -5.403  -0.850
  717    H    GLN  97           HN       GLN  97   7.475  -4.825  -7.041
  718    HA   GLN  97           HA       GLN  97   7.849  -2.062  -7.177
  719    HB2  GLN  97           HB2      GLN  97   6.776  -3.858  -8.869
  720    HB3  GLN  97           HB1      GLN  97   5.307  -3.100  -8.265
  721    HG2  GLN  97           HG2      GLN  97   5.885  -1.885 -10.178
  722    HG3  GLN  97           HG1      GLN  97   6.384  -0.884  -8.815
  723   HE21  GLN  97          HE21      GLN  97   8.641  -0.658  -8.366
  724   HE22  GLN  97          HE22      GLN  97   9.821  -1.021  -9.574
  725    H    ALA  98           HN       ALA  98   5.538  -3.962  -5.381
  726    HA   ALA  98           HA       ALA  98   3.676  -2.015  -4.657
  727    HB1  ALA  98           HB1      ALA  98   4.810  -4.201  -2.919
  728    HB2  ALA  98           HB2      ALA  98   3.479  -4.386  -4.056
  729    HB3  ALA  98           HB3      ALA  98   3.296  -3.338  -2.651
  730    H    LEU  99           HN       LEU  99   6.839  -2.765  -3.355
  731    HA   LEU  99           HA       LEU  99   6.663  -0.801  -1.258
  732    HB2  LEU  99           HB2      LEU  99   8.000  -2.854  -0.993
  733    HB3  LEU  99           HB1      LEU  99   9.058  -2.303  -2.291
  734    HG   LEU  99           HG       LEU  99   9.693  -0.350  -0.935
  735   HD11  LEU  99          HD11      LEU  99   7.661  -0.107   0.366
  736   HD12  LEU  99          HD12      LEU  99   9.066  -0.242   1.427
  737   HD13  LEU  99          HD13      LEU  99   7.993  -1.625   1.198
  738   HD21  LEU  99          HD21      LEU  99  11.056  -2.358  -0.831
  739   HD22  LEU  99          HD22      LEU  99  10.058  -2.979   0.485
  740   HD23  LEU  99          HD23      LEU  99  11.032  -1.527   0.724
  741    H    ASP 100           HN       ASP 100   8.116  -1.108  -4.397
  742    HA   ASP 100           HA       ASP 100   9.894   1.059  -4.285
  743    HB2  ASP 100           HB2      ASP 100   9.996  -0.822  -5.895
  744    HB3  ASP 100           HB1      ASP 100   8.564  -0.207  -6.691
  745    H    LEU 101           HN       LEU 101   6.518   0.770  -5.052
  746    HA   LEU 101           HA       LEU 101   6.305   3.549  -5.837
  747    HB2  LEU 101           HB2      LEU 101   4.183   1.438  -5.475
  748    HB3  LEU 101           HB1      LEU 101   3.965   3.001  -6.218
  749    HG   LEU 101           HG       LEU 101   5.600   0.710  -7.278
  750   HD11  LEU 101          HD11      LEU 101   4.018   0.770  -9.141
  751   HD12  LEU 101          HD12      LEU 101   3.114   2.044  -8.323
  752   HD13  LEU 101          HD13      LEU 101   3.224   0.439  -7.601
  753   HD21  LEU 101          HD21      LEU 101   6.797   2.729  -7.771
  754   HD22  LEU 101          HD22      LEU 101   5.325   3.508  -8.350
  755   HD23  LEU 101          HD23      LEU 101   6.016   2.153  -9.243
  756    H    SER 102           HN       SER 102   5.622   1.523  -3.054
  757    HA   SER 102           HA       SER 102   3.839   3.284  -1.748
  758    HB2  SER 102           HB2      SER 102   3.893   0.962  -1.088
  759    HB3  SER 102           HB1      SER 102   5.595   1.079  -0.650
  760    HG   SER 102           HG       SER 102   4.389   1.227   1.206
  761    H    VAL 103           HN       VAL 103   7.314   3.005  -1.816
  762    HA   VAL 103           HA       VAL 103   7.914   4.539   0.445
  763    HB   VAL 103           HB       VAL 103   9.478   3.946  -2.020
  764   HG11  VAL 103          HG11      VAL 103  10.252   6.082  -1.014
  765   HG12  VAL 103          HG12      VAL 103  11.456   4.803  -0.894
  766   HG13  VAL 103          HG13      VAL 103  10.498   5.245   0.519
  767   HG21  VAL 103          HG21      VAL 103   9.401   2.854   0.774
  768   HG22  VAL 103          HG22      VAL 103  10.756   2.567  -0.310
  769   HG23  VAL 103          HG23      VAL 103   9.144   2.001  -0.750
  770    HA   PRO 104           HA       PRO 104   8.397   8.391  -2.503
  771    HB2  PRO 104           HB2      PRO 104   6.926   8.203  -4.832
  772    HB3  PRO 104           HB1      PRO 104   8.667   7.929  -4.712
  773    HG2  PRO 104           HG2      PRO 104   6.447   5.938  -4.774
  774    HG3  PRO 104           HG1      PRO 104   8.037   5.877  -5.547
  775    HD2  PRO 104           HD2      PRO 104   7.532   4.494  -3.320
  776    HD3  PRO 104           HD1      PRO 104   9.110   5.232  -3.622
  777    H    LEU 105           HN       LEU 105   5.522   6.410  -2.296
  778    HA   LEU 105           HA       LEU 105   3.751   8.674  -1.940
  779    HB2  LEU 105           HB2      LEU 105   3.500   5.701  -1.677
  780    HB3  LEU 105           HB1      LEU 105   2.199   6.769  -1.141
  781    HG   LEU 105           HG       LEU 105   3.189   6.240  -3.925
  782   HD11  LEU 105          HD11      LEU 105   0.448   6.367  -2.684
  783   HD12  LEU 105          HD12      LEU 105   1.354   4.899  -3.055
  784   HD13  LEU 105          HD13      LEU 105   0.809   5.951  -4.360
  785   HD21  LEU 105          HD21      LEU 105   1.885   8.143  -4.736
  786   HD22  LEU 105          HD22      LEU 105   3.216   8.668  -3.702
  787   HD23  LEU 105          HD23      LEU 105   1.568   8.634  -3.073
  788    H    MET 106           HN       MET 106   5.942   6.994  -0.064
  789    HA   MET 106           HA       MET 106   4.721   7.626   2.502
  790    HB2  MET 106           HB2      MET 106   5.623   5.413   2.198
  791    HB3  MET 106           HB1      MET 106   7.153   6.067   1.647
  792    HG2  MET 106           HG2      MET 106   7.665   6.874   3.829
  793    HG3  MET 106           HG1      MET 106   6.059   6.426   4.416
  794    HE1  MET 106           HE1      MET 106   5.717   3.720   2.757
  795    HE2  MET 106           HE2      MET 106   5.220   3.817   4.447
  796    HE3  MET 106           HE3      MET 106   6.257   2.497   3.904
  797    H    ASP 107           HN       ASP 107   5.556   9.123   3.938
  798    HA   ASP 107           HA       ASP 107   7.593  10.946   2.871
  799    HB2  ASP 107           HB2      ASP 107   5.345  11.239   4.691
  800    HB3  ASP 107           HB1      ASP 107   6.830  11.851   5.417
  801    H    VAL 108           HN       VAL 108   9.456  11.534   4.143
  802    HA   VAL 108           HA       VAL 108  10.754   9.311   5.280
  803    HB   VAL 108           HB       VAL 108  11.422  12.191   4.978
  804   HG11  VAL 108          HG11      VAL 108  13.439  11.997   6.368
  805   HG12  VAL 108          HG12      VAL 108  12.877  10.430   6.950
  806   HG13  VAL 108          HG13      VAL 108  11.962  11.890   7.328
  807   HG21  VAL 108          HG21      VAL 108  12.054  10.510   3.307
  808   HG22  VAL 108          HG22      VAL 108  12.988   9.649   4.532
  809   HG23  VAL 108          HG23      VAL 108  13.469  11.271   4.034
  810    H    GLY 109           HN       GLY 109  10.588   8.432   7.170
  811    HA2  GLY 109           HA2      GLY 109  10.782   8.497   9.530
  812    HA3  GLY 109           HA1      GLY 109  10.136  10.129   9.509
  813    H    GLU 110           HN       GLU 110   8.361   8.011   7.499
  814    HA   GLU 110           HA       GLU 110   6.351   7.819   9.629
  815    HB2  GLU 110           HB2      GLU 110   4.651   7.888   8.079
  816    HB3  GLU 110           HB1      GLU 110   5.830   8.974   7.358
  817    HG2  GLU 110           HG2      GLU 110   6.444   7.372   5.757
  818    HG3  GLU 110           HG1      GLU 110   5.602   6.086   6.613
  819    H    THR 111           HN       THR 111   4.905   5.898   9.446
  820    HA   THR 111           HA       THR 111   6.279   3.559   8.401
  821    HB   THR 111           HB       THR 111   4.871   3.571  11.070
  822    HG1  THR 111           HG1      THR 111   7.306   4.455  10.479
  823   HG21  THR 111          HG21      THR 111   6.602   1.496   9.716
  824   HG22  THR 111          HG22      THR 111   4.850   1.416   9.902
  825   HG23  THR 111          HG23      THR 111   5.893   1.355  11.323
  826    H    ALA 112           HN       ALA 112   5.035   2.559   7.037
  827    HA   ALA 112           HA       ALA 112   2.139   3.071   7.183
  828    HB1  ALA 112           HB1      ALA 112   3.834   2.680   4.734
  829    HB2  ALA 112           HB2      ALA 112   3.216   4.220   5.331
  830    HB3  ALA 112           HB3      ALA 112   2.095   2.978   4.768
  831    H    MET 113           HN       MET 113   0.816   1.362   7.124
  832    HA   MET 113           HA       MET 113   1.993  -1.294   6.686
  833    HB2  MET 113           HB2      MET 113   0.590  -1.270   8.631
  834    HB3  MET 113           HB1      MET 113  -0.664  -0.356   7.801
  835    HG2  MET 113           HG2      MET 113  -1.160  -2.276   6.395
  836    HG3  MET 113           HG1      MET 113   0.108  -3.207   7.192
  837    HE1  MET 113           HE1      MET 113  -2.912  -4.194   6.900
  838    HE2  MET 113           HE2      MET 113  -3.201  -4.859   8.508
  839    HE3  MET 113           HE3      MET 113  -1.657  -5.137   7.705
  840    H    VAL 114           HN       VAL 114   1.891  -2.012   4.655
  841    HA   VAL 114           HA       VAL 114  -0.104  -0.795   2.851
  842    HB   VAL 114           HB       VAL 114   2.423  -2.122   1.956
  843   HG11  VAL 114          HG11      VAL 114   0.794  -1.703   0.239
  844   HG12  VAL 114          HG12      VAL 114   2.191  -0.649   0.013
  845   HG13  VAL 114          HG13      VAL 114   0.703  -0.006   0.707
  846   HG21  VAL 114          HG21      VAL 114   3.142  -0.480   3.543
  847   HG22  VAL 114          HG22      VAL 114   2.130   0.744   2.776
  848   HG23  VAL 114          HG23      VAL 114   3.517   0.076   1.913
  849    H    THR 115           HN       THR 115  -1.514  -2.160   1.906
  850    HA   THR 115           HA       THR 115  -0.742  -4.984   1.922
  851    HB   THR 115           HB       THR 115  -3.552  -3.902   1.689
  852    HG1  THR 115           HG1      THR 115  -1.962  -4.412   3.825
  853   HG21  THR 115          HG21      THR 115  -4.116  -6.299   2.013
  854   HG22  THR 115          HG22      THR 115  -2.394  -6.673   1.879
  855   HG23  THR 115          HG23      THR 115  -3.255  -5.976   0.505
  856    H    ALA 116           HN       ALA 116  -0.006  -5.629   0.175
  857    HA   ALA 116           HA       ALA 116  -1.003  -4.578  -2.401
  858    HB1  ALA 116           HB1      ALA 116   1.246  -3.756  -1.914
  859    HB2  ALA 116           HB2      ALA 116   1.251  -4.878  -3.276
  860    HB3  ALA 116           HB3      ALA 116   1.801  -5.416  -1.690
  861    H    ASP 117           HN       ASP 117  -1.691  -6.064  -3.793
  862    HA   ASP 117           HA       ASP 117  -2.000  -8.750  -3.244
  863    HB2  ASP 117           HB2      ASP 117  -2.958  -7.404  -5.220
  864    HB3  ASP 117           HB1      ASP 117  -1.431  -7.731  -6.003
  865    H    SER 118           HN       SER 118  -0.808 -10.595  -3.770
  866    HA   SER 118           HA       SER 118   1.928 -10.471  -3.323
  867    HB2  SER 118           HB2      SER 118   0.252 -12.462  -3.188
  868    HB3  SER 118           HB1      SER 118   0.681 -12.711  -4.881
  869    HG   SER 118           HG       SER 118   1.969 -13.890  -3.282
  870    H    LYS 119           HN       LYS 119   0.091 -10.278  -6.286
  871    HA   LYS 119           HA       LYS 119   2.077 -10.688  -8.178
  872    HB2  LYS 119           HB2      LYS 119   0.760  -9.061  -9.581
  873    HB3  LYS 119           HB1      LYS 119  -0.150 -10.423  -8.935
  874    HG2  LYS 119           HG2      LYS 119  -1.100  -9.008  -7.248
  875    HG3  LYS 119           HG1      LYS 119  -0.064  -7.667  -7.745
  876    HD2  LYS 119           HD2      LYS 119  -2.263  -7.345  -8.660
  877    HD3  LYS 119           HD1      LYS 119  -1.140  -7.704  -9.973
  878    HE2  LYS 119           HE2      LYS 119  -1.895 -10.125  -9.730
  879    HE3  LYS 119           HE1      LYS 119  -3.200  -9.496  -8.727
  880    HZ1  LYS 119           HZ1      LYS 119  -3.881  -9.756 -11.045
  881    HZ2  LYS 119           HZ2      LYS 119  -2.675  -8.674 -11.535
  882    HZ3  LYS 119           HZ3      LYS 119  -3.952  -8.138 -10.563
  883    H    TYR 120           HN       TYR 120   1.522  -7.865  -6.115
  884    HA   TYR 120           HA       TYR 120   3.713  -6.447  -7.445
  885    HB2  TYR 120           HB2      TYR 120   1.957  -5.559  -5.141
  886    HB3  TYR 120           HB1      TYR 120   3.138  -4.560  -5.981
  887    HD1  TYR 120           HD2      TYR 120  -0.131  -6.180  -6.209
  888    HD2  TYR 120           HD1      TYR 120   2.662  -3.605  -8.100
  889    HE1  TYR 120           HE2      TYR 120  -1.881  -5.493  -7.785
  890    HE2  TYR 120           HE1      TYR 120   0.925  -2.886  -9.699
  891    HH   TYR 120           HH       TYR 120  -2.393  -3.593  -9.259
  892    H    CYS 121           HN       CYS 121   3.395  -8.773  -5.268
  893    HA   CYS 121           HA       CYS 121   5.649  -7.862  -3.613
  894    HB2  CYS 121           HB2      CYS 121   3.442  -9.784  -2.868
  895    HB3  CYS 121           HB1      CYS 121   4.781  -9.306  -1.832
  896    HG   CYS 121           HG       CYS 121   1.874  -7.831  -2.288
  897    H    TYR 122           HN       TYR 122   4.392 -11.154  -3.571
  898    HA   TYR 122           HA       TYR 122   6.594 -11.993  -5.317
  899    HB2  TYR 122           HB2      TYR 122   6.153 -13.433  -2.703
  900    HB3  TYR 122           HB1      TYR 122   7.517 -13.539  -3.801
  901    HD1  TYR 122           HD2      TYR 122   9.234 -11.767  -3.840
  902    HD2  TYR 122           HD1      TYR 122   6.033 -11.709  -1.034
  903    HE1  TYR 122           HE2      TYR 122  10.464 -10.137  -2.473
  904    HE2  TYR 122           HE1      TYR 122   7.249 -10.084   0.333
  905    HH   TYR 122           HH       TYR 122   9.537  -9.309   0.711
  906    H    GLY 123           HN       GLY 123   3.755 -11.989  -5.896
  907    HA2  GLY 123           HA2      GLY 123   2.298 -14.232  -5.478
  908    HA3  GLY 123           HA1      GLY 123   2.326 -13.402  -7.022
  909    HA   PRO 124           HA       PRO 124   4.237 -17.115  -8.575
  910    HB2  PRO 124           HB2      PRO 124   5.115 -16.250 -10.969
  911    HB3  PRO 124           HB1      PRO 124   3.392 -16.413 -10.614
  912    HG2  PRO 124           HG2      PRO 124   5.057 -13.970 -10.818
  913    HG3  PRO 124           HG1      PRO 124   3.331 -14.191 -11.149
  914    HD2  PRO 124           HD2      PRO 124   4.498 -13.104  -8.808
  915    HD3  PRO 124           HD1      PRO 124   2.795 -13.520  -9.056
  916    H    GLN 125           HN       GLN 125   5.825 -14.890  -7.083
  917    HA   GLN 125           HA       GLN 125   8.494 -15.382  -8.231
  918    HB2  GLN 125           HB2      GLN 125   7.654 -13.237  -6.276
  919    HB3  GLN 125           HB1      GLN 125   9.175 -13.337  -7.154
  920    HG2  GLN 125           HG2      GLN 125   8.095 -12.885  -9.224
  921    HG3  GLN 125           HG1      GLN 125   6.503 -13.044  -8.495
  922   HE21  GLN 125          HE21      GLN 125   5.669 -11.391  -7.301
  923   HE22  GLN 125          HE22      GLN 125   6.368  -9.815  -7.231
  924    H    GLY 126           HN       GLY 126   6.724 -15.149  -5.206
  925    HA2  GLY 126           HA2      GLY 126   6.963 -16.295  -3.245
  926    HA3  GLY 126           HA1      GLY 126   8.301 -17.192  -3.946
  927    H    SER 127           HN       SER 127   7.870 -15.790  -1.360
  928    HA   SER 127           HA       SER 127   9.815 -13.688  -1.456
  929    HB2  SER 127           HB2      SER 127   7.865 -13.151  -0.203
  930    HB3  SER 127           HB1      SER 127   7.968 -14.635   0.733
  931    HG   SER 127           HG       SER 127   8.768 -12.525   1.684
  932    H    ARG 128           HN       ARG 128  11.394 -13.545   0.458
  933    HA   ARG 128           HA       ARG 128  13.387 -15.374  -0.108
  934    HB2  ARG 128           HB2      ARG 128  14.670 -14.398   1.716
  935    HB3  ARG 128           HB1      ARG 128  13.847 -13.144   0.804
  936    HG2  ARG 128           HG2      ARG 128  12.290 -12.764   2.523
  937    HG3  ARG 128           HG1      ARG 128  12.710 -14.267   3.345
  938    HD2  ARG 128           HD2      ARG 128  13.722 -12.583   4.622
  939    HD3  ARG 128           HD1      ARG 128  15.030 -13.255   3.652
  940    HE   ARG 128           HE       ARG 128  14.123 -11.145   2.176
  941   HH11  ARG 128          HH11      ARG 128  15.339 -11.578   5.427
  942   HH12  ARG 128          HH12      ARG 128  15.906  -9.946   5.585
  943   HH21  ARG 128          HH21      ARG 128  14.873  -8.994   2.358
  944   HH22  ARG 128          HH22      ARG 128  15.646  -8.466   3.835
  945    H    SER 129           HN       SER 129  11.372 -15.272   2.832
  946    HA   SER 129           HA       SER 129  12.506 -17.804   3.652
  947    HB2  SER 129           HB2      SER 129  10.349 -16.219   5.055
  948    HB3  SER 129           HB1      SER 129  11.333 -17.518   5.731
  949    HG   SER 129           HG       SER 129  13.161 -16.188   5.496
  950    HA   PRO 130           HA       PRO 130   8.297 -19.371   2.330
  951    HB2  PRO 130           HB2      PRO 130   6.160 -17.554   2.445
  952    HB3  PRO 130           HB1      PRO 130   6.581 -18.713   3.699
  953    HG2  PRO 130           HG2      PRO 130   6.706 -15.939   3.955
  954    HG3  PRO 130           HG1      PRO 130   7.526 -17.096   5.008
  955    HD2  PRO 130           HD2      PRO 130   8.593 -15.602   2.628
  956    HD3  PRO 130           HD1      PRO 130   9.363 -15.904   4.201
  957    H    TYR 131           HN       TYR 131   8.395 -19.590   0.083
  958    HA   TYR 131           HA       TYR 131   7.834 -17.641  -1.800
  959    HB2  TYR 131           HB2      TYR 131   8.449 -19.975  -2.359
  960    HB3  TYR 131           HB1      TYR 131   6.885 -20.525  -1.776
  961    HD1  TYR 131           HD2      TYR 131   4.814 -19.455  -2.972
  962    HD2  TYR 131           HD1      TYR 131   8.728 -19.558  -4.633
  963    HE1  TYR 131           HE2      TYR 131   3.863 -19.152  -5.216
  964    HE2  TYR 131           HE1      TYR 131   7.788 -19.248  -6.880
  965    HH   TYR 131           HH       TYR 131   4.656 -18.240  -7.428
  966    H    ILE 132           HN       ILE 132   6.317 -16.146  -1.131
  967    HA   ILE 132           HA       ILE 132   3.898 -16.797   0.158
  968    HB   ILE 132           HB       ILE 132   4.710 -14.342  -1.424
  969   HG12  ILE 132          HG12      ILE 132   5.320 -13.372   0.518
  970   HG13  ILE 132          HG11      ILE 132   3.826 -13.854   1.299
  971   HG21  ILE 132          HG21      ILE 132   2.143 -14.817   0.058
  972   HG22  ILE 132          HG22      ILE 132   2.328 -14.703  -1.696
  973   HG23  ILE 132          HG23      ILE 132   2.642 -13.293  -0.681
  974   HD11  ILE 132          HD11      ILE 132   6.387 -15.387   1.135
  975   HD12  ILE 132          HD12      ILE 132   4.874 -16.052   1.763
  976   HD13  ILE 132          HD13      ILE 132   5.631 -14.671   2.561
  977    HA   PRO 133           HA       PRO 133   1.812 -18.780  -3.285
  978    HB2  PRO 133           HB2      PRO 133  -0.569 -17.709  -1.839
  979    HB3  PRO 133           HB1      PRO 133  -0.271 -19.340  -2.451
  980    HG2  PRO 133           HG2      PRO 133  -0.049 -18.814   0.147
  981    HG3  PRO 133           HG1      PRO 133   1.096 -19.903  -0.658
  982    HD2  PRO 133           HD2      PRO 133   1.476 -17.090   0.252
  983    HD3  PRO 133           HD1      PRO 133   2.638 -18.429   0.203
  984    HA   PRO 134           HA       PRO 134   1.142 -15.417  -6.129
  985    HB2  PRO 134           HB2      PRO 134  -0.784 -17.347  -7.332
  986    HB3  PRO 134           HB1      PRO 134   0.516 -16.418  -8.095
  987    HG2  PRO 134           HG2      PRO 134   0.805 -19.022  -7.601
  988    HG3  PRO 134           HG1      PRO 134   2.159 -17.894  -7.398
  989    HD2  PRO 134           HD2      PRO 134   0.450 -19.200  -5.327
  990    HD3  PRO 134           HD1      PRO 134   2.173 -18.777  -5.269
  991    H    HIS 135           HN       HIS 135  -0.127 -13.758  -5.967
  992    HA   HIS 135           HA       HIS 135  -1.960 -12.432  -5.799
  993    HB2  HIS 135           HB2      HIS 135  -3.195 -15.027  -6.424
  994    HB3  HIS 135           HB1      HIS 135  -4.241 -13.909  -5.558
  995    HD1  HIS 135           HD1      HIS 135  -5.507 -12.356  -6.969
  996    HD2  HIS 135           HD2      HIS 135  -2.087 -13.755  -8.878
  997    HE1  HIS 135           HE1      HIS 135  -5.615 -11.446  -9.312
  998    HE2  HIS 135           HE2      HIS 135  -3.690 -12.544 -10.510
  999    H    ALA 136           HN       ALA 136  -0.805 -14.246  -3.400
 1000    HA   ALA 136           HA       ALA 136  -2.896 -13.919  -1.464
 1001    HB1  ALA 136           HB1      ALA 136  -1.155 -15.616  -1.154
 1002    HB2  ALA 136           HB2      ALA 136  -1.194 -14.481   0.197
 1003    HB3  ALA 136           HB3      ALA 136   0.061 -14.341  -1.034
 1004    H    ALA 137           HN       ALA 137  -3.428 -12.103  -0.389
 1005    HA   ALA 137           HA       ALA 137  -2.139  -9.688  -1.259
 1006    HB1  ALA 137           HB1      ALA 137  -4.577  -9.786  -0.914
 1007    HB2  ALA 137           HB2      ALA 137  -3.823  -8.516   0.052
 1008    HB3  ALA 137           HB3      ALA 137  -4.315 -10.026   0.814
 1009    H    LEU 138           HN       LEU 138  -0.340  -8.981  -0.416
 1010    HA   LEU 138           HA       LEU 138   0.594  -9.999   2.130
 1011    HB2  LEU 138           HB2      LEU 138   1.790  -9.364  -0.306
 1012    HB3  LEU 138           HB1      LEU 138   2.347  -8.123   0.797
 1013    HG   LEU 138           HG       LEU 138   3.182  -9.814   2.321
 1014   HD11  LEU 138          HD11      LEU 138   1.556 -11.547   1.870
 1015   HD12  LEU 138          HD12      LEU 138   3.199 -12.163   1.684
 1016   HD13  LEU 138          HD13      LEU 138   2.232 -11.775   0.261
 1017   HD21  LEU 138          HD21      LEU 138   4.114 -10.279  -0.496
 1018   HD22  LEU 138          HD22      LEU 138   5.012 -10.656   0.971
 1019   HD23  LEU 138          HD23      LEU 138   4.659  -8.978   0.565
 1020    H    CYS 139           HN       CYS 139   0.698  -8.800   3.984
 1021    HA   CYS 139           HA       CYS 139   0.172  -5.922   3.698
 1022    HB2  CYS 139           HB2      CYS 139  -0.887  -6.015   5.936
 1023    HB3  CYS 139           HB1      CYS 139  -1.696  -6.993   4.733
 1024    HG   CYS 139           HG       CYS 139  -1.615  -9.225   5.972
 1025    H    LEU 140           HN       LEU 140   2.058  -4.980   3.823
 1026    HA   LEU 140           HA       LEU 140   4.018  -5.994   5.763
 1027    HB2  LEU 140           HB2      LEU 140   5.692  -4.858   4.290
 1028    HB3  LEU 140           HB1      LEU 140   4.893  -6.254   3.594
 1029    HG   LEU 140           HG       LEU 140   3.561  -3.721   2.959
 1030   HD11  LEU 140          HD11      LEU 140   5.290  -2.996   1.375
 1031   HD12  LEU 140          HD12      LEU 140   6.376  -4.239   2.000
 1032   HD13  LEU 140          HD13      LEU 140   5.863  -2.912   3.045
 1033   HD21  LEU 140          HD21      LEU 140   3.591  -4.678   0.724
 1034   HD22  LEU 140          HD22      LEU 140   3.041  -5.876   1.896
 1035   HD23  LEU 140          HD23      LEU 140   4.686  -5.951   1.261
 1036    H    GLU 141           HN       GLU 141   4.780  -4.722   7.281
 1037    HA   GLU 141           HA       GLU 141   3.874  -1.941   7.358
 1038    HB2  GLU 141           HB2      GLU 141   3.356  -3.313   9.295
 1039    HB3  GLU 141           HB1      GLU 141   5.039  -3.780   9.452
 1040    HG2  GLU 141           HG2      GLU 141   5.648  -1.543  10.101
 1041    HG3  GLU 141           HG1      GLU 141   3.992  -0.983   9.824
 1042    H    VAL 142           HN       VAL 142   5.251  -0.537   6.466
 1043    HA   VAL 142           HA       VAL 142   8.120  -1.137   6.578
 1044    HB   VAL 142           HB       VAL 142   8.146   0.479   4.519
 1045   HG11  VAL 142          HG11      VAL 142   7.924  -1.447   3.042
 1046   HG12  VAL 142          HG12      VAL 142   7.117  -2.345   4.327
 1047   HG13  VAL 142          HG13      VAL 142   8.807  -1.877   4.509
 1048   HG21  VAL 142          HG21      VAL 142   5.752   1.066   4.672
 1049   HG22  VAL 142          HG22      VAL 142   5.340  -0.622   4.372
 1050   HG23  VAL 142          HG23      VAL 142   6.161   0.319   3.129
 1051    H    THR 143           HN       THR 143   9.134   0.072   7.963
 1052    HA   THR 143           HA       THR 143   8.424   2.838   8.508
 1053    HB   THR 143           HB       THR 143  10.887   1.349   9.460
 1054    HG1  THR 143           HG1      THR 143   8.216   1.335  10.483
 1055   HG21  THR 143          HG21      THR 143   9.304   3.664  10.608
 1056   HG22  THR 143          HG22      THR 143  10.884   3.765   9.829
 1057   HG23  THR 143          HG23      THR 143  10.708   2.907  11.360
 1058    H    LEU 144           HN       LEU 144   9.043   4.345   7.027
 1059    HA   LEU 144           HA       LEU 144  11.559   4.041   5.594
 1060    HB2  LEU 144           HB2      LEU 144   9.589   5.035   4.476
 1061    HB3  LEU 144           HB1      LEU 144   9.604   6.354   5.635
 1062    HG   LEU 144           HG       LEU 144  11.821   7.044   4.798
 1063   HD11  LEU 144          HD11      LEU 144  12.613   4.864   4.037
 1064   HD12  LEU 144          HD12      LEU 144  12.698   6.058   2.741
 1065   HD13  LEU 144          HD13      LEU 144  11.400   4.865   2.756
 1066   HD21  LEU 144          HD21      LEU 144  11.051   7.933   2.672
 1067   HD22  LEU 144          HD22      LEU 144   9.777   8.024   3.890
 1068   HD23  LEU 144          HD23      LEU 144   9.726   6.768   2.652
 1069    H    LYS 145           HN       LYS 145  13.153   4.130   7.018
 1070    HA   LYS 145           HA       LYS 145  13.093   6.048   9.187
 1071    HB2  LYS 145           HB2      LYS 145  15.320   4.127   8.535
 1072    HB3  LYS 145           HB1      LYS 145  14.924   4.847  10.090
 1073    HG2  LYS 145           HG2      LYS 145  12.913   3.539  10.244
 1074    HG3  LYS 145           HG1      LYS 145  13.183   2.880   8.630
 1075    HD2  LYS 145           HD2      LYS 145  15.064   2.509  10.961
 1076    HD3  LYS 145           HD1      LYS 145  13.830   1.336  10.476
 1077    HE2  LYS 145           HE2      LYS 145  14.863   0.978   8.383
 1078    HE3  LYS 145           HE1      LYS 145  15.975   2.335   8.607
 1079    HZ1  LYS 145           HZ1      LYS 145  17.210   0.400   9.061
 1080    HZ2  LYS 145           HZ2      LYS 145  15.980  -0.281  10.011
 1081    HZ3  LYS 145           HZ3      LYS 145  16.855   1.048  10.583
 1082    H    THR 146           HN       THR 146  14.712   5.583   6.137
 1083    HA   THR 146           HA       THR 146  16.043   8.135   6.415
 1084    HB   THR 146           HB       THR 146  17.701   5.707   5.725
 1085    HG1  THR 146           HG1      THR 146  17.776   5.294   7.793
 1086   HG21  THR 146          HG21      THR 146  18.456   8.524   6.544
 1087   HG22  THR 146          HG22      THR 146  18.585   7.832   4.928
 1088   HG23  THR 146          HG23      THR 146  19.595   7.210   6.232
 1089    H    ALA 147           HN       ALA 147  16.553   9.083   4.461
 1090    HA   ALA 147           HA       ALA 147  16.361   7.436   2.040
 1091    HB1  ALA 147           HB1      ALA 147  14.266   8.665   2.177
 1092    HB2  ALA 147           HB2      ALA 147  15.260   9.323   0.874
 1093    HB3  ALA 147           HB3      ALA 147  15.147  10.175   2.413
 1094    H    VAL 148           HN       VAL 148  18.125   7.686   0.751
 1095    HA   VAL 148           HA       VAL 148  19.838  10.029   1.257
 1096    HB   VAL 148           HB       VAL 148  21.089   7.570   0.247
 1097   HG11  VAL 148          HG11      VAL 148  21.876   9.601   2.303
 1098   HG12  VAL 148          HG12      VAL 148  22.340   9.584   0.602
 1099   HG13  VAL 148          HG13      VAL 148  22.908   8.313   1.686
 1100   HG21  VAL 148          HG21      VAL 148  21.382   6.616   2.529
 1101   HG22  VAL 148          HG22      VAL 148  19.719   6.544   1.952
 1102   HG23  VAL 148          HG23      VAL 148  20.187   7.771   3.126
 1103    H    ASP 149           HN       ASP 149  20.131  11.194  -0.547
 1104    HA   ASP 149           HA       ASP 149  19.418  10.194  -3.093
 1105    HB2  ASP 149           HB2      ASP 149  20.667  12.279  -3.848
 1106    HB3  ASP 149           HB1      ASP 149  19.221  12.514  -2.885
 1107    H    LEU 150           HN       LEU 150  20.520   8.814  -4.243
 1108    HA   LEU 150           HA       LEU 150  23.428   8.933  -4.358
 1109    HB2  LEU 150           HB2      LEU 150  22.242   7.197  -2.605
 1110    HB3  LEU 150           HB1      LEU 150  22.364   6.203  -4.038
 1111    HG   LEU 150           HG       LEU 150  24.251   5.834  -2.553
 1112   HD11  LEU 150          HD11      LEU 150  26.081   6.181  -4.135
 1113   HD12  LEU 150          HD12      LEU 150  25.059   7.267  -5.074
 1114   HD13  LEU 150          HD13      LEU 150  24.637   5.561  -4.935
 1115   HD21  LEU 150          HD21      LEU 150  25.899   7.576  -2.129
 1116   HD22  LEU 150          HD22      LEU 150  24.321   8.018  -1.478
 1117   HD23  LEU 150          HD23      LEU 150  24.891   8.746  -2.980
 1118    H    GLU 151           HN       GLU 151  21.064   9.430  -6.105
 1119    HA   GLU 151           HA       GLU 151  21.327   7.313  -8.093
 1120    HB2  GLU 151           HB2      GLU 151  19.079   8.366  -7.451
 1121    HB3  GLU 151           HB1      GLU 151  19.615   9.785  -8.341
 1122    HG2  GLU 151           HG2      GLU 151  19.853   7.248  -9.798
 1123    HG3  GLU 151           HG1      GLU 151  18.196   7.729  -9.409
 1124    H    HIS 152           HN       HIS 152  22.908   7.456  -9.495
 1125    HA   HIS 152           HA       HIS 152  23.548  10.078 -10.621
 1126    HB2  HIS 152           HB2      HIS 152  25.218   9.308  -8.827
 1127    HB3  HIS 152           HB1      HIS 152  25.707   8.073  -9.980
 1128    HD1  HIS 152           HD1      HIS 152  25.265  11.863 -10.026
 1129    HD2  HIS 152           HD2      HIS 152  27.797   8.897 -11.473
 1130    HE1  HIS 152           HE1      HIS 152  27.088  13.071 -11.262
 1131    HE2  HIS 152           HE2      HIS 152  28.719  11.270 -11.934
 1132    H    HIS 153           HN       HIS 153  22.066   9.194 -12.180
 1133    HA   HIS 153           HA       HIS 153  22.322   6.909 -13.673
 1134    HB2  HIS 153           HB2      HIS 153  20.509   8.721 -13.730
 1135    HB3  HIS 153           HB1      HIS 153  21.538   9.558 -14.881
 1136    HD1  HIS 153           HD1      HIS 153  18.775   7.380 -14.787
 1137    HD2  HIS 153           HD2      HIS 153  22.173   7.603 -17.166
 1138    HE1  HIS 153           HE1      HIS 153  18.200   6.150 -16.898
 1139    HE2  HIS 153           HE2      HIS 153  20.351   6.083 -18.207
 1140    H    HIS 154           HN       HIS 154  24.103   6.172 -14.596
 1141    HA   HIS 154           HA       HIS 154  25.448   7.860 -16.579
 1142    HB2  HIS 154           HB2      HIS 154  26.899   7.822 -14.567
 1143    HB3  HIS 154           HB1      HIS 154  26.895   6.063 -14.613
 1144    HD1  HIS 154           HD1      HIS 154  28.751   8.953 -15.803
 1145    HD2  HIS 154           HD2      HIS 154  28.193   5.022 -17.039
 1146    HE1  HIS 154           HE1      HIS 154  30.600   8.486 -17.439
 1147    HE2  HIS 154           HE2      HIS 154  30.270   6.082 -18.147
 1148    H    HIS 155           HN       HIS 155  25.724   4.530 -15.302
 1149    HA   HIS 155           HA       HIS 155  24.462   3.463 -17.659
 1150    HB2  HIS 155           HB2      HIS 155  27.054   3.857 -18.077
 1151    HB3  HIS 155           HB1      HIS 155  27.191   2.346 -17.180
 1152    HD1  HIS 155           HD1      HIS 155  25.700   3.779 -20.331
 1153    HD2  HIS 155           HD2      HIS 155  26.520   0.078 -18.608
 1154    HE1  HIS 155           HE1      HIS 155  25.268   2.077 -22.127
 1155    HE2  HIS 155           HE2      HIS 155  25.820  -0.155 -21.090
 1156    H    HIS 156           HN       HIS 156  24.244   3.578 -14.737
 1157    HA   HIS 156           HA       HIS 156  23.937   0.702 -14.215
 1158    HB2  HIS 156           HB2      HIS 156  25.874   1.827 -12.914
 1159    HB3  HIS 156           HB1      HIS 156  24.622   2.719 -12.060
 1160    HD1  HIS 156           HD1      HIS 156  22.877   1.166 -10.674
 1161    HD2  HIS 156           HD2      HIS 156  26.422  -0.627 -11.912
 1162    HE1  HIS 156           HE1      HIS 156  23.132  -0.893  -9.250
 1163    HE2  HIS 156           HE2      HIS 156  25.309  -1.936  -9.977
 1164    H    HIS 157           HN       HIS 157  21.947   1.763 -15.340
 1165    HA   HIS 157           HA       HIS 157  19.891   2.695 -15.381
 1166    HB2  HIS 157           HB2      HIS 157  20.119   2.304 -12.405
 1167    HB3  HIS 157           HB1      HIS 157  18.753   3.162 -13.103
 1168    HD1  HIS 157           HD1      HIS 157  18.602   0.414 -11.544
 1169    HD2  HIS 157           HD2      HIS 157  18.533   0.915 -15.679
 1170    HE1  HIS 157           HE1      HIS 157  17.467  -1.632 -12.464
 1171    HE2  HIS 157           HE2      HIS 157  17.196  -1.167 -14.925
  Start of MODEL   12
    1    H1   MET   1           HT1      MET   1 -41.119  28.763 -40.371
    2    H2   MET   1           HT2      MET   1 -42.652  29.455 -40.544
    3    H3   MET   1           HT3      MET   1 -42.296  27.987 -41.311
    4    HA   MET   1           HA       MET   1 -42.454  28.462 -38.394
    5    HB2  MET   1           HB2      MET   1 -44.420  27.062 -38.433
    6    HB3  MET   1           HB1      MET   1 -44.641  28.377 -39.578
    7    HG2  MET   1           HG2      MET   1 -44.090  26.877 -41.420
    8    HG3  MET   1           HG1      MET   1 -43.846  25.557 -40.278
    9    HE1  MET   1           HE1      MET   1 -47.158  24.556 -42.126
   10    HE2  MET   1           HE2      MET   1 -45.544  24.027 -41.659
   11    HE3  MET   1           HE3      MET   1 -45.740  25.347 -42.810
   12    H    GLY   2           HN       GLY   2 -41.801  26.821 -37.086
   13    HA2  GLY   2           HA2      GLY   2 -41.440  24.175 -37.557
   14    HA3  GLY   2           HA1      GLY   2 -39.981  24.896 -38.228
   15    H    GLN   3           HN       GLN   3 -39.165  23.388 -36.425
   16    HA   GLN   3           HA       GLN   3 -38.641  25.096 -34.122
   17    HB2  GLN   3           HB2      GLN   3 -40.588  23.564 -33.568
   18    HB3  GLN   3           HB1      GLN   3 -39.482  22.213 -33.753
   19    HG2  GLN   3           HG2      GLN   3 -39.539  22.589 -31.468
   20    HG3  GLN   3           HG1      GLN   3 -38.047  23.366 -31.991
   21   HE21  GLN   3          HE21      GLN   3 -39.629  25.628 -33.158
   22   HE22  GLN   3          HE22      GLN   3 -40.087  26.590 -31.801
   23    HA   PRO   4           HA       PRO   4 -34.718  23.287 -35.577
   24    HB2  PRO   4           HB2      PRO   4 -33.670  25.483 -33.904
   25    HB3  PRO   4           HB1      PRO   4 -33.329  25.099 -35.595
   26    HG2  PRO   4           HG2      PRO   4 -34.822  27.214 -34.931
   27    HG3  PRO   4           HG1      PRO   4 -35.184  26.243 -36.371
   28    HD2  PRO   4           HD2      PRO   4 -36.507  26.211 -33.683
   29    HD3  PRO   4           HD1      PRO   4 -37.241  26.129 -35.300
   30    HA   PRO   5           HA       PRO   5 -34.296  20.717 -32.026
   31    HB2  PRO   5           HB2      PRO   5 -31.671  19.924 -32.512
   32    HB3  PRO   5           HB1      PRO   5 -33.119  19.160 -33.172
   33    HG2  PRO   5           HG2      PRO   5 -31.287  21.156 -34.427
   34    HG3  PRO   5           HG1      PRO   5 -32.108  19.763 -35.161
   35    HD2  PRO   5           HD2      PRO   5 -33.000  22.256 -35.542
   36    HD3  PRO   5           HD1      PRO   5 -34.123  20.894 -35.353
   37    H    ALA   6           HN       ALA   6 -34.036  21.400 -30.057
   38    HA   ALA   6           HA       ALA   6 -31.469  22.606 -29.285
   39    HB1  ALA   6           HB1      ALA   6 -32.606  24.129 -27.747
   40    HB2  ALA   6           HB2      ALA   6 -34.172  23.521 -28.283
   41    HB3  ALA   6           HB3      ALA   6 -33.144  24.411 -29.404
   42    H    GLU   7           HN       GLU   7 -30.847  20.554 -28.571
   43    HA   GLU   7           HA       GLU   7 -32.038  19.613 -26.120
   44    HB2  GLU   7           HB2      GLU   7 -32.323  17.281 -27.200
   45    HB3  GLU   7           HB1      GLU   7 -33.557  18.500 -27.497
   46    HG2  GLU   7           HG2      GLU   7 -32.503  19.014 -29.659
   47    HG3  GLU   7           HG1      GLU   7 -31.325  17.734 -29.374
   48    H    GLU   8           HN       GLU   8 -30.089  18.158 -28.719
   49    HA   GLU   8           HA       GLU   8 -28.080  17.133 -28.757
   50    HB2  GLU   8           HB2      GLU   8 -27.183  19.285 -27.990
   51    HB3  GLU   8           HB1      GLU   8 -27.476  18.816 -26.320
   52    HG2  GLU   8           HG2      GLU   8 -25.899  16.934 -26.609
   53    HG3  GLU   8           HG1      GLU   8 -25.556  17.513 -28.238
   54    H    ALA   9           HN       ALA   9 -28.860  15.105 -28.385
   55    HA   ALA   9           HA       ALA   9 -29.260  13.128 -27.354
   56    HB1  ALA   9           HB1      ALA   9 -26.895  13.317 -26.734
   57    HB2  ALA   9           HB2      ALA   9 -27.827  12.510 -25.472
   58    HB3  ALA   9           HB3      ALA   9 -27.348  14.195 -25.271
   59    H    GLU  10           HN       GLU  10 -29.616  12.310 -24.796
   60    HA   GLU  10           HA       GLU  10 -31.860  13.968 -23.893
   61    HB2  GLU  10           HB2      GLU  10 -32.551  11.927 -22.611
   62    HB3  GLU  10           HB1      GLU  10 -32.586  11.752 -24.357
   63    HG2  GLU  10           HG2      GLU  10 -30.293  10.797 -22.667
   64    HG3  GLU  10           HG1      GLU  10 -31.695   9.793 -23.033
   65    H    GLN  11           HN       GLN  11 -29.005  12.244 -22.672
   66    HA   GLN  11           HA       GLN  11 -28.735  14.286 -20.646
   67    HB2  GLN  11           HB2      GLN  11 -28.441  12.594 -18.816
   68    HB3  GLN  11           HB1      GLN  11 -30.090  12.804 -19.384
   69    HG2  GLN  11           HG2      GLN  11 -29.971  10.758 -20.642
   70    HG3  GLN  11           HG1      GLN  11 -28.262  10.572 -20.246
   71   HE21  GLN  11          HE21      GLN  11 -28.601   8.567 -19.274
   72   HE22  GLN  11          HE22      GLN  11 -29.384   8.407 -17.733
   73    HA   PRO  12           HA       PRO  12 -24.552  13.327 -22.061
   74    HB2  PRO  12           HB2      PRO  12 -23.984  15.923 -20.832
   75    HB3  PRO  12           HB1      PRO  12 -23.780  15.417 -22.509
   76    HG2  PRO  12           HG2      PRO  12 -25.679  17.181 -21.759
   77    HG3  PRO  12           HG1      PRO  12 -25.919  16.042 -23.096
   78    HD2  PRO  12           HD2      PRO  12 -26.906  15.888 -20.272
   79    HD3  PRO  12           HD1      PRO  12 -27.758  15.502 -21.783
   80    H    GLY  13           HN       GLY  13 -22.623  12.866 -20.911
   81    HA2  GLY  13           HA2      GLY  13 -22.416  13.408 -18.092
   82    HA3  GLY  13           HA1      GLY  13 -22.776  11.725 -18.442
   83    H    ALA  14           HN       ALA  14 -20.935  10.770 -17.862
   84    HA   ALA  14           HA       ALA  14 -18.874   9.868 -18.136
   85    HB1  ALA  14           HB1      ALA  14 -17.546  10.294 -20.111
   86    HB2  ALA  14           HB2      ALA  14 -18.549  11.688 -20.517
   87    HB3  ALA  14           HB3      ALA  14 -19.238  10.063 -20.559
   88    H    LEU  15           HN       LEU  15 -18.511  13.313 -18.996
   89    HA   LEU  15           HA       LEU  15 -16.107  13.421 -17.335
   90    HB2  LEU  15           HB2      LEU  15 -16.085  14.236 -19.708
   91    HB3  LEU  15           HB1      LEU  15 -17.208  15.498 -19.246
   92    HG   LEU  15           HG       LEU  15 -14.560  15.284 -17.852
   93   HD11  LEU  15          HD11      LEU  15 -13.600  16.782 -19.543
   94   HD12  LEU  15          HD12      LEU  15 -15.058  16.598 -20.518
   95   HD13  LEU  15          HD13      LEU  15 -14.018  15.207 -20.216
   96   HD21  LEU  15          HD21      LEU  15 -14.851  17.692 -17.611
   97   HD22  LEU  15          HD22      LEU  15 -16.268  16.838 -16.999
   98   HD23  LEU  15          HD23      LEU  15 -16.328  17.626 -18.575
   99    H    ALA  16           HN       ALA  16 -15.992  14.514 -15.467
  100    HA   ALA  16           HA       ALA  16 -17.819  16.638 -14.811
  101    HB1  ALA  16           HB1      ALA  16 -17.895  14.100 -13.165
  102    HB2  ALA  16           HB2      ALA  16 -19.172  14.649 -14.251
  103    HB3  ALA  16           HB3      ALA  16 -18.766  15.595 -12.819
  104    H    ARG  17           HN       ARG  17 -16.871  18.045 -13.441
  105    HA   ARG  17           HA       ARG  17 -14.755  17.118 -11.655
  106    HB2  ARG  17           HB2      ARG  17 -13.352  19.108 -12.326
  107    HB3  ARG  17           HB1      ARG  17 -13.445  17.813 -13.513
  108    HG2  ARG  17           HG2      ARG  17 -14.984  19.051 -14.854
  109    HG3  ARG  17           HG1      ARG  17 -15.171  20.280 -13.602
  110    HD2  ARG  17           HD2      ARG  17 -13.710  20.960 -15.488
  111    HD3  ARG  17           HD1      ARG  17 -12.921  21.029 -13.915
  112    HE   ARG  17           HE       ARG  17 -12.159  18.619 -14.745
  113   HH11  ARG  17          HH11      ARG  17 -12.330  21.614 -16.554
  114   HH12  ARG  17          HH12      ARG  17 -10.910  21.265 -17.503
  115   HH21  ARG  17          HH21      ARG  17 -10.281  18.175 -15.975
  116   HH22  ARG  17          HH22      ARG  17  -9.721  19.339 -17.140
  117    H    GLU  18           HN       GLU  18 -14.148  18.830 -10.056
  118    HA   GLU  18           HA       GLU  18 -16.589  20.190  -9.217
  119    HB2  GLU  18           HB2      GLU  18 -13.980  19.752  -7.756
  120    HB3  GLU  18           HB1      GLU  18 -15.414  20.498  -7.070
  121    HG2  GLU  18           HG2      GLU  18 -16.640  18.399  -7.404
  122    HG3  GLU  18           HG1      GLU  18 -15.162  17.661  -8.025
  123    H    PHE  19           HN       PHE  19 -16.869  22.218  -9.847
  124    HA   PHE  19           HA       PHE  19 -14.608  23.924 -10.451
  125    HB2  PHE  19           HB2      PHE  19 -16.337  25.592 -11.092
  126    HB3  PHE  19           HB1      PHE  19 -16.525  24.054 -11.927
  127    HD1  PHE  19           HD2      PHE  19 -18.387  22.570 -11.401
  128    HD2  PHE  19           HD1      PHE  19 -17.991  26.374  -9.527
  129    HE1  PHE  19           HE2      PHE  19 -20.731  22.450 -10.669
  130    HE2  PHE  19           HE1      PHE  19 -20.334  26.255  -8.796
  131    HZ   PHE  19           HZ       PHE  19 -21.706  24.295  -9.367
  132    H    LEU  20           HN       LEU  20 -15.981  22.999  -7.669
  133    HA   LEU  20           HA       LEU  20 -15.339  25.546  -6.369
  134    HB2  LEU  20           HB2      LEU  20 -17.139  24.854  -4.654
  135    HB3  LEU  20           HB1      LEU  20 -17.635  25.580  -6.168
  136    HG   LEU  20           HG       LEU  20 -18.015  23.180  -6.999
  137   HD11  LEU  20          HD11      LEU  20 -17.972  22.629  -4.035
  138   HD12  LEU  20          HD12      LEU  20 -16.795  22.036  -5.206
  139   HD13  LEU  20          HD13      LEU  20 -18.474  21.508  -5.300
  140   HD21  LEU  20          HD21      LEU  20 -20.241  23.102  -5.945
  141   HD22  LEU  20          HD22      LEU  20 -19.824  24.709  -6.534
  142   HD23  LEU  20          HD23      LEU  20 -19.725  24.350  -4.813
  143    H    ALA  21           HN       ALA  21 -15.014  22.147  -6.451
  144    HA   ALA  21           HA       ALA  21 -13.849  20.619  -5.261
  145    HB1  ALA  21           HB1      ALA  21 -11.769  21.344  -4.225
  146    HB2  ALA  21           HB2      ALA  21 -12.301  23.024  -4.293
  147    HB3  ALA  21           HB3      ALA  21 -11.990  22.136  -5.787
  148    H    ALA  22           HN       ALA  22 -15.455  19.855  -3.899
  149    HA   ALA  22           HA       ALA  22 -16.151  21.302  -1.499
  150    HB1  ALA  22           HB1      ALA  22 -17.852  20.076  -2.730
  151    HB2  ALA  22           HB2      ALA  22 -17.698  19.445  -1.090
  152    HB3  ALA  22           HB3      ALA  22 -16.992  18.564  -2.443
  153    H    MET  23           HN       MET  23 -13.448  19.798  -2.096
  154    HA   MET  23           HA       MET  23 -13.277  18.209   0.347
  155    HB2  MET  23           HB2      MET  23 -11.052  17.581  -0.442
  156    HB3  MET  23           HB1      MET  23 -12.253  17.306  -1.698
  157    HG2  MET  23           HG2      MET  23 -11.580  19.445  -2.744
  158    HG3  MET  23           HG1      MET  23 -10.314  19.604  -1.529
  159    HE1  MET  23           HE1      MET  23 -10.464  16.199  -4.629
  160    HE2  MET  23           HE2      MET  23 -11.660  17.494  -4.546
  161    HE3  MET  23           HE3      MET  23 -11.549  16.307  -3.248
  162    H    GLU  24           HN       GLU  24 -13.140  21.364  -0.355
  163    HA   GLU  24           HA       GLU  24 -10.851  22.100   1.232
  164    HB2  GLU  24           HB2      GLU  24 -11.567  23.527  -0.635
  165    HB3  GLU  24           HB1      GLU  24 -13.107  23.811   0.164
  166    HG2  GLU  24           HG2      GLU  24 -11.719  25.721   0.497
  167    HG3  GLU  24           HG1      GLU  24 -11.878  24.883   2.038
  168    HA   PRO  25           HA       PRO  25 -14.412  23.240   4.422
  169    HB2  PRO  25           HB2      PRO  25 -16.496  21.320   3.547
  170    HB3  PRO  25           HB1      PRO  25 -16.665  22.982   4.126
  171    HG2  PRO  25           HG2      PRO  25 -17.000  22.387   1.551
  172    HG3  PRO  25           HG1      PRO  25 -16.199  23.891   2.048
  173    HD2  PRO  25           HD2      PRO  25 -14.989  21.339   1.047
  174    HD3  PRO  25           HD1      PRO  25 -14.555  23.016   0.660
  175    H    GLU  26           HN       GLU  26 -15.789  21.554   5.959
  176    HA   GLU  26           HA       GLU  26 -13.804  19.982   7.140
  177    HB2  GLU  26           HB2      GLU  26 -15.875  20.932   8.225
  178    HB3  GLU  26           HB1      GLU  26 -16.780  19.622   7.481
  179    HG2  GLU  26           HG2      GLU  26 -16.334  18.993   9.714
  180    HG3  GLU  26           HG1      GLU  26 -15.294  18.018   8.679
  181    HA   PRO  27           HA       PRO  27 -13.848  16.578   4.289
  182    HB2  PRO  27           HB2      PRO  27 -12.217  14.943   5.772
  183    HB3  PRO  27           HB1      PRO  27 -11.643  16.247   4.728
  184    HG2  PRO  27           HG2      PRO  27 -12.047  16.232   7.693
  185    HG3  PRO  27           HG1      PRO  27 -10.726  16.934   6.742
  186    HD2  PRO  27           HD2      PRO  27 -12.716  18.445   7.741
  187    HD3  PRO  27           HD1      PRO  27 -11.952  18.807   6.179
  188    H    ALA  28           HN       ALA  28 -15.280  15.025   4.033
  189    HA   ALA  28           HA       ALA  28 -16.525  13.802   6.391
  190    HB1  ALA  28           HB1      ALA  28 -18.269  13.061   4.825
  191    HB2  ALA  28           HB2      ALA  28 -17.366  13.779   3.489
  192    HB3  ALA  28           HB3      ALA  28 -18.037  14.810   4.755
  193    HA   PRO  29           HA       PRO  29 -14.435   9.956   5.913
  194    HB2  PRO  29           HB2      PRO  29 -17.068   8.594   6.053
  195    HB3  PRO  29           HB1      PRO  29 -15.639   8.391   7.071
  196    HG2  PRO  29           HG2      PRO  29 -17.788   9.682   7.977
  197    HG3  PRO  29           HG1      PRO  29 -16.150  10.227   8.387
  198    HD2  PRO  29           HD2      PRO  29 -18.077  11.350   6.397
  199    HD3  PRO  29           HD1      PRO  29 -16.960  12.196   7.487
  200    H    ALA  30           HN       ALA  30 -13.669   9.052   4.146
  201    HA   ALA  30           HA       ALA  30 -15.467   8.075   2.085
  202    HB1  ALA  30           HB1      ALA  30 -14.346   9.166   0.269
  203    HB2  ALA  30           HB2      ALA  30 -13.176   9.898   1.364
  204    HB3  ALA  30           HB3      ALA  30 -14.868  10.395   1.422
  205    HA   PRO  31           HA       PRO  31 -11.133   5.897   1.801
  206    HB2  PRO  31           HB2      PRO  31  -9.625   7.051   4.047
  207    HB3  PRO  31           HB1      PRO  31  -9.102   6.765   2.385
  208    HG2  PRO  31           HG2      PRO  31  -9.528   9.245   3.327
  209    HG3  PRO  31           HG1      PRO  31  -9.882   8.806   1.646
  210    HD2  PRO  31           HD2      PRO  31 -11.755   9.104   3.966
  211    HD3  PRO  31           HD1      PRO  31 -11.953   9.634   2.281
  212    H    ALA  32           HN       ALA  32 -11.256   3.924   2.750
  213    HA   ALA  32           HA       ALA  32 -12.697   3.788   5.283
  214    HB1  ALA  32           HB1      ALA  32 -13.016   1.420   4.729
  215    HB2  ALA  32           HB2      ALA  32 -12.005   1.622   3.299
  216    HB3  ALA  32           HB3      ALA  32 -13.545   2.471   3.414
  217    HA   PRO  33           HA       PRO  33  -9.126   2.575   7.663
  218    HB2  PRO  33           HB2      PRO  33 -10.382   0.910   9.453
  219    HB3  PRO  33           HB1      PRO  33 -10.357   2.670   9.588
  220    HG2  PRO  33           HG2      PRO  33 -12.508   0.880   8.539
  221    HG3  PRO  33           HG1      PRO  33 -12.650   2.345   9.527
  222    HD2  PRO  33           HD2      PRO  33 -13.136   2.339   6.873
  223    HD3  PRO  33           HD1      PRO  33 -12.443   3.743   7.711
  224    H    GLU  34           HN       GLU  34 -11.268   0.387   6.095
  225    HA   GLU  34           HA       GLU  34  -9.403  -1.846   6.300
  226    HB2  GLU  34           HB2      GLU  34 -11.853  -2.200   6.651
  227    HB3  GLU  34           HB1      GLU  34 -12.120  -1.726   4.979
  228    HG2  GLU  34           HG2      GLU  34 -10.864  -3.620   4.194
  229    HG3  GLU  34           HG1      GLU  34 -10.451  -4.069   5.851
  230    H    GLU  35           HN       GLU  35 -11.175  -0.071   3.750
  231    HA   GLU  35           HA       GLU  35  -9.102  -0.820   1.826
  232    HB2  GLU  35           HB2      GLU  35 -11.792   0.508   1.428
  233    HB3  GLU  35           HB1      GLU  35 -10.642   0.195   0.137
  234    HG2  GLU  35           HG2      GLU  35 -11.992  -1.877   1.851
  235    HG3  GLU  35           HG1      GLU  35 -12.370  -1.492   0.172
  236    H    TRP  36           HN       TRP  36  -7.402   0.482   2.131
  237    HA   TRP  36           HA       TRP  36  -7.699   3.251   2.848
  238    HB2  TRP  36           HB2      TRP  36  -5.075   2.024   2.077
  239    HB3  TRP  36           HB1      TRP  36  -5.419   3.217   3.323
  240    HD1  TRP  36           HD1      TRP  36  -7.515   1.705   5.069
  241    HE1  TRP  36           HE1      TRP  36  -6.847  -0.388   6.411
  242    HE3  TRP  36           HE3      TRP  36  -3.313   0.377   2.447
  243    HZ2  TRP  36           HZ2      TRP  36  -4.783  -2.325   6.373
  244    HZ3  TRP  36           HZ3      TRP  36  -2.076  -1.590   3.163
  245    HH2  TRP  36           HH2      TRP  36  -2.781  -2.927   5.062
  246    H    LEU  37           HN       LEU  37  -5.409   4.247   1.525
  247    HA   LEU  37           HA       LEU  37  -6.563   5.112  -0.919
  248    HB2  LEU  37           HB2      LEU  37  -5.100   6.532   0.427
  249    HB3  LEU  37           HB1      LEU  37  -3.765   5.427   0.167
  250    HG   LEU  37           HG       LEU  37  -3.873   5.935  -2.268
  251   HD11  LEU  37          HD11      LEU  37  -5.866   8.015  -1.380
  252   HD12  LEU  37          HD12      LEU  37  -6.188   6.631  -2.425
  253   HD13  LEU  37          HD13      LEU  37  -5.125   7.926  -2.978
  254   HD21  LEU  37          HD21      LEU  37  -2.839   8.132  -2.085
  255   HD22  LEU  37          HD22      LEU  37  -2.288   7.063  -0.794
  256   HD23  LEU  37          HD23      LEU  37  -3.488   8.312  -0.456
  257    H    ASP  38           HN       ASP  38  -6.761   3.781  -2.570
  258    HA   ASP  38           HA       ASP  38  -5.027   1.653  -3.199
  259    HB2  ASP  38           HB2      ASP  38  -6.233   1.919  -5.519
  260    HB3  ASP  38           HB1      ASP  38  -7.102   1.313  -4.118
  261    H    ILE  39           HN       ILE  39  -3.003   1.972  -3.553
  262    HA   ILE  39           HA       ILE  39  -1.714   4.264  -4.403
  263    HB   ILE  39           HB       ILE  39  -0.787   1.413  -4.775
  264   HG12  ILE  39          HG12      ILE  39  -0.595   3.328  -2.449
  265   HG13  ILE  39          HG11      ILE  39  -1.338   1.734  -2.481
  266   HG21  ILE  39          HG21      ILE  39   1.479   2.358  -4.718
  267   HG22  ILE  39          HG22      ILE  39   0.790   3.978  -4.669
  268   HG23  ILE  39          HG23      ILE  39   0.543   2.963  -6.087
  269   HD11  ILE  39          HD11      ILE  39   0.756   1.630  -1.305
  270   HD12  ILE  39          HD12      ILE  39   1.602   2.338  -2.677
  271   HD13  ILE  39          HD13      ILE  39   0.887   0.734  -2.816
  272    H    LEU  40           HN       LEU  40  -2.622   1.430  -6.320
  273    HA   LEU  40           HA       LEU  40  -2.016   2.975  -8.734
  274    HB2  LEU  40           HB2      LEU  40  -2.205   0.008  -8.298
  275    HB3  LEU  40           HB1      LEU  40  -2.145   0.732  -9.896
  276    HG   LEU  40           HG       LEU  40   0.000   0.907  -7.777
  277   HD11  LEU  40          HD11      LEU  40  -0.117  -1.268  -8.858
  278   HD12  LEU  40          HD12      LEU  40   1.321  -0.390  -9.381
  279   HD13  LEU  40          HD13      LEU  40  -0.081  -0.497 -10.443
  280   HD21  LEU  40          HD21      LEU  40  -0.167   2.135 -10.524
  281   HD22  LEU  40          HD22      LEU  40   1.318   2.006  -9.582
  282   HD23  LEU  40          HD23      LEU  40  -0.025   2.975  -8.979
  283    H    GLY  41           HN       GLY  41  -4.473   2.709  -6.876
  284    HA2  GLY  41           HA2      GLY  41  -6.692   3.197  -7.181
  285    HA3  GLY  41           HA1      GLY  41  -6.341   3.403  -8.883
  286    H    ASN  42           HN       ASN  42  -5.351   0.387  -7.918
  287    HA   ASN  42           HA       ASN  42  -7.746  -0.786  -9.097
  288    HB2  ASN  42           HB2      ASN  42  -6.436  -2.705  -9.652
  289    HB3  ASN  42           HB1      ASN  42  -5.517  -1.280 -10.099
  290   HD21  ASN  42          HD21      ASN  42  -4.800  -0.904  -7.156
  291   HD22  ASN  42          HD22      ASN  42  -3.517  -2.028  -6.920
  292    H    GLY  43           HN       GLY  43  -6.328  -0.364  -6.062
  293    HA2  GLY  43           HA2      GLY  43  -7.400  -0.891  -4.048
  294    HA3  GLY  43           HA1      GLY  43  -8.405  -2.047  -4.910
  295    H    LEU  44           HN       LEU  44  -5.774  -3.073  -6.100
  296    HA   LEU  44           HA       LEU  44  -5.387  -5.191  -4.203
  297    HB2  LEU  44           HB2      LEU  44  -4.091  -4.483  -6.833
  298    HB3  LEU  44           HB1      LEU  44  -3.539  -5.834  -5.865
  299    HG   LEU  44           HG       LEU  44  -5.799  -6.823  -6.050
  300   HD11  LEU  44          HD11      LEU  44  -7.134  -4.862  -6.479
  301   HD12  LEU  44          HD12      LEU  44  -7.316  -6.017  -7.800
  302   HD13  LEU  44          HD13      LEU  44  -6.287  -4.600  -8.003
  303   HD21  LEU  44          HD21      LEU  44  -4.335  -6.252  -8.598
  304   HD22  LEU  44          HD22      LEU  44  -5.576  -7.495  -8.410
  305   HD23  LEU  44          HD23      LEU  44  -4.074  -7.599  -7.489
  306    H    LEU  45           HN       LEU  45  -3.992  -2.230  -4.977
  307    HA   LEU  45           HA       LEU  45  -1.724  -2.645  -3.154
  308    HB2  LEU  45           HB2      LEU  45  -1.230  -2.260  -5.622
  309    HB3  LEU  45           HB1      LEU  45  -1.905  -0.671  -5.418
  310    HG   LEU  45           HG       LEU  45  -0.109   0.104  -4.178
  311   HD11  LEU  45          HD11      LEU  45   1.543  -1.360  -3.105
  312   HD12  LEU  45          HD12      LEU  45   0.639  -2.775  -3.653
  313   HD13  LEU  45          HD13      LEU  45  -0.087  -1.657  -2.495
  314   HD21  LEU  45          HD21      LEU  45   1.068  -2.003  -5.979
  315   HD22  LEU  45          HD22      LEU  45   1.861  -0.519  -5.431
  316   HD23  LEU  45          HD23      LEU  45   0.465  -0.431  -6.513
  317    H    ARG  46           HN       ARG  46  -2.133  -1.612  -1.243
  318    HA   ARG  46           HA       ARG  46  -3.151   1.139  -1.364
  319    HB2  ARG  46           HB2      ARG  46  -4.386  -1.101   0.223
  320    HB3  ARG  46           HB1      ARG  46  -4.667   0.598   0.594
  321    HG2  ARG  46           HG2      ARG  46  -5.697   0.968  -1.508
  322    HG3  ARG  46           HG1      ARG  46  -5.209  -0.615  -2.096
  323    HD2  ARG  46           HD2      ARG  46  -7.008  -0.260   0.285
  324    HD3  ARG  46           HD1      ARG  46  -7.627  -0.359  -1.367
  325    HE   ARG  46           HE       ARG  46  -6.513  -2.581  -1.480
  326   HH11  ARG  46          HH11      ARG  46  -7.350  -1.244   1.633
  327   HH12  ARG  46          HH12      ARG  46  -7.552  -2.778   2.392
  328   HH21  ARG  46          HH21      ARG  46  -6.681  -4.612  -0.456
  329   HH22  ARG  46          HH22      ARG  46  -7.115  -4.696   1.218
  330    H    LYS  47           HN       LYS  47  -2.225   2.498   0.050
  331    HA   LYS  47           HA       LYS  47  -0.351   1.370   2.040
  332    HB2  LYS  47           HB2      LYS  47   0.446   2.878   0.067
  333    HB3  LYS  47           HB1      LYS  47  -0.295   4.188   0.960
  334    HG2  LYS  47           HG2      LYS  47   1.178   3.306   2.920
  335    HG3  LYS  47           HG1      LYS  47   2.111   2.573   1.616
  336    HD2  LYS  47           HD2      LYS  47   3.145   4.620   1.933
  337    HD3  LYS  47           HD1      LYS  47   2.085   4.902   0.558
  338    HE2  LYS  47           HE2      LYS  47   0.654   6.242   1.723
  339    HE3  LYS  47           HE1      LYS  47   0.979   5.447   3.261
  340    HZ1  LYS  47           HZ1      LYS  47   1.844   7.728   3.160
  341    HZ2  LYS  47           HZ2      LYS  47   2.861   7.292   1.884
  342    HZ3  LYS  47           HZ3      LYS  47   3.073   6.595   3.420
  343    H    LYS  48           HN       LYS  48  -0.915   1.662   4.154
  344    HA   LYS  48           HA       LYS  48  -2.714   3.921   4.748
  345    HB2  LYS  48           HB2      LYS  48  -3.651   1.642   5.230
  346    HB3  LYS  48           HB1      LYS  48  -2.378   1.434   6.427
  347    HG2  LYS  48           HG2      LYS  48  -3.219   3.279   7.717
  348    HG3  LYS  48           HG1      LYS  48  -4.414   3.651   6.475
  349    HD2  LYS  48           HD2      LYS  48  -5.519   2.491   8.251
  350    HD3  LYS  48           HD1      LYS  48  -5.417   1.400   6.872
  351    HE2  LYS  48           HE2      LYS  48  -4.908   0.299   9.014
  352    HE3  LYS  48           HE1      LYS  48  -3.558   0.227   7.874
  353    HZ1  LYS  48           HZ1      LYS  48  -3.045   0.856  10.287
  354    HZ2  LYS  48           HZ2      LYS  48  -3.756   2.356   9.939
  355    HZ3  LYS  48           HZ3      LYS  48  -2.391   1.844   9.078
  356    H    THR  49           HN       THR  49  -1.899   5.511   5.824
  357    HA   THR  49           HA       THR  49   0.733   5.466   6.948
  358    HB   THR  49           HB       THR  49  -0.024   7.829   7.677
  359    HG1  THR  49           HG1      THR  49  -2.135   8.050   7.382
  360   HG21  THR  49          HG21      THR  49   0.291   8.652   5.364
  361   HG22  THR  49          HG22      THR  49   0.102   7.000   4.775
  362   HG23  THR  49          HG23      THR  49   1.467   7.416   5.812
  363    H    LEU  50           HN       LEU  50   0.948   4.227   8.735
  364    HA   LEU  50           HA       LEU  50  -0.836   4.280  10.970
  365    HB2  LEU  50           HB2      LEU  50   2.118   3.784  11.210
  366    HB3  LEU  50           HB1      LEU  50   0.808   3.041  12.106
  367    HG   LEU  50           HG       LEU  50   1.308   2.500   9.181
  368   HD11  LEU  50          HD11      LEU  50   2.238   0.933  11.582
  369   HD12  LEU  50          HD12      LEU  50   3.260   1.853  10.474
  370   HD13  LEU  50          HD13      LEU  50   2.384   0.435   9.894
  371   HD21  LEU  50          HD21      LEU  50  -0.069   0.542   9.588
  372   HD22  LEU  50          HD22      LEU  50  -0.945   2.016  10.001
  373   HD23  LEU  50          HD23      LEU  50  -0.260   1.010  11.277
  374    H    VAL  51           HN       VAL  51   2.368   5.525  10.418
  375    HA   VAL  51           HA       VAL  51   1.633   8.147  11.544
  376    HB   VAL  51           HB       VAL  51   4.337   6.818  11.694
  377   HG11  VAL  51          HG11      VAL  51   4.517   9.213  11.560
  378   HG12  VAL  51          HG12      VAL  51   4.913   8.699  13.199
  379   HG13  VAL  51          HG13      VAL  51   3.340   9.418  12.853
  380   HG21  VAL  51          HG21      VAL  51   2.332   7.248  13.902
  381   HG22  VAL  51          HG22      VAL  51   3.968   6.620  14.110
  382   HG23  VAL  51          HG23      VAL  51   2.780   5.704  13.183
  383    HA   PRO  52           HA       PRO  52   3.511   8.905   7.549
  384    HB2  PRO  52           HB2      PRO  52   1.853  10.897   6.849
  385    HB3  PRO  52           HB1      PRO  52   1.372   9.197   6.927
  386    HG2  PRO  52           HG2      PRO  52   0.523  11.392   8.634
  387    HG3  PRO  52           HG1      PRO  52  -0.136   9.760   8.522
  388    HD2  PRO  52           HD2      PRO  52   1.877  10.847  10.401
  389    HD3  PRO  52           HD1      PRO  52   0.825   9.419  10.568
  390    H    GLY  53           HN       GLY  53   5.293   9.695   9.238
  391    HA2  GLY  53           HA2      GLY  53   7.105  11.107   9.205
  392    HA3  GLY  53           HA1      GLY  53   6.269  12.068   7.999
  393    HA   PRO  54           HA       PRO  54   6.083  14.300  12.145
  394    HB2  PRO  54           HB2      PRO  54   8.390  15.667  12.182
  395    HB3  PRO  54           HB1      PRO  54   8.288  14.029  12.846
  396    HG2  PRO  54           HG2      PRO  54   9.327  14.929  10.182
  397    HG3  PRO  54           HG1      PRO  54  10.021  13.752  11.314
  398    HD2  PRO  54           HD2      PRO  54   8.553  13.051   9.123
  399    HD3  PRO  54           HD1      PRO  54   8.643  12.064  10.595
  400    HA   PRO  55           HA       PRO  55   4.734  17.897   9.894
  401    HB2  PRO  55           HB2      PRO  55   5.898  19.536  12.088
  402    HB3  PRO  55           HB1      PRO  55   4.258  19.533  11.430
  403    HG2  PRO  55           HG2      PRO  55   4.769  18.420  13.791
  404    HG3  PRO  55           HG1      PRO  55   3.625  17.672  12.662
  405    HD2  PRO  55           HD2      PRO  55   6.446  16.897  13.290
  406    HD3  PRO  55           HD1      PRO  55   5.038  15.866  12.972
  407    H    GLY  56           HN       GLY  56   6.128  17.914   8.132
  408    HA2  GLY  56           HA2      GLY  56   7.568  19.470   6.950
  409    HA3  GLY  56           HA1      GLY  56   8.485  19.667   8.435
  410    H    SER  57           HN       SER  57   7.367  16.714   6.801
  411    HA   SER  57           HA       SER  57  10.064  15.669   6.856
  412    HB2  SER  57           HB2      SER  57   8.658  13.720   5.712
  413    HB3  SER  57           HB1      SER  57   8.633  13.974   7.456
  414    HG   SER  57           HG       SER  57   6.659  14.374   5.544
  415    H    SER  58           HN       SER  58  10.065  14.065   4.635
  416    HA   SER  58           HA       SER  58   9.476  15.659   2.288
  417    HB2  SER  58           HB2      SER  58  12.287  14.675   2.836
  418    HB3  SER  58           HB1      SER  58  11.742  15.580   1.418
  419    HG   SER  58           HG       SER  58  11.060  16.937   3.602
  420    H    ARG  59           HN       ARG  59   9.274  14.363   0.431
  421    HA   ARG  59           HA       ARG  59   9.218  11.507   1.023
  422    HB2  ARG  59           HB2      ARG  59   8.119  12.966  -1.388
  423    HB3  ARG  59           HB1      ARG  59   7.842  11.276  -0.958
  424    HG2  ARG  59           HG2      ARG  59   6.759  12.017   1.120
  425    HG3  ARG  59           HG1      ARG  59   6.961  13.686   0.608
  426    HD2  ARG  59           HD2      ARG  59   5.520  13.339  -1.286
  427    HD3  ARG  59           HD1      ARG  59   5.417  11.611  -0.938
  428    HE   ARG  59           HE       ARG  59   4.521  12.658   1.354
  429   HH11  ARG  59          HH11      ARG  59   3.670  13.430  -1.975
  430   HH12  ARG  59          HH12      ARG  59   2.041  13.897  -1.573
  431   HH21  ARG  59          HH21      ARG  59   2.402  13.241   1.858
  432   HH22  ARG  59          HH22      ARG  59   1.308  13.766   0.609
  433    HA   PRO  60           HA       PRO  60  13.272  11.016  -0.728
  434    HB2  PRO  60           HB2      PRO  60  12.861   8.284  -1.190
  435    HB3  PRO  60           HB1      PRO  60  13.522   8.997   0.285
  436    HG2  PRO  60           HG2      PRO  60  10.708   8.186  -0.335
  437    HG3  PRO  60           HG1      PRO  60  11.635   7.959   1.164
  438    HD2  PRO  60           HD2      PRO  60   9.840   9.883   1.051
  439    HD3  PRO  60           HD1      PRO  60  11.433  10.229   1.755
  440    H    VAL  61           HN       VAL  61  14.142  10.878  -2.757
  441    HA   VAL  61           HA       VAL  61  12.226  10.820  -4.943
  442    HB   VAL  61           HB       VAL  61  15.186  11.271  -5.213
  443   HG11  VAL  61          HG11      VAL  61  13.961  10.855  -7.274
  444   HG12  VAL  61          HG12      VAL  61  14.550  12.515  -7.211
  445   HG13  VAL  61          HG13      VAL  61  12.853  12.172  -6.886
  446   HG21  VAL  61          HG21      VAL  61  14.754  13.685  -5.039
  447   HG22  VAL  61          HG22      VAL  61  14.391  12.840  -3.533
  448   HG23  VAL  61          HG23      VAL  61  13.081  13.339  -4.604
  449    H    LYS  62           HN       LYS  62  12.312   9.401  -6.632
  450    HA   LYS  62           HA       LYS  62  13.253   6.776  -6.119
  451    HB2  LYS  62           HB2      LYS  62  12.160   8.125  -8.596
  452    HB3  LYS  62           HB1      LYS  62  12.652   6.437  -8.584
  453    HG2  LYS  62           HG2      LYS  62  11.009   5.923  -6.894
  454    HG3  LYS  62           HG1      LYS  62  10.567   7.630  -6.772
  455    HD2  LYS  62           HD2      LYS  62   9.754   7.615  -9.051
  456    HD3  LYS  62           HD1      LYS  62  10.293   5.946  -9.258
  457    HE2  LYS  62           HE2      LYS  62   8.727   5.210  -7.549
  458    HE3  LYS  62           HE1      LYS  62   8.218   6.877  -7.275
  459    HZ1  LYS  62           HZ1      LYS  62   6.609   5.947  -8.670
  460    HZ2  LYS  62           HZ2      LYS  62   7.756   5.199  -9.667
  461    HZ3  LYS  62           HZ3      LYS  62   7.575   6.882  -9.703
  462    H    GLY  63           HN       GLY  63  15.268   6.374  -5.982
  463    HA2  GLY  63           HA2      GLY  63  17.235   6.064  -7.630
  464    HA3  GLY  63           HA1      GLY  63  17.211   7.829  -7.610
  465    H    GLN  64           HN       GLN  64  16.336   7.952  -4.828
  466    HA   GLN  64           HA       GLN  64  18.906   7.723  -3.554
  467    HB2  GLN  64           HB2      GLN  64  16.352   8.076  -2.024
  468    HB3  GLN  64           HB1      GLN  64  17.948   8.737  -1.686
  469    HG2  GLN  64           HG2      GLN  64  16.030   9.663  -3.812
  470    HG3  GLN  64           HG1      GLN  64  16.395  10.475  -2.297
  471   HE21  GLN  64          HE21      GLN  64  18.703   9.000  -4.553
  472   HE22  GLN  64          HE22      GLN  64  19.528  10.485  -4.918
  473    H    VAL  65           HN       VAL  65  19.621   6.061  -2.266
  474    HA   VAL  65           HA       VAL  65  17.881   3.753  -2.124
  475    HB   VAL  65           HB       VAL  65  19.707   2.491  -1.231
  476   HG11  VAL  65          HG11      VAL  65  19.708   2.862  -3.638
  477   HG12  VAL  65          HG12      VAL  65  21.349   2.696  -3.014
  478   HG13  VAL  65          HG13      VAL  65  20.721   4.290  -3.424
  479   HG21  VAL  65          HG21      VAL  65  21.917   3.490  -0.787
  480   HG22  VAL  65          HG22      VAL  65  20.662   4.036   0.325
  481   HG23  VAL  65          HG23      VAL  65  21.205   5.093  -0.983
  482    H    VAL  66           HN       VAL  66  16.531   3.497  -0.580
  483    HA   VAL  66           HA       VAL  66  16.799   5.185   1.804
  484    HB   VAL  66           HB       VAL  66  14.322   5.054   1.943
  485   HG11  VAL  66          HG11      VAL  66  15.516   6.159  -0.593
  486   HG12  VAL  66          HG12      VAL  66  15.265   7.009   0.934
  487   HG13  VAL  66          HG13      VAL  66  13.881   6.517  -0.040
  488   HG21  VAL  66          HG21      VAL  66  14.466   3.892  -0.832
  489   HG22  VAL  66          HG22      VAL  66  13.020   4.203   0.133
  490   HG23  VAL  66          HG23      VAL  66  14.146   2.934   0.616
  491    H    THR  67           HN       THR  67  16.326   4.362   3.819
  492    HA   THR  67           HA       THR  67  16.492   1.461   4.013
  493    HB   THR  67           HB       THR  67  16.732   1.797   6.432
  494    HG1  THR  67           HG1      THR  67  17.045   4.115   7.066
  495   HG21  THR  67          HG21      THR  67  18.582   3.647   4.938
  496   HG22  THR  67          HG22      THR  67  18.746   1.891   5.019
  497   HG23  THR  67          HG23      THR  67  18.875   2.859   6.491
  498    H    VAL  68           HN       VAL  68  14.579   0.461   3.823
  499    HA   VAL  68           HA       VAL  68  12.436   1.543   5.494
  500    HB   VAL  68           HB       VAL  68  10.871   0.048   4.279
  501   HG11  VAL  68          HG11      VAL  68  11.087   2.397   3.629
  502   HG12  VAL  68          HG12      VAL  68  10.747   1.380   2.228
  503   HG13  VAL  68          HG13      VAL  68  12.384   1.976   2.510
  504   HG21  VAL  68          HG21      VAL  68  12.459  -1.625   3.513
  505   HG22  VAL  68          HG22      VAL  68  13.226  -0.441   2.457
  506   HG23  VAL  68          HG23      VAL  68  11.565  -0.951   2.153
  507    H    HIS  69           HN       HIS  69  11.609   0.316   7.109
  508    HA   HIS  69           HA       HIS  69  12.839  -2.331   7.478
  509    HB2  HIS  69           HB2      HIS  69  12.982  -0.908   9.477
  510    HB3  HIS  69           HB1      HIS  69  11.247  -0.610   9.426
  511    HD1  HIS  69           HD1      HIS  69  12.606  -1.942  11.937
  512    HD2  HIS  69           HD2      HIS  69  10.774  -3.983   8.824
  513    HE1  HIS  69           HE1      HIS  69  11.971  -4.212  12.851
  514    HE2  HIS  69           HE2      HIS  69  10.710  -5.323  11.027
  515    H    LEU  70           HN       LEU  70  11.651  -3.960   6.675
  516    HA   LEU  70           HA       LEU  70   8.765  -3.527   6.735
  517    HB2  LEU  70           HB2      LEU  70   8.409  -4.349   4.681
  518    HB3  LEU  70           HB1      LEU  70  10.042  -3.780   4.422
  519    HG   LEU  70           HG       LEU  70   9.400  -6.613   5.188
  520   HD11  LEU  70          HD11      LEU  70   9.789  -5.439   2.428
  521   HD12  LEU  70          HD12      LEU  70   8.287  -6.093   3.081
  522   HD13  LEU  70          HD13      LEU  70   9.666  -7.157   2.806
  523   HD21  LEU  70          HD21      LEU  70  11.704  -5.844   5.587
  524   HD22  LEU  70          HD22      LEU  70  11.835  -5.376   3.890
  525   HD23  LEU  70          HD23      LEU  70  11.623  -7.074   4.322
  526    H    GLN  71           HN       GLN  71   7.577  -4.887   7.726
  527    HA   GLN  71           HA       GLN  71   8.491  -7.663   8.063
  528    HB2  GLN  71           HB2      GLN  71   6.593  -6.554  10.051
  529    HB3  GLN  71           HB1      GLN  71   7.785  -7.826  10.252
  530    HG2  GLN  71           HG2      GLN  71   8.777  -6.261  11.520
  531    HG3  GLN  71           HG1      GLN  71   9.445  -5.789   9.964
  532   HE21  GLN  71          HE21      GLN  71   6.711  -4.852   9.184
  533   HE22  GLN  71          HE22      GLN  71   6.601  -3.294   9.911
  534    H    THR  72           HN       THR  72   7.226  -8.838   6.993
  535    HA   THR  72           HA       THR  72   4.812  -7.579   5.956
  536    HB   THR  72           HB       THR  72   6.601  -9.686   4.783
  537    HG1  THR  72           HG1      THR  72   7.580  -8.062   3.793
  538   HG21  THR  72          HG21      THR  72   4.352  -9.982   4.022
  539   HG22  THR  72          HG22      THR  72   5.306  -9.256   2.724
  540   HG23  THR  72          HG23      THR  72   4.207  -8.256   3.683
  541    H    SER  73           HN       SER  73   2.937  -8.465   6.311
  542    HA   SER  73           HA       SER  73   2.850 -11.116   7.559
  543    HB2  SER  73           HB2      SER  73   0.454  -9.365   7.621
  544    HB3  SER  73           HB1      SER  73   1.172 -10.336   8.908
  545    HG   SER  73           HG       SER  73   1.857  -7.741   8.036
  546    H    LEU  74           HN       LEU  74   1.270 -12.544   6.881
  547    HA   LEU  74           HA       LEU  74   0.470 -12.388   4.138
  548    HB2  LEU  74           HB2      LEU  74  -0.067 -14.347   6.353
  549    HB3  LEU  74           HB1      LEU  74  -0.673 -14.565   4.730
  550    HG   LEU  74           HG       LEU  74   2.114 -14.762   5.764
  551   HD11  LEU  74          HD11      LEU  74   2.128 -16.782   4.418
  552   HD12  LEU  74          HD12      LEU  74   0.504 -16.407   3.826
  553   HD13  LEU  74          HD13      LEU  74   0.764 -16.765   5.537
  554   HD21  LEU  74          HD21      LEU  74   2.287 -13.112   4.006
  555   HD22  LEU  74          HD22      LEU  74   1.380 -14.155   2.905
  556   HD23  LEU  74          HD23      LEU  74   2.974 -14.648   3.475
  557    H    GLU  75           HN       GLU  75  -1.804 -12.650   3.494
  558    HA   GLU  75           HA       GLU  75  -3.579 -10.838   4.613
  559    HB2  GLU  75           HB2      GLU  75  -5.332 -12.179   3.344
  560    HB3  GLU  75           HB1      GLU  75  -3.984 -11.548   2.411
  561    HG2  GLU  75           HG2      GLU  75  -2.924 -13.695   2.374
  562    HG3  GLU  75           HG1      GLU  75  -4.150 -14.359   3.453
  563    H    ASN  76           HN       ASN  76  -2.599 -13.846   5.747
  564    HA   ASN  76           HA       ASN  76  -5.005 -14.489   7.242
  565    HB2  ASN  76           HB2      ASN  76  -2.260 -15.775   7.269
  566    HB3  ASN  76           HB1      ASN  76  -3.682 -16.405   8.082
  567   HD21  ASN  76          HD21      ASN  76  -3.802 -14.975   4.889
  568   HD22  ASN  76          HD22      ASN  76  -4.105 -16.437   4.030
  569    H    GLY  77           HN       GLY  77  -2.241 -12.563   7.593
  570    HA2  GLY  77           HA2      GLY  77  -1.973 -11.105   9.481
  571    HA3  GLY  77           HA1      GLY  77  -2.674 -12.357  10.500
  572    H    THR  78           HN       THR  78  -0.751 -14.044   8.564
  573    HA   THR  78           HA       THR  78   1.212 -14.377  10.615
  574    HB   THR  78           HB       THR  78   1.076 -15.747   7.934
  575    HG1  THR  78           HG1      THR  78   0.112 -17.374   9.688
  576   HG21  THR  78          HG21      THR  78   3.199 -16.006   9.150
  577   HG22  THR  78          HG22      THR  78   2.310 -17.528   9.058
  578   HG23  THR  78          HG23      THR  78   2.313 -16.597  10.558
  579    H    ARG  79           HN       ARG  79   2.855 -12.971  10.746
  580    HA   ARG  79           HA       ARG  79   3.951 -11.686   8.436
  581    HB2  ARG  79           HB2      ARG  79   4.895 -11.786  11.302
  582    HB3  ARG  79           HB1      ARG  79   5.687 -10.851  10.033
  583    HG2  ARG  79           HG2      ARG  79   3.202  -9.981   9.679
  584    HG3  ARG  79           HG1      ARG  79   3.105 -10.392  11.395
  585    HD2  ARG  79           HD2      ARG  79   4.965  -8.963  11.907
  586    HD3  ARG  79           HD1      ARG  79   5.247  -8.644  10.187
  587    HE   ARG  79           HE       ARG  79   2.648  -7.855  10.682
  588   HH11  ARG  79          HH11      ARG  79   5.781  -6.978  12.002
  589   HH12  ARG  79          HH12      ARG  79   5.347  -5.321  12.266
  590   HH21  ARG  79          HH21      ARG  79   2.074  -5.667  11.030
  591   HH22  ARG  79          HH22      ARG  79   3.239  -4.567  11.717
  592    H    VAL  80           HN       VAL  80   5.307 -12.473   7.068
  593    HA   VAL  80           HA       VAL  80   6.486 -15.080   7.660
  594    HB   VAL  80           HB       VAL  80   6.690 -15.273   5.195
  595   HG11  VAL  80          HG11      VAL  80   4.776 -16.199   6.374
  596   HG12  VAL  80          HG12      VAL  80   4.296 -15.581   4.792
  597   HG13  VAL  80          HG13      VAL  80   3.942 -14.648   6.248
  598   HG21  VAL  80          HG21      VAL  80   5.173 -12.669   5.210
  599   HG22  VAL  80          HG22      VAL  80   5.461 -13.671   3.787
  600   HG23  VAL  80          HG23      VAL  80   6.818 -12.914   4.625
  601    H    GLN  81           HN       GLN  81   7.401 -11.863   7.337
  602    HA   GLN  81           HA       GLN  81  10.192 -12.561   7.322
  603    HB2  GLN  81           HB2      GLN  81  10.748 -11.183   5.351
  604    HB3  GLN  81           HB1      GLN  81   9.736 -12.555   4.928
  605    HG2  GLN  81           HG2      GLN  81   7.770 -11.069   4.899
  606    HG3  GLN  81           HG1      GLN  81   8.828  -9.700   5.230
  607   HE21  GLN  81          HE21      GLN  81   7.083 -10.316   2.956
  608   HE22  GLN  81          HE22      GLN  81   8.095 -10.219   1.558
  609    H    GLU  82           HN       GLU  82  11.341 -11.130   8.452
  610    HA   GLU  82           HA       GLU  82  10.305  -8.412   8.723
  611    HB2  GLU  82           HB2      GLU  82   9.682  -9.627  10.771
  612    HB3  GLU  82           HB1      GLU  82  11.367 -10.067  11.019
  613    HG2  GLU  82           HG2      GLU  82  11.988  -7.776  11.327
  614    HG3  GLU  82           HG1      GLU  82  10.370  -7.234  10.896
  615    H    GLU  83           HN       GLU  83  11.746  -7.105   7.974
  616    HA   GLU  83           HA       GLU  83  14.574  -7.663   8.456
  617    HB2  GLU  83           HB2      GLU  83  14.502  -8.258   6.245
  618    HB3  GLU  83           HB1      GLU  83  13.139  -7.216   5.898
  619    HG2  GLU  83           HG2      GLU  83  14.497  -5.337   5.620
  620    HG3  GLU  83           HG1      GLU  83  15.888  -6.125   6.372
  621    HA   PRO  84           HA       PRO  84  13.893  -3.771  10.426
  622    HB2  PRO  84           HB2      PRO  84  16.732  -3.969  11.144
  623    HB3  PRO  84           HB1      PRO  84  15.312  -3.953  12.190
  624    HG2  PRO  84           HG2      PRO  84  16.771  -6.177  11.824
  625    HG3  PRO  84           HG1      PRO  84  15.013  -6.236  12.042
  626    HD2  PRO  84           HD2      PRO  84  16.615  -6.424   9.520
  627    HD3  PRO  84           HD1      PRO  84  15.202  -7.376  10.027
  628    H    GLU  85           HN       GLU  85  16.070  -4.367   7.875
  629    HA   GLU  85           HA       GLU  85  16.195  -1.585   7.228
  630    HB2  GLU  85           HB2      GLU  85  18.095  -2.011   8.927
  631    HB3  GLU  85           HB1      GLU  85  18.868  -2.927   7.642
  632    HG2  GLU  85           HG2      GLU  85  19.824  -0.811   7.471
  633    HG3  GLU  85           HG1      GLU  85  18.573  -0.804   6.224
  634    H    LEU  86           HN       LEU  86  15.402  -1.926   5.360
  635    HA   LEU  86           HA       LEU  86  16.935  -3.538   3.453
  636    HB2  LEU  86           HB2      LEU  86  14.724  -4.414   3.648
  637    HB3  LEU  86           HB1      LEU  86  14.021  -2.813   3.596
  638    HG   LEU  86           HG       LEU  86  14.642  -2.569   1.280
  639   HD11  LEU  86          HD11      LEU  86  16.675  -3.915   1.253
  640   HD12  LEU  86          HD12      LEU  86  15.556  -4.455   0.004
  641   HD13  LEU  86          HD13      LEU  86  15.724  -5.382   1.496
  642   HD21  LEU  86          HD21      LEU  86  13.141  -4.299   0.344
  643   HD22  LEU  86          HD22      LEU  86  12.479  -3.521   1.780
  644   HD23  LEU  86          HD23      LEU  86  13.182  -5.135   1.900
  645    H    VAL  87           HN       VAL  87  18.277  -2.132   2.499
  646    HA   VAL  87           HA       VAL  87  17.250   0.522   1.782
  647    HB   VAL  87           HB       VAL  87  19.398   0.352   3.089
  648   HG11  VAL  87          HG11      VAL  87  20.498  -0.721   0.506
  649   HG12  VAL  87          HG12      VAL  87  20.351  -1.611   2.019
  650   HG13  VAL  87          HG13      VAL  87  21.446  -0.233   1.908
  651   HG21  VAL  87          HG21      VAL  87  19.554   1.661   0.382
  652   HG22  VAL  87          HG22      VAL  87  20.565   2.046   1.776
  653   HG23  VAL  87          HG23      VAL  87  18.828   2.348   1.837
  654    H    PHE  88           HN       PHE  88  16.978   1.087  -0.320
  655    HA   PHE  88           HA       PHE  88  18.008  -0.583  -2.467
  656    HB2  PHE  88           HB2      PHE  88  15.863  -1.225  -3.361
  657    HB3  PHE  88           HB1      PHE  88  15.987  -1.813  -1.707
  658    HD1  PHE  88           HD2      PHE  88  14.797  -0.560   0.113
  659    HD2  PHE  88           HD1      PHE  88  14.139   0.218  -4.018
  660    HE1  PHE  88           HE2      PHE  88  12.670   0.539   0.665
  661    HE2  PHE  88           HE1      PHE  88  12.007   1.314  -3.479
  662    HZ   PHE  88           HZ       PHE  88  11.263   1.463  -1.144
  663    H    THR  89           HN       THR  89  17.667   0.294  -4.538
  664    HA   THR  89           HA       THR  89  17.513   3.145  -4.608
  665    HB   THR  89           HB       THR  89  17.417   1.307  -6.997
  666    HG1  THR  89           HG1      THR  89  19.294   0.576  -6.333
  667   HG21  THR  89          HG21      THR  89  18.620   4.047  -6.569
  668   HG22  THR  89          HG22      THR  89  17.118   3.697  -7.426
  669   HG23  THR  89          HG23      THR  89  18.657   3.130  -8.079
  670    H    LEU  90           HN       LEU  90  15.612   4.127  -4.383
  671    HA   LEU  90           HA       LEU  90  13.078   3.036  -4.866
  672    HB2  LEU  90           HB2      LEU  90  13.733   5.138  -3.559
  673    HB3  LEU  90           HB1      LEU  90  13.758   5.956  -5.093
  674    HG   LEU  90           HG       LEU  90  11.409   5.506  -5.434
  675   HD11  LEU  90          HD11      LEU  90  11.509   4.100  -2.773
  676   HD12  LEU  90          HD12      LEU  90  11.367   3.308  -4.343
  677   HD13  LEU  90          HD13      LEU  90  10.077   4.366  -3.770
  678   HD21  LEU  90          HD21      LEU  90  11.906   6.554  -2.650
  679   HD22  LEU  90          HD22      LEU  90  10.494   6.872  -3.659
  680   HD23  LEU  90          HD23      LEU  90  12.073   7.491  -4.136
  681    H    GLY  91           HN       GLY  91  11.814   2.892  -6.678
  682    HA2  GLY  91           HA2      GLY  91  11.040   3.358  -8.810
  683    HA3  GLY  91           HA1      GLY  91  12.270   4.601  -8.960
  684    H    ASP  92           HN       ASP  92  13.655   1.764  -7.913
  685    HA   ASP  92           HA       ASP  92  14.655   1.224 -10.621
  686    HB2  ASP  92           HB2      ASP  92  16.374   1.877  -9.035
  687    HB3  ASP  92           HB1      ASP  92  15.839   0.634  -7.908
  688    H    CYS  93           HN       CYS  93  12.461   0.120  -8.467
  689    HA   CYS  93           HA       CYS  93  11.333  -1.825  -8.145
  690    HB2  CYS  93           HB2      CYS  93  12.625  -2.734 -10.729
  691    HB3  CYS  93           HB1      CYS  93  11.168  -3.393  -9.986
  692    HG   CYS  93           HG       CYS  93   9.503  -1.838 -11.159
  693    H    ASP  94           HN       ASP  94  13.978  -1.458  -7.046
  694    HA   ASP  94           HA       ASP  94  15.483  -3.858  -7.310
  695    HB2  ASP  94           HB2      ASP  94  16.435  -1.682  -6.521
  696    HB3  ASP  94           HB1      ASP  94  15.534  -1.874  -5.019
  697    H    VAL  95           HN       VAL  95  12.691  -2.981  -5.799
  698    HA   VAL  95           HA       VAL  95  12.677  -5.289  -3.969
  699    HB   VAL  95           HB       VAL  95  11.002  -3.899  -2.654
  700   HG11  VAL  95          HG11      VAL  95  13.310  -4.184  -1.920
  701   HG12  VAL  95          HG12      VAL  95  12.729  -2.559  -1.559
  702   HG13  VAL  95          HG13      VAL  95  13.804  -2.825  -2.931
  703   HG21  VAL  95          HG21      VAL  95  12.074  -1.749  -4.490
  704   HG22  VAL  95          HG22      VAL  95  11.141  -1.443  -3.022
  705   HG23  VAL  95          HG23      VAL  95  10.405  -2.307  -4.369
  706    H    ILE  96           HN       ILE  96   9.859  -4.752  -3.362
  707    HA   ILE  96           HA       ILE  96   8.635  -5.860  -5.736
  708    HB   ILE  96           HB       ILE  96   6.627  -6.094  -4.335
  709   HG12  ILE  96          HG12      ILE  96   8.321  -4.921  -2.115
  710   HG13  ILE  96          HG11      ILE  96   6.981  -4.090  -2.901
  711   HG21  ILE  96          HG21      ILE  96   9.146  -7.129  -3.049
  712   HG22  ILE  96          HG22      ILE  96   8.245  -7.888  -4.362
  713   HG23  ILE  96          HG23      ILE  96   7.523  -7.750  -2.759
  714   HD11  ILE  96          HD11      ILE  96   6.802  -6.612  -1.270
  715   HD12  ILE  96          HD12      ILE  96   5.451  -5.804  -2.065
  716   HD13  ILE  96          HD13      ILE  96   6.316  -4.996  -0.760
  717    H    GLN  97           HN       GLN  97   7.142  -4.755  -6.934
  718    HA   GLN  97           HA       GLN  97   7.627  -2.023  -7.210
  719    HB2  GLN  97           HB2      GLN  97   6.631  -3.726  -8.913
  720    HB3  GLN  97           HB1      GLN  97   5.081  -3.229  -8.240
  721    HG2  GLN  97           HG2      GLN  97   5.383  -1.850 -10.091
  722    HG3  GLN  97           HG1      GLN  97   5.835  -0.841  -8.718
  723   HE21  GLN  97          HE21      GLN  97   8.090  -0.359  -8.378
  724   HE22  GLN  97          HE22      GLN  97   9.216  -0.521  -9.677
  725    H    ALA  98           HN       ALA  98   5.192  -3.726  -5.386
  726    HA   ALA  98           HA       ALA  98   3.418  -1.683  -4.744
  727    HB1  ALA  98           HB1      ALA  98   3.016  -2.918  -2.657
  728    HB2  ALA  98           HB2      ALA  98   4.454  -3.891  -2.970
  729    HB3  ALA  98           HB3      ALA  98   3.070  -3.990  -4.054
  730    H    LEU  99           HN       LEU  99   6.471  -2.573  -3.218
  731    HA   LEU  99           HA       LEU  99   6.304  -0.497  -1.239
  732    HB2  LEU  99           HB2      LEU  99   7.497  -2.557  -0.729
  733    HB3  LEU  99           HB1      LEU  99   8.626  -2.239  -2.036
  734    HG   LEU  99           HG       LEU  99   9.440  -0.243  -0.863
  735   HD11  LEU  99          HD11      LEU  99   7.499  -1.073   1.287
  736   HD12  LEU  99          HD12      LEU  99   7.409   0.380   0.292
  737   HD13  LEU  99          HD13      LEU  99   8.729   0.183   1.446
  738   HD21  LEU  99          HD21      LEU  99  10.559  -1.360   0.989
  739   HD22  LEU  99          HD22      LEU  99  10.549  -2.372  -0.455
  740   HD23  LEU  99          HD23      LEU  99   9.431  -2.709   0.866
  741    H    ASP 100           HN       ASP 100   7.825  -0.952  -4.316
  742    HA   ASP 100           HA       ASP 100   9.714   1.124  -4.197
  743    HB2  ASP 100           HB2      ASP 100   9.803  -0.729  -5.810
  744    HB3  ASP 100           HB1      ASP 100   8.344  -0.148  -6.581
  745    H    LEU 101           HN       LEU 101   6.336   0.993  -5.007
  746    HA   LEU 101           HA       LEU 101   6.248   3.783  -5.768
  747    HB2  LEU 101           HB2      LEU 101   4.074   1.719  -5.473
  748    HB3  LEU 101           HB1      LEU 101   3.863   3.326  -6.118
  749    HG   LEU 101           HG       LEU 101   5.542   1.144  -7.334
  750   HD11  LEU 101          HD11      LEU 101   3.159   0.752  -7.566
  751   HD12  LEU 101          HD12      LEU 101   3.877   1.179  -9.117
  752   HD13  LEU 101          HD13      LEU 101   2.941   2.373  -8.220
  753   HD21  LEU 101          HD21      LEU 101   5.009   3.961  -8.288
  754   HD22  LEU 101          HD22      LEU 101   5.810   2.704  -9.228
  755   HD23  LEU 101          HD23      LEU 101   6.558   3.306  -7.751
  756    H    SER 102           HN       SER 102   5.492   1.786  -2.992
  757    HA   SER 102           HA       SER 102   3.721   3.525  -1.678
  758    HB2  SER 102           HB2      SER 102   3.907   1.174  -1.045
  759    HB3  SER 102           HB1      SER 102   5.580   1.421  -0.548
  760    HG   SER 102           HG       SER 102   4.870   2.715   1.126
  761    H    VAL 103           HN       VAL 103   7.209   3.261  -1.717
  762    HA   VAL 103           HA       VAL 103   7.768   4.849   0.514
  763    HB   VAL 103           HB       VAL 103   9.398   4.259  -1.917
  764   HG11  VAL 103          HG11      VAL 103  10.293   5.533   0.680
  765   HG12  VAL 103          HG12      VAL 103  10.193   6.343  -0.883
  766   HG13  VAL 103          HG13      VAL 103  11.345   5.036  -0.641
  767   HG21  VAL 103          HG21      VAL 103   9.138   3.074   0.818
  768   HG22  VAL 103          HG22      VAL 103  10.613   2.866  -0.121
  769   HG23  VAL 103          HG23      VAL 103   9.072   2.277  -0.755
  770    HA   PRO 104           HA       PRO 104   8.286   8.668  -2.457
  771    HB2  PRO 104           HB2      PRO 104   6.946   8.427  -4.857
  772    HB3  PRO 104           HB1      PRO 104   8.679   8.154  -4.649
  773    HG2  PRO 104           HG2      PRO 104   6.453   6.162  -4.755
  774    HG3  PRO 104           HG1      PRO 104   8.064   6.082  -5.482
  775    HD2  PRO 104           HD2      PRO 104   7.482   4.744  -3.250
  776    HD3  PRO 104           HD1      PRO 104   9.074   5.477  -3.504
  777    H    LEU 105           HN       LEU 105   5.463   6.627  -2.295
  778    HA   LEU 105           HA       LEU 105   3.613   8.845  -2.152
  779    HB2  LEU 105           HB2      LEU 105   3.424   5.883  -1.766
  780    HB3  LEU 105           HB1      LEU 105   2.083   6.931  -1.306
  781    HG   LEU 105           HG       LEU 105   3.177   6.364  -4.040
  782   HD11  LEU 105          HD11      LEU 105   0.857   5.859  -4.527
  783   HD12  LEU 105          HD12      LEU 105   0.399   6.325  -2.889
  784   HD13  LEU 105          HD13      LEU 105   1.429   4.918  -3.149
  785   HD21  LEU 105          HD21      LEU 105   1.379   8.654  -3.273
  786   HD22  LEU 105          HD22      LEU 105   1.735   8.141  -4.922
  787   HD23  LEU 105          HD23      LEU 105   3.023   8.780  -3.899
  788    H    MET 106           HN       MET 106   5.754   7.335  -0.025
  789    HA   MET 106           HA       MET 106   4.236   8.208   2.326
  790    HB2  MET 106           HB2      MET 106   5.023   6.400   3.387
  791    HB3  MET 106           HB1      MET 106   5.456   5.815   1.793
  792    HG2  MET 106           HG2      MET 106   7.687   7.022   2.197
  793    HG3  MET 106           HG1      MET 106   7.184   7.032   3.894
  794    HE1  MET 106           HE1      MET 106   6.649   4.836   5.282
  795    HE2  MET 106           HE2      MET 106   6.834   3.198   4.650
  796    HE3  MET 106           HE3      MET 106   5.549   4.238   4.040
  797    H    ASP 107           HN       ASP 107   5.375   9.320   4.036
  798    HA   ASP 107           HA       ASP 107   7.373  11.165   2.939
  799    HB2  ASP 107           HB2      ASP 107   5.373  11.288   5.131
  800    HB3  ASP 107           HB1      ASP 107   6.876  12.158   5.399
  801    H    VAL 108           HN       VAL 108   9.309  11.671   4.063
  802    HA   VAL 108           HA       VAL 108  10.687   9.457   5.098
  803    HB   VAL 108           HB       VAL 108  11.278  12.353   4.840
  804   HG11  VAL 108          HG11      VAL 108  13.341  12.192   6.163
  805   HG12  VAL 108          HG12      VAL 108  12.852  10.594   6.727
  806   HG13  VAL 108          HG13      VAL 108  11.903  12.017   7.170
  807   HG21  VAL 108          HG21      VAL 108  13.341  11.464   3.849
  808   HG22  VAL 108          HG22      VAL 108  11.900  10.769   3.109
  809   HG23  VAL 108          HG23      VAL 108  12.834   9.829   4.274
  810    H    GLY 109           HN       GLY 109  10.654   8.535   6.976
  811    HA2  GLY 109           HA2      GLY 109  10.837   8.467   9.318
  812    HA3  GLY 109           HA1      GLY 109  10.221  10.110   9.396
  813    H    GLU 110           HN       GLU 110   8.459   7.943   7.352
  814    HA   GLU 110           HA       GLU 110   6.433   7.787   9.459
  815    HB2  GLU 110           HB2      GLU 110   4.739   7.769   7.871
  816    HB3  GLU 110           HB1      GLU 110   5.874   8.962   7.264
  817    HG2  GLU 110           HG2      GLU 110   6.569   7.563   5.527
  818    HG3  GLU 110           HG1      GLU 110   5.878   6.128   6.283
  819    H    THR 111           HN       THR 111   4.993   5.891   9.322
  820    HA   THR 111           HA       THR 111   6.342   3.488   8.343
  821    HB   THR 111           HB       THR 111   4.777   3.530  10.924
  822    HG1  THR 111           HG1      THR 111   7.307   4.436  10.435
  823   HG21  THR 111          HG21      THR 111   6.781   1.573   9.784
  824   HG22  THR 111          HG22      THR 111   5.033   1.351   9.834
  825   HG23  THR 111          HG23      THR 111   5.956   1.417  11.335
  826    H    ALA 112           HN       ALA 112   5.065   2.569   6.877
  827    HA   ALA 112           HA       ALA 112   2.179   3.083   7.104
  828    HB1  ALA 112           HB1      ALA 112   3.794   2.784   4.578
  829    HB2  ALA 112           HB2      ALA 112   3.190   4.303   5.239
  830    HB3  ALA 112           HB3      ALA 112   2.059   3.074   4.681
  831    H    MET 113           HN       MET 113   0.825   1.423   6.911
  832    HA   MET 113           HA       MET 113   2.022  -1.220   6.468
  833    HB2  MET 113           HB2      MET 113   0.720  -1.149   8.508
  834    HB3  MET 113           HB1      MET 113  -0.628  -0.390   7.681
  835    HG2  MET 113           HG2      MET 113  -1.233  -2.344   6.597
  836    HG3  MET 113           HG1      MET 113   0.321  -3.122   6.896
  837    HE1  MET 113           HE1      MET 113  -2.964  -2.435  10.073
  838    HE2  MET 113           HE2      MET 113  -3.142  -2.076   8.354
  839    HE3  MET 113           HE3      MET 113  -2.044  -1.116   9.345
  840    H    VAL 114           HN       VAL 114   1.839  -1.996   4.486
  841    HA   VAL 114           HA       VAL 114  -0.232  -0.810   2.736
  842    HB   VAL 114           HB       VAL 114   2.344  -2.048   1.827
  843   HG11  VAL 114          HG11      VAL 114   1.993  -0.806  -0.212
  844   HG12  VAL 114          HG12      VAL 114   0.532  -0.078   0.458
  845   HG13  VAL 114          HG13      VAL 114   0.590  -1.815   0.139
  846   HG21  VAL 114          HG21      VAL 114   2.929  -0.263   3.315
  847   HG22  VAL 114          HG22      VAL 114   1.834   0.832   2.471
  848   HG23  VAL 114          HG23      VAL 114   3.270   0.213   1.652
  849    H    THR 115           HN       THR 115  -1.659  -2.182   1.857
  850    HA   THR 115           HA       THR 115  -0.941  -5.017   1.964
  851    HB   THR 115           HB       THR 115  -3.708  -3.814   1.724
  852    HG1  THR 115           HG1      THR 115  -3.883  -4.818   3.865
  853   HG21  THR 115          HG21      THR 115  -3.440  -5.976   0.577
  854   HG22  THR 115          HG22      THR 115  -4.478  -6.106   1.997
  855   HG23  THR 115          HG23      THR 115  -2.808  -6.669   2.071
  856    H    ALA 116           HN       ALA 116  -0.218  -5.735   0.209
  857    HA   ALA 116           HA       ALA 116  -1.202  -4.706  -2.385
  858    HB1  ALA 116           HB1      ALA 116   1.038  -5.008  -3.272
  859    HB2  ALA 116           HB2      ALA 116   1.606  -5.548  -1.691
  860    HB3  ALA 116           HB3      ALA 116   1.054  -3.886  -1.911
  861    H    ASP 117           HN       ASP 117  -1.891  -6.254  -3.768
  862    HA   ASP 117           HA       ASP 117  -2.112  -8.939  -3.108
  863    HB2  ASP 117           HB2      ASP 117  -3.161  -7.740  -5.125
  864    HB3  ASP 117           HB1      ASP 117  -1.627  -8.026  -5.916
  865    H    SER 118           HN       SER 118  -0.875 -10.777  -3.660
  866    HA   SER 118           HA       SER 118   1.860 -10.552  -3.231
  867    HB2  SER 118           HB2      SER 118   0.272 -12.602  -3.044
  868    HB3  SER 118           HB1      SER 118   0.682 -12.864  -4.740
  869    HG   SER 118           HG       SER 118   2.030 -13.949  -3.100
  870    H    LYS 119           HN       LYS 119   0.002 -10.441  -6.184
  871    HA   LYS 119           HA       LYS 119   2.015 -10.795  -8.065
  872    HB2  LYS 119           HB2      LYS 119   0.610  -9.294  -9.507
  873    HB3  LYS 119           HB1      LYS 119  -0.243 -10.660  -8.789
  874    HG2  LYS 119           HG2      LYS 119  -1.167  -9.174  -7.107
  875    HG3  LYS 119           HG1      LYS 119  -0.251  -7.826  -7.787
  876    HD2  LYS 119           HD2      LYS 119  -2.462  -7.647  -8.626
  877    HD3  LYS 119           HD1      LYS 119  -1.460  -8.217  -9.956
  878    HE2  LYS 119           HE2      LYS 119  -2.216 -10.527  -9.471
  879    HE3  LYS 119           HE1      LYS 119  -3.281  -9.887  -8.223
  880    HZ1  LYS 119           HZ1      LYS 119  -3.444  -9.442 -11.155
  881    HZ2  LYS 119           HZ2      LYS 119  -4.302  -8.499 -10.043
  882    HZ3  LYS 119           HZ3      LYS 119  -4.596 -10.167 -10.139
  883    H    TYR 120           HN       TYR 120   1.316  -7.964  -6.056
  884    HA   TYR 120           HA       TYR 120   3.458  -6.470  -7.368
  885    HB2  TYR 120           HB2      TYR 120   1.581  -5.645  -5.133
  886    HB3  TYR 120           HB1      TYR 120   2.785  -4.606  -5.890
  887    HD1  TYR 120           HD2      TYR 120  -0.406  -6.337  -6.329
  888    HD2  TYR 120           HD1      TYR 120   2.397  -3.640  -8.032
  889    HE1  TYR 120           HE2      TYR 120  -2.085  -5.642  -7.997
  890    HE2  TYR 120           HE1      TYR 120   0.752  -2.938  -9.710
  891    HH   TYR 120           HH       TYR 120  -1.293  -3.743 -10.748
  892    H    CYS 121           HN       CYS 121   3.322  -8.847  -5.306
  893    HA   CYS 121           HA       CYS 121   5.507  -7.833  -3.637
  894    HB2  CYS 121           HB2      CYS 121   3.366  -9.810  -2.860
  895    HB3  CYS 121           HB1      CYS 121   4.705  -9.305  -1.838
  896    HG   CYS 121           HG       CYS 121   1.775  -7.849  -2.378
  897    H    TYR 122           HN       TYR 122   4.355 -11.175  -3.579
  898    HA   TYR 122           HA       TYR 122   6.541 -11.964  -5.359
  899    HB2  TYR 122           HB2      TYR 122   6.199 -13.421  -2.742
  900    HB3  TYR 122           HB1      TYR 122   7.543 -13.466  -3.863
  901    HD1  TYR 122           HD2      TYR 122   9.209 -11.669  -3.910
  902    HD2  TYR 122           HD1      TYR 122   6.036 -11.661  -1.067
  903    HE1  TYR 122           HE2      TYR 122  10.405  -9.989  -2.575
  904    HE2  TYR 122           HE1      TYR 122   7.225  -9.987   0.256
  905    HH   TYR 122           HH       TYR 122   9.917  -8.283  -0.903
  906    H    GLY 123           HN       GLY 123   3.684 -12.043  -5.852
  907    HA2  GLY 123           HA2      GLY 123   2.353 -14.374  -5.398
  908    HA3  GLY 123           HA1      GLY 123   2.257 -13.501  -6.914
  909    HA   PRO 124           HA       PRO 124   4.152 -17.098  -8.735
  910    HB2  PRO 124           HB2      PRO 124   4.911 -16.113 -11.114
  911    HB3  PRO 124           HB1      PRO 124   3.205 -16.327 -10.706
  912    HG2  PRO 124           HG2      PRO 124   4.860 -13.839 -10.687
  913    HG3  PRO 124           HG1      PRO 124   3.194 -14.074 -11.242
  914    HD2  PRO 124           HD2      PRO 124   3.879 -13.021  -8.794
  915    HD3  PRO 124           HD1      PRO 124   2.336 -13.822  -9.140
  916    H    GLN 125           HN       GLN 125   5.761 -14.799  -7.264
  917    HA   GLN 125           HA       GLN 125   8.379 -15.235  -8.533
  918    HB2  GLN 125           HB2      GLN 125   7.603 -13.146  -6.492
  919    HB3  GLN 125           HB1      GLN 125   9.070 -13.195  -7.460
  920    HG2  GLN 125           HG2      GLN 125   7.860 -12.716  -9.453
  921    HG3  GLN 125           HG1      GLN 125   6.318 -12.913  -8.630
  922   HE21  GLN 125          HE21      GLN 125   5.555 -11.311  -7.319
  923   HE22  GLN 125          HE22      GLN 125   6.233  -9.727  -7.256
  924    H    GLY 126           HN       GLY 126   6.720 -15.091  -5.424
  925    HA2  GLY 126           HA2      GLY 126   7.109 -16.215  -3.473
  926    HA3  GLY 126           HA1      GLY 126   8.448 -17.059  -4.240
  927    H    SER 127           HN       SER 127   8.152 -15.696  -1.647
  928    HA   SER 127           HA       SER 127   9.967 -13.483  -1.846
  929    HB2  SER 127           HB2      SER 127   8.193 -13.065  -0.338
  930    HB3  SER 127           HB1      SER 127   8.332 -14.650   0.385
  931    HG   SER 127           HG       SER 127   9.428 -12.395   1.214
  932    H    ARG 128           HN       ARG 128  11.804 -13.330  -0.273
  933    HA   ARG 128           HA       ARG 128  13.762 -15.141  -1.005
  934    HB2  ARG 128           HB2      ARG 128  13.830 -13.578   1.584
  935    HB3  ARG 128           HB1      ARG 128  15.200 -14.094   0.610
  936    HG2  ARG 128           HG2      ARG 128  14.524 -12.533  -1.148
  937    HG3  ARG 128           HG1      ARG 128  13.155 -12.025  -0.153
  938    HD2  ARG 128           HD2      ARG 128  15.080 -11.657   1.633
  939    HD3  ARG 128           HD1      ARG 128  16.055 -11.455   0.177
  940    HE   ARG 128           HE       ARG 128  13.968  -9.838  -0.314
  941   HH11  ARG 128          HH11      ARG 128  16.144 -10.157   2.400
  942   HH12  ARG 128          HH12      ARG 128  15.887  -8.538   2.982
  943   HH21  ARG 128          HH21      ARG 128  13.626  -7.668   0.472
  944   HH22  ARG 128          HH22      ARG 128  14.451  -7.149   1.916
  945    H    SER 129           HN       SER 129  12.266 -14.870   2.216
  946    HA   SER 129           HA       SER 129  13.342 -17.400   3.014
  947    HB2  SER 129           HB2      SER 129  11.384 -15.561   4.407
  948    HB3  SER 129           HB1      SER 129  12.104 -16.999   5.127
  949    HG   SER 129           HG       SER 129  14.167 -15.999   4.747
  950    HA   PRO 130           HA       PRO 130   9.092 -19.087   2.128
  951    HB2  PRO 130           HB2      PRO 130   6.880 -17.447   2.464
  952    HB3  PRO 130           HB1      PRO 130   7.644 -18.356   3.760
  953    HG2  PRO 130           HG2      PRO 130   7.516 -15.539   3.521
  954    HG3  PRO 130           HG1      PRO 130   8.487 -16.461   4.681
  955    HD2  PRO 130           HD2      PRO 130   9.281 -15.317   2.023
  956    HD3  PRO 130           HD1      PRO 130  10.203 -15.398   3.531
  957    H    TYR 131           HN       TYR 131   8.950 -19.454  -0.093
  958    HA   TYR 131           HA       TYR 131   8.218 -17.651  -2.050
  959    HB2  TYR 131           HB2      TYR 131   8.787 -19.686  -2.957
  960    HB3  TYR 131           HB1      TYR 131   7.964 -20.597  -1.701
  961    HD1  TYR 131           HD1      TYR 131   7.132 -18.291  -4.509
  962    HD2  TYR 131           HD2      TYR 131   6.088 -21.821  -2.371
  963    HE1  TYR 131           HE1      TYR 131   5.287 -18.687  -6.079
  964    HE2  TYR 131           HE2      TYR 131   4.232 -22.224  -3.943
  965    HH   TYR 131           HH       TYR 131   3.870 -20.379  -6.868
  966    H    ILE 132           HN       ILE 132   6.729 -16.177  -1.469
  967    HA   ILE 132           HA       ILE 132   4.374 -16.750  -0.037
  968    HB   ILE 132           HB       ILE 132   4.892 -14.385  -1.845
  969   HG12  ILE 132          HG12      ILE 132   6.679 -14.377  -0.303
  970   HG13  ILE 132          HG11      ILE 132   5.512 -13.200   0.287
  971   HG21  ILE 132          HG21      ILE 132   2.561 -14.671  -1.207
  972   HG22  ILE 132          HG22      ILE 132   3.259 -13.244  -0.440
  973   HG23  ILE 132          HG23      ILE 132   3.029 -14.727   0.494
  974   HD11  ILE 132          HD11      ILE 132   5.783 -15.999   1.321
  975   HD12  ILE 132          HD12      ILE 132   4.767 -14.710   1.975
  976   HD13  ILE 132          HD13      ILE 132   6.528 -14.567   2.029
  977    HA   PRO 133           HA       PRO 133   2.038 -18.814  -3.245
  978    HB2  PRO 133           HB2      PRO 133  -0.215 -17.665  -1.648
  979    HB3  PRO 133           HB1      PRO 133   0.024 -19.318  -2.230
  980    HG2  PRO 133           HG2      PRO 133   0.453 -18.720   0.319
  981    HG3  PRO 133           HG1      PRO 133   1.531 -19.834  -0.544
  982    HD2  PRO 133           HD2      PRO 133   1.971 -16.986   0.232
  983    HD3  PRO 133           HD1      PRO 133   3.127 -18.331   0.169
  984    HA   PRO 134           HA       PRO 134   1.223 -15.437  -6.029
  985    HB2  PRO 134           HB2      PRO 134  -0.559 -16.976  -7.597
  986    HB3  PRO 134           HB1      PRO 134   1.130 -16.619  -7.935
  987    HG2  PRO 134           HG2      PRO 134  -0.101 -19.072  -6.908
  988    HG3  PRO 134           HG1      PRO 134   1.497 -18.839  -7.627
  989    HD2  PRO 134           HD2      PRO 134   1.009 -19.320  -4.948
  990    HD3  PRO 134           HD1      PRO 134   2.488 -18.591  -5.598
  991    H    HIS 135           HN       HIS 135  -0.118 -13.868  -5.739
  992    HA   HIS 135           HA       HIS 135  -2.010 -12.643  -5.557
  993    HB2  HIS 135           HB2      HIS 135  -3.370 -15.301  -5.966
  994    HB3  HIS 135           HB1      HIS 135  -4.274 -13.828  -5.653
  995    HD1  HIS 135           HD1      HIS 135  -4.780 -15.224  -8.248
  996    HD2  HIS 135           HD2      HIS 135  -1.819 -12.344  -7.778
  997    HE1  HIS 135           HE1      HIS 135  -4.368 -14.292 -10.549
  998    HE2  HIS 135           HE2      HIS 135  -2.421 -12.708 -10.267
  999    H    ALA 136           HN       ALA 136  -0.740 -14.440  -3.268
 1000    HA   ALA 136           HA       ALA 136  -2.792 -14.235  -1.262
 1001    HB1  ALA 136           HB1      ALA 136   0.199 -14.571  -0.958
 1002    HB2  ALA 136           HB2      ALA 136  -0.996 -15.869  -0.986
 1003    HB3  ALA 136           HB3      ALA 136  -0.983 -14.708   0.342
 1004    H    ALA 137           HN       ALA 137  -3.389 -12.398  -0.247
 1005    HA   ALA 137           HA       ALA 137  -2.176  -9.967  -1.168
 1006    HB1  ALA 137           HB1      ALA 137  -4.585 -10.082  -0.818
 1007    HB2  ALA 137           HB2      ALA 137  -3.869  -8.823   0.188
 1008    HB3  ALA 137           HB3      ALA 137  -4.336 -10.364   0.901
 1009    H    LEU 138           HN       LEU 138  -0.390  -9.179  -0.362
 1010    HA   LEU 138           HA       LEU 138   0.572 -10.060   2.214
 1011    HB2  LEU 138           HB2      LEU 138   1.724  -9.378  -0.259
 1012    HB3  LEU 138           HB1      LEU 138   2.290  -8.182   0.893
 1013    HG   LEU 138           HG       LEU 138   3.233  -9.876   2.292
 1014   HD11  LEU 138          HD11      LEU 138   3.090 -12.245   1.744
 1015   HD12  LEU 138          HD12      LEU 138   2.015 -11.862   0.397
 1016   HD13  LEU 138          HD13      LEU 138   1.500 -11.548   2.055
 1017   HD21  LEU 138          HD21      LEU 138   4.895 -10.840   0.804
 1018   HD22  LEU 138          HD22      LEU 138   4.574  -9.151   0.398
 1019   HD23  LEU 138          HD23      LEU 138   3.882 -10.442  -0.587
 1020    H    CYS 139           HN       CYS 139   0.600  -8.835   3.995
 1021    HA   CYS 139           HA       CYS 139  -0.067  -5.975   3.731
 1022    HB2  CYS 139           HB2      CYS 139  -1.689  -7.649   4.940
 1023    HB3  CYS 139           HB1      CYS 139  -0.507  -7.558   6.238
 1024    HG   CYS 139           HG       CYS 139  -2.103  -4.828   4.943
 1025    H    LEU 140           HN       LEU 140   1.857  -4.990   3.845
 1026    HA   LEU 140           HA       LEU 140   3.832  -6.035   5.762
 1027    HB2  LEU 140           HB2      LEU 140   5.533  -5.089   4.205
 1028    HB3  LEU 140           HB1      LEU 140   4.637  -6.462   3.583
 1029    HG   LEU 140           HG       LEU 140   3.206  -4.245   2.726
 1030   HD11  LEU 140          HD11      LEU 140   6.171  -3.773   2.426
 1031   HD12  LEU 140          HD12      LEU 140   5.050  -2.790   3.368
 1032   HD13  LEU 140          HD13      LEU 140   4.899  -2.858   1.608
 1033   HD21  LEU 140          HD21      LEU 140   5.285  -5.857   1.247
 1034   HD22  LEU 140          HD22      LEU 140   3.993  -4.903   0.514
 1035   HD23  LEU 140          HD23      LEU 140   3.599  -6.321   1.490
 1036    H    GLU 141           HN       GLU 141   4.856  -4.684   7.116
 1037    HA   GLU 141           HA       GLU 141   3.856  -1.917   7.189
 1038    HB2  GLU 141           HB2      GLU 141   3.411  -3.376   9.141
 1039    HB3  GLU 141           HB1      GLU 141   5.137  -3.638   9.324
 1040    HG2  GLU 141           HG2      GLU 141   5.438  -1.251   9.790
 1041    HG3  GLU 141           HG1      GLU 141   3.687  -1.026   9.664
 1042    H    VAL 142           HN       VAL 142   5.264  -0.417   6.461
 1043    HA   VAL 142           HA       VAL 142   8.119  -1.114   6.500
 1044    HB   VAL 142           HB       VAL 142   8.291   0.448   4.477
 1045   HG11  VAL 142          HG11      VAL 142   7.758  -1.387   2.951
 1046   HG12  VAL 142          HG12      VAL 142   6.858  -2.193   4.238
 1047   HG13  VAL 142          HG13      VAL 142   8.603  -1.969   4.386
 1048   HG21  VAL 142          HG21      VAL 142   6.048   1.417   4.622
 1049   HG22  VAL 142          HG22      VAL 142   5.342  -0.181   4.369
 1050   HG23  VAL 142          HG23      VAL 142   6.282   0.582   3.084
 1051    H    THR 143           HN       THR 143   9.200   0.025   7.886
 1052    HA   THR 143           HA       THR 143   8.523   2.778   8.548
 1053    HB   THR 143           HB       THR 143  11.083   1.523   9.474
 1054    HG1  THR 143           HG1      THR 143   9.770   0.368  11.104
 1055   HG21  THR 143          HG21      THR 143   8.875   3.013  10.924
 1056   HG22  THR 143          HG22      THR 143  10.332   3.752  10.253
 1057   HG23  THR 143          HG23      THR 143  10.461   2.587  11.573
 1058    H    LEU 144           HN       LEU 144   9.090   4.240   7.007
 1059    HA   LEU 144           HA       LEU 144  11.663   4.038   5.648
 1060    HB2  LEU 144           HB2      LEU 144   9.694   4.931   4.425
 1061    HB3  LEU 144           HB1      LEU 144   9.586   6.240   5.589
 1062    HG   LEU 144           HG       LEU 144  11.845   7.003   4.879
 1063   HD11  LEU 144          HD11      LEU 144  12.764   6.140   2.775
 1064   HD12  LEU 144          HD12      LEU 144  11.515   4.893   2.751
 1065   HD13  LEU 144          HD13      LEU 144  12.720   4.908   4.039
 1066   HD21  LEU 144          HD21      LEU 144   9.790   6.815   2.681
 1067   HD22  LEU 144          HD22      LEU 144  11.109   7.983   2.775
 1068   HD23  LEU 144          HD23      LEU 144   9.817   8.013   3.976
 1069    H    LYS 145           HN       LYS 145  13.281   4.352   6.987
 1070    HA   LYS 145           HA       LYS 145  12.953   6.309   9.143
 1071    HB2  LYS 145           HB2      LYS 145  15.094   4.210   9.020
 1072    HB3  LYS 145           HB1      LYS 145  14.378   4.982  10.433
 1073    HG2  LYS 145           HG2      LYS 145  12.349   3.782  10.160
 1074    HG3  LYS 145           HG1      LYS 145  12.856   3.166   8.596
 1075    HD2  LYS 145           HD2      LYS 145  14.158   2.514  11.232
 1076    HD3  LYS 145           HD1      LYS 145  13.001   1.482  10.377
 1077    HE2  LYS 145           HE2      LYS 145  15.743   2.332   9.423
 1078    HE3  LYS 145           HE1      LYS 145  15.213   0.720   9.916
 1079    HZ1  LYS 145           HZ1      LYS 145  14.232   2.221   7.560
 1080    HZ2  LYS 145           HZ2      LYS 145  13.711   0.688   8.030
 1081    HZ3  LYS 145           HZ3      LYS 145  15.318   0.919   7.539
 1082    H    THR 146           HN       THR 146  14.658   5.680   6.263
 1083    HA   THR 146           HA       THR 146  16.177   8.112   6.566
 1084    HB   THR 146           HB       THR 146  17.687   5.603   5.890
 1085    HG1  THR 146           HG1      THR 146  16.949   6.597   8.380
 1086   HG21  THR 146          HG21      THR 146  18.702   7.688   5.158
 1087   HG22  THR 146          HG22      THR 146  19.649   6.986   6.469
 1088   HG23  THR 146          HG23      THR 146  18.578   8.351   6.786
 1089    H    ALA 147           HN       ALA 147  16.662   9.033   4.618
 1090    HA   ALA 147           HA       ALA 147  16.578   7.329   2.233
 1091    HB1  ALA 147           HB1      ALA 147  15.554   9.167   0.966
 1092    HB2  ALA 147           HB2      ALA 147  15.443  10.120   2.445
 1093    HB3  ALA 147           HB3      ALA 147  14.503   8.639   2.280
 1094    H    VAL 148           HN       VAL 148  18.444   7.508   1.067
 1095    HA   VAL 148           HA       VAL 148  20.019   9.947   1.518
 1096    HB   VAL 148           HB       VAL 148  22.097   8.728   1.686
 1097   HG11  VAL 148          HG11      VAL 148  21.788   7.672   3.880
 1098   HG12  VAL 148          HG12      VAL 148  20.040   7.689   3.630
 1099   HG13  VAL 148          HG13      VAL 148  20.929   9.208   3.753
 1100   HG21  VAL 148          HG21      VAL 148  22.111   6.262   1.961
 1101   HG22  VAL 148          HG22      VAL 148  21.650   6.793   0.344
 1102   HG23  VAL 148          HG23      VAL 148  20.415   6.241   1.475
 1103    H    ASP 149           HN       ASP 149  21.116  10.717  -0.213
 1104    HA   ASP 149           HA       ASP 149  20.109   9.765  -2.729
 1105    HB2  ASP 149           HB2      ASP 149  20.132  12.111  -2.583
 1106    HB3  ASP 149           HB1      ASP 149  21.779  12.146  -1.939
 1107    H    LEU 150           HN       LEU 150  21.074   8.262  -3.848
 1108    HA   LEU 150           HA       LEU 150  23.994   8.167  -3.872
 1109    HB2  LEU 150           HB2      LEU 150  22.829   6.451  -2.320
 1110    HB3  LEU 150           HB1      LEU 150  22.344   5.656  -3.805
 1111    HG   LEU 150           HG       LEU 150  24.747   5.450  -4.429
 1112   HD11  LEU 150          HD11      LEU 150  26.408   5.774  -2.621
 1113   HD12  LEU 150          HD12      LEU 150  25.148   6.532  -1.644
 1114   HD13  LEU 150          HD13      LEU 150  25.658   7.278  -3.157
 1115   HD21  LEU 150          HD21      LEU 150  23.955   4.223  -1.783
 1116   HD22  LEU 150          HD22      LEU 150  25.251   3.652  -2.837
 1117   HD23  LEU 150          HD23      LEU 150  23.574   3.583  -3.385
 1118    H    GLU 151           HN       GLU 151  21.412   8.777  -5.598
 1119    HA   GLU 151           HA       GLU 151  21.858   6.946  -7.800
 1120    HB2  GLU 151           HB2      GLU 151  19.556   7.939  -6.973
 1121    HB3  GLU 151           HB1      GLU 151  19.996   9.263  -8.046
 1122    HG2  GLU 151           HG2      GLU 151  19.860   6.375  -8.882
 1123    HG3  GLU 151           HG1      GLU 151  18.546   7.534  -9.095
 1124    H    HIS 152           HN       HIS 152  23.962   7.576  -8.223
 1125    HA   HIS 152           HA       HIS 152  23.873   9.434 -10.414
 1126    HB2  HIS 152           HB2      HIS 152  26.202  10.324  -9.792
 1127    HB3  HIS 152           HB1      HIS 152  24.813  11.009  -8.964
 1128    HD1  HIS 152           HD1      HIS 152  24.978  11.119  -6.496
 1129    HD2  HIS 152           HD2      HIS 152  27.635   8.362  -8.122
 1130    HE1  HIS 152           HE1      HIS 152  26.395  10.327  -4.574
 1131    HE2  HIS 152           HE2      HIS 152  28.170   8.891  -5.647
 1132    H    HIS 153           HN       HIS 153  23.737   7.480 -11.465
 1133    HA   HIS 153           HA       HIS 153  25.451   5.326 -11.296
 1134    HB2  HIS 153           HB2      HIS 153  23.816   6.456 -13.542
 1135    HB3  HIS 153           HB1      HIS 153  24.881   5.082 -13.832
 1136    HD1  HIS 153           HD1      HIS 153  21.949   6.037 -11.551
 1137    HD2  HIS 153           HD2      HIS 153  23.805   2.673 -13.177
 1138    HE1  HIS 153           HE1      HIS 153  20.514   4.079 -10.905
 1139    HE2  HIS 153           HE2      HIS 153  21.545   2.087 -12.064
 1140    H    HIS 154           HN       HIS 154  27.301   4.687 -12.441
 1141    HA   HIS 154           HA       HIS 154  29.373   6.383 -12.003
 1142    HB2  HIS 154           HB2      HIS 154  29.044   3.791 -13.111
 1143    HB3  HIS 154           HB1      HIS 154  30.203   4.659 -14.110
 1144    HD1  HIS 154           HD1      HIS 154  32.429   5.413 -12.969
 1145    HD2  HIS 154           HD2      HIS 154  29.931   3.107 -10.559
 1146    HE1  HIS 154           HE1      HIS 154  33.843   4.682 -11.019
 1147    HE2  HIS 154           HE2      HIS 154  32.279   3.419  -9.498
 1148    H    HIS 155           HN       HIS 155  27.811   5.918 -15.173
 1149    HA   HIS 155           HA       HIS 155  29.456   8.168 -16.128
 1150    HB2  HIS 155           HB2      HIS 155  29.266   7.238 -18.402
 1151    HB3  HIS 155           HB1      HIS 155  30.084   6.149 -17.292
 1152    HD1  HIS 155           HD1      HIS 155  26.908   6.516 -19.277
 1153    HD2  HIS 155           HD2      HIS 155  28.816   3.707 -16.873
 1154    HE1  HIS 155           HE1      HIS 155  25.705   4.352 -19.678
 1155    HE2  HIS 155           HE2      HIS 155  27.023   2.634 -18.405
 1156    H    HIS 156           HN       HIS 156  26.934   8.399 -14.772
 1157    HA   HIS 156           HA       HIS 156  25.018   9.624 -14.877
 1158    HB2  HIS 156           HB2      HIS 156  26.104  10.539 -17.549
 1159    HB3  HIS 156           HB1      HIS 156  24.713  11.243 -16.737
 1160    HD1  HIS 156           HD1      HIS 156  28.158  11.819 -17.248
 1161    HD2  HIS 156           HD2      HIS 156  25.579  12.251 -14.017
 1162    HE1  HIS 156           HE1      HIS 156  29.284  13.451 -15.693
 1163    HE2  HIS 156           HE2      HIS 156  27.602  13.854 -13.856
 1164    H    HIS 157           HN       HIS 157  25.094   9.341 -18.343
 1165    HA   HIS 157           HA       HIS 157  22.684   7.666 -18.256
 1166    HB2  HIS 157           HB2      HIS 157  22.377   9.819 -19.377
 1167    HB3  HIS 157           HB1      HIS 157  23.752   9.495 -20.425
 1168    HD1  HIS 157           HD1      HIS 157  23.357   8.060 -22.481
 1169    HD2  HIS 157           HD2      HIS 157  20.032   8.334 -19.999
 1170    HE1  HIS 157           HE1      HIS 157  21.447   7.115 -23.809
 1171    HE2  HIS 157           HE2      HIS 157  19.411   7.484 -22.366
  Start of MODEL   13
    1    H1   MET   1           HT1      MET   1 -41.335  10.762 -20.817
    2    H2   MET   1           HT2      MET   1 -41.788   9.763 -19.528
    3    H3   MET   1           HT3      MET   1 -42.246  11.395 -19.536
    4    HA   MET   1           HA       MET   1 -43.155   9.309 -21.425
    5    HB2  MET   1           HB2      MET   1 -44.620  10.820 -19.251
    6    HB3  MET   1           HB1      MET   1 -45.376   9.734 -20.411
    7    HG2  MET   1           HG2      MET   1 -43.340   8.985 -18.327
    8    HG3  MET   1           HG1      MET   1 -45.068   8.642 -18.276
    9    HE1  MET   1           HE1      MET   1 -43.560   5.079 -18.806
   10    HE2  MET   1           HE2      MET   1 -44.654   6.072 -17.844
   11    HE3  MET   1           HE3      MET   1 -42.919   6.384 -17.807
   12    H    GLY   2           HN       GLY   2 -42.621  12.651 -20.787
   13    HA2  GLY   2           HA2      GLY   2 -42.789  14.352 -22.415
   14    HA3  GLY   2           HA1      GLY   2 -43.888  13.331 -23.336
   15    H    GLN   3           HN       GLN   3 -45.742  12.668 -21.436
   16    HA   GLN   3           HA       GLN   3 -47.095  15.198 -20.987
   17    HB2  GLN   3           HB2      GLN   3 -48.052  12.365 -20.507
   18    HB3  GLN   3           HB1      GLN   3 -49.040  13.817 -20.419
   19    HG2  GLN   3           HG2      GLN   3 -47.692  12.726 -22.877
   20    HG3  GLN   3           HG1      GLN   3 -49.415  12.656 -22.503
   21   HE21  GLN   3          HE21      GLN   3 -49.521  15.314 -21.395
   22   HE22  GLN   3          HE22      GLN   3 -49.388  16.429 -22.713
   23    HA   PRO   4           HA       PRO   4 -45.316  15.665 -16.998
   24    HB2  PRO   4           HB2      PRO   4 -47.913  17.031 -16.455
   25    HB3  PRO   4           HB1      PRO   4 -46.263  17.572 -16.131
   26    HG2  PRO   4           HG2      PRO   4 -47.604  18.544 -18.202
   27    HG3  PRO   4           HG1      PRO   4 -45.878  18.160 -18.343
   28    HD2  PRO   4           HD2      PRO   4 -48.243  16.663 -19.386
   29    HD3  PRO   4           HD1      PRO   4 -46.628  16.861 -20.098
   30    HA   PRO   5           HA       PRO   5 -48.450  13.410 -14.295
   31    HB2  PRO   5           HB2      PRO   5 -51.009  12.988 -15.494
   32    HB3  PRO   5           HB1      PRO   5 -50.608  14.043 -14.137
   33    HG2  PRO   5           HG2      PRO   5 -51.450  14.916 -16.624
   34    HG3  PRO   5           HG1      PRO   5 -50.560  15.894 -15.448
   35    HD2  PRO   5           HD2      PRO   5 -49.550  14.457 -17.866
   36    HD3  PRO   5           HD1      PRO   5 -49.077  16.041 -17.212
   37    H    ALA   6           HN       ALA   6 -47.676  11.426 -14.286
   38    HA   ALA   6           HA       ALA   6 -48.744   9.477 -16.209
   39    HB1  ALA   6           HB1      ALA   6 -46.489  10.119 -16.958
   40    HB2  ALA   6           HB2      ALA   6 -46.552   8.435 -16.444
   41    HB3  ALA   6           HB3      ALA   6 -45.842   9.653 -15.387
   42    H    GLU   7           HN       GLU   7 -48.479  10.418 -13.133
   43    HA   GLU   7           HA       GLU   7 -48.677   7.700 -12.068
   44    HB2  GLU   7           HB2      GLU   7 -47.452   8.516 -10.024
   45    HB3  GLU   7           HB1      GLU   7 -46.464   8.375 -11.474
   46    HG2  GLU   7           HG2      GLU   7 -46.715  10.801 -11.836
   47    HG3  GLU   7           HG1      GLU   7 -47.607  10.909 -10.322
   48    H    GLU   8           HN       GLU   8 -50.064   7.477 -10.302
   49    HA   GLU   8           HA       GLU   8 -51.743   9.820  -9.713
   50    HB2  GLU   8           HB2      GLU   8 -52.942   8.210 -11.126
   51    HB3  GLU   8           HB1      GLU   8 -52.588   6.926  -9.981
   52    HG2  GLU   8           HG2      GLU   8 -54.863   7.652  -9.720
   53    HG3  GLU   8           HG1      GLU   8 -53.929   8.080  -8.290
   54    H    ALA   9           HN       ALA   9 -51.195  10.435  -7.735
   55    HA   ALA   9           HA       ALA   9 -50.941  10.461  -5.485
   56    HB1  ALA   9           HB1      ALA   9 -51.777   8.657  -4.100
   57    HB2  ALA   9           HB2      ALA   9 -51.880   7.595  -5.502
   58    HB3  ALA   9           HB3      ALA   9 -52.929   9.007  -5.388
   59    H    GLU  10           HN       GLU  10 -49.984   7.155  -6.423
   60    HA   GLU  10           HA       GLU  10 -47.225   7.528  -6.336
   61    HB2  GLU  10           HB2      GLU  10 -47.681   7.972  -3.903
   62    HB3  GLU  10           HB1      GLU  10 -48.294   6.328  -3.770
   63    HG2  GLU  10           HG2      GLU  10 -46.056   6.349  -2.971
   64    HG3  GLU  10           HG1      GLU  10 -46.070   5.507  -4.521
   65    H    GLN  11           HN       GLN  11 -49.578   5.215  -5.062
   66    HA   GLN  11           HA       GLN  11 -49.881   2.989  -5.293
   67    HB2  GLN  11           HB2      GLN  11 -50.100   3.915  -7.770
   68    HB3  GLN  11           HB1      GLN  11 -48.631   2.979  -8.004
   69    HG2  GLN  11           HG2      GLN  11 -51.282   1.929  -7.039
   70    HG3  GLN  11           HG1      GLN  11 -50.577   1.686  -8.633
   71   HE21  GLN  11          HE21      GLN  11 -50.452   0.817  -5.275
   72   HE22  GLN  11          HE22      GLN  11 -49.425  -0.564  -5.464
   73    HA   PRO  12           HA       PRO  12 -45.510   1.864  -4.525
   74    HB2  PRO  12           HB2      PRO  12 -45.556   1.833  -1.846
   75    HB3  PRO  12           HB1      PRO  12 -45.425   3.350  -2.744
   76    HG2  PRO  12           HG2      PRO  12 -47.717   2.245  -1.245
   77    HG3  PRO  12           HG1      PRO  12 -47.334   3.927  -1.640
   78    HD2  PRO  12           HD2      PRO  12 -49.150   2.147  -2.991
   79    HD3  PRO  12           HD1      PRO  12 -48.791   3.843  -3.374
   80    H    GLY  13           HN       GLY  13 -44.764   0.046  -2.815
   81    HA2  GLY  13           HA2      GLY  13 -45.874  -1.846  -1.534
   82    HA3  GLY  13           HA1      GLY  13 -46.715  -2.156  -3.044
   83    H    ALA  14           HN       ALA  14 -44.208  -1.414  -4.557
   84    HA   ALA  14           HA       ALA  14 -43.122  -4.092  -4.532
   85    HB1  ALA  14           HB1      ALA  14 -42.445  -1.732  -6.287
   86    HB2  ALA  14           HB2      ALA  14 -43.590  -3.018  -6.670
   87    HB3  ALA  14           HB3      ALA  14 -41.872  -3.382  -6.516
   88    H    LEU  15           HN       LEU  15 -42.199  -3.991  -2.440
   89    HA   LEU  15           HA       LEU  15 -40.478  -3.877  -0.976
   90    HB2  LEU  15           HB2      LEU  15 -39.154  -4.425  -3.068
   91    HB3  LEU  15           HB1      LEU  15 -38.809  -2.712  -3.202
   92    HG   LEU  15           HG       LEU  15 -37.670  -2.782  -1.011
   93   HD11  LEU  15          HD11      LEU  15 -37.171  -4.957   0.011
   94   HD12  LEU  15          HD12      LEU  15 -38.221  -5.740  -1.171
   95   HD13  LEU  15          HD13      LEU  15 -38.901  -4.613   0.001
   96   HD21  LEU  15          HD21      LEU  15 -36.693  -4.785  -3.042
   97   HD22  LEU  15          HD22      LEU  15 -35.719  -4.099  -1.743
   98   HD23  LEU  15          HD23      LEU  15 -36.349  -3.055  -3.017
   99    H    ALA  16           HN       ALA  16 -38.970  -2.245   0.122
  100    HA   ALA  16           HA       ALA  16 -38.856  -0.324   1.322
  101    HB1  ALA  16           HB1      ALA  16 -39.436   0.930  -1.364
  102    HB2  ALA  16           HB2      ALA  16 -37.843   0.518  -0.730
  103    HB3  ALA  16           HB3      ALA  16 -38.801   1.782   0.045
  104    H    ARG  17           HN       ARG  17 -40.866  -1.180   2.307
  105    HA   ARG  17           HA       ARG  17 -43.413  -0.157   1.489
  106    HB2  ARG  17           HB2      ARG  17 -44.251  -1.323   3.495
  107    HB3  ARG  17           HB1      ARG  17 -43.231  -2.356   2.504
  108    HG2  ARG  17           HG2      ARG  17 -41.387  -2.085   4.019
  109    HG3  ARG  17           HG1      ARG  17 -42.288  -0.900   4.966
  110    HD2  ARG  17           HD2      ARG  17 -42.305  -3.063   6.070
  111    HD3  ARG  17           HD1      ARG  17 -43.930  -2.625   5.545
  112    HE   ARG  17           HE       ARG  17 -42.307  -4.383   3.847
  113   HH11  ARG  17          HH11      ARG  17 -44.990  -3.977   6.059
  114   HH12  ARG  17          HH12      ARG  17 -45.808  -5.418   5.542
  115   HH21  ARG  17          HH21      ARG  17 -43.356  -6.318   3.194
  116   HH22  ARG  17          HH22      ARG  17 -44.871  -6.769   3.928
  117    H    GLU  18           HN       GLU  18 -41.389   1.865   2.286
  118    HA   GLU  18           HA       GLU  18 -41.042   3.673   3.625
  119    HB2  GLU  18           HB2      GLU  18 -43.281   4.243   2.679
  120    HB3  GLU  18           HB1      GLU  18 -44.029   3.477   4.074
  121    HG2  GLU  18           HG2      GLU  18 -42.801   5.116   5.519
  122    HG3  GLU  18           HG1      GLU  18 -42.324   5.953   4.045
  123    H    PHE  19           HN       PHE  19 -39.868   2.218   5.082
  124    HA   PHE  19           HA       PHE  19 -40.814   2.406   7.776
  125    HB2  PHE  19           HB2      PHE  19 -42.007   0.359   6.821
  126    HB3  PHE  19           HB1      PHE  19 -40.421  -0.394   6.699
  127    HD1  PHE  19           HD1      PHE  19 -42.751   1.167   9.137
  128    HD2  PHE  19           HD2      PHE  19 -39.510  -1.524   8.510
  129    HE1  PHE  19           HE1      PHE  19 -42.929   0.405  11.470
  130    HE2  PHE  19           HE2      PHE  19 -39.696  -2.295  10.836
  131    HZ   PHE  19           HZ       PHE  19 -41.391  -1.297  12.333
  132    H    LEU  20           HN       LEU  20 -38.644   0.324   5.853
  133    HA   LEU  20           HA       LEU  20 -36.401   1.347   7.462
  134    HB2  LEU  20           HB2      LEU  20 -36.760  -1.417   6.303
  135    HB3  LEU  20           HB1      LEU  20 -35.290  -0.838   7.060
  136    HG   LEU  20           HG       LEU  20 -37.953  -1.102   8.455
  137   HD11  LEU  20          HD11      LEU  20 -35.494  -2.846   8.589
  138   HD12  LEU  20          HD12      LEU  20 -37.032  -3.277   7.841
  139   HD13  LEU  20          HD13      LEU  20 -36.945  -3.021   9.584
  140   HD21  LEU  20          HD21      LEU  20 -36.619  -0.736  10.493
  141   HD22  LEU  20          HD22      LEU  20 -36.558   0.650   9.406
  142   HD23  LEU  20          HD23      LEU  20 -35.190  -0.459   9.498
  143    H    ALA  21           HN       ALA  21 -34.296   1.257   6.334
  144    HA   ALA  21           HA       ALA  21 -34.627   2.010   3.526
  145    HB1  ALA  21           HB1      ALA  21 -32.424   3.054   3.743
  146    HB2  ALA  21           HB2      ALA  21 -32.290   2.434   5.391
  147    HB3  ALA  21           HB3      ALA  21 -33.526   3.631   4.997
  148    H    ALA  22           HN       ALA  22 -32.647   1.413   2.129
  149    HA   ALA  22           HA       ALA  22 -32.155  -1.451   2.555
  150    HB1  ALA  22           HB1      ALA  22 -32.046   0.078  -0.045
  151    HB2  ALA  22           HB2      ALA  22 -33.434  -0.846   0.526
  152    HB3  ALA  22           HB3      ALA  22 -31.916  -1.668   0.164
  153    H    MET  23           HN       MET  23 -30.288  -1.504   3.683
  154    HA   MET  23           HA       MET  23 -27.953  -0.176   2.488
  155    HB2  MET  23           HB2      MET  23 -28.342   0.296   4.884
  156    HB3  MET  23           HB1      MET  23 -28.252  -1.424   5.233
  157    HG2  MET  23           HG2      MET  23 -26.174  -0.316   5.804
  158    HG3  MET  23           HG1      MET  23 -25.932  -1.465   4.490
  159    HE1  MET  23           HE1      MET  23 -26.163   2.347   5.478
  160    HE2  MET  23           HE2      MET  23 -27.524   2.108   4.385
  161    HE3  MET  23           HE3      MET  23 -26.160   3.107   3.885
  162    H    GLU  24           HN       GLU  24 -27.874  -1.711   0.790
  163    HA   GLU  24           HA       GLU  24 -27.299  -4.476   1.592
  164    HB2  GLU  24           HB2      GLU  24 -28.022  -3.482  -1.171
  165    HB3  GLU  24           HB1      GLU  24 -27.981  -5.147  -0.611
  166    HG2  GLU  24           HG2      GLU  24 -29.903  -3.031   0.329
  167    HG3  GLU  24           HG1      GLU  24 -30.259  -4.316  -0.821
  168    HA   PRO  25           HA       PRO  25 -23.121  -3.612   0.191
  169    HB2  PRO  25           HB2      PRO  25 -22.471  -6.290   1.074
  170    HB3  PRO  25           HB1      PRO  25 -21.980  -4.751   1.783
  171    HG2  PRO  25           HG2      PRO  25 -23.685  -6.491   3.007
  172    HG3  PRO  25           HG1      PRO  25 -23.719  -4.737   3.279
  173    HD2  PRO  25           HD2      PRO  25 -25.466  -6.422   1.514
  174    HD3  PRO  25           HD1      PRO  25 -25.910  -5.071   2.583
  175    H    GLU  26           HN       GLU  26 -22.973  -3.718  -1.978
  176    HA   GLU  26           HA       GLU  26 -23.905  -5.922  -3.512
  177    HB2  GLU  26           HB2      GLU  26 -22.117  -3.620  -4.327
  178    HB3  GLU  26           HB1      GLU  26 -22.915  -4.734  -5.431
  179    HG2  GLU  26           HG2      GLU  26 -25.100  -3.969  -4.467
  180    HG3  GLU  26           HG1      GLU  26 -24.203  -2.727  -3.597
  181    HA   PRO  27           HA       PRO  27 -20.674  -8.817  -3.255
  182    HB2  PRO  27           HB2      PRO  27 -20.906  -9.186  -6.189
  183    HB3  PRO  27           HB1      PRO  27 -21.075 -10.365  -4.884
  184    HG2  PRO  27           HG2      PRO  27 -23.214  -9.458  -6.187
  185    HG3  PRO  27           HG1      PRO  27 -23.273  -9.750  -4.438
  186    HD2  PRO  27           HD2      PRO  27 -23.023  -7.168  -5.927
  187    HD3  PRO  27           HD1      PRO  27 -23.954  -7.539  -4.461
  188    H    ALA  28           HN       ALA  28 -18.892  -7.500  -2.803
  189    HA   ALA  28           HA       ALA  28 -17.100  -7.096  -5.105
  190    HB1  ALA  28           HB1      ALA  28 -15.990  -5.333  -3.812
  191    HB2  ALA  28           HB2      ALA  28 -17.172  -5.547  -2.519
  192    HB3  ALA  28           HB3      ALA  28 -17.690  -4.959  -4.099
  193    HA   PRO  29           HA       PRO  29 -14.443  -9.949  -2.899
  194    HB2  PRO  29           HB2      PRO  29 -12.250  -9.233  -4.598
  195    HB3  PRO  29           HB1      PRO  29 -13.262 -10.677  -4.686
  196    HG2  PRO  29           HG2      PRO  29 -13.225  -8.684  -6.587
  197    HG3  PRO  29           HG1      PRO  29 -14.577  -9.800  -6.333
  198    HD2  PRO  29           HD2      PRO  29 -14.252  -6.971  -5.419
  199    HD3  PRO  29           HD1      PRO  29 -15.708  -7.811  -5.996
  200    H    ALA  30           HN       ALA  30 -12.406  -9.956  -1.775
  201    HA   ALA  30           HA       ALA  30 -11.022  -9.110  -0.206
  202    HB1  ALA  30           HB1      ALA  30  -9.733  -7.118  -0.731
  203    HB2  ALA  30           HB2      ALA  30 -10.854  -6.719  -2.034
  204    HB3  ALA  30           HB3      ALA  30  -9.857  -8.169  -2.142
  205    HA   PRO  31           HA       PRO  31 -14.471  -6.546   1.567
  206    HB2  PRO  31           HB2      PRO  31 -14.775  -8.655   3.541
  207    HB3  PRO  31           HB1      PRO  31 -15.955  -8.065   2.374
  208    HG2  PRO  31           HG2      PRO  31 -14.822 -10.541   2.234
  209    HG3  PRO  31           HG1      PRO  31 -15.394  -9.650   0.812
  210    HD2  PRO  31           HD2      PRO  31 -12.608  -9.953   1.855
  211    HD3  PRO  31           HD1      PRO  31 -13.190  -9.990   0.188
  212    H    ALA  32           HN       ALA  32 -12.223  -5.549   1.977
  213    HA   ALA  32           HA       ALA  32 -10.971  -6.206   4.463
  214    HB1  ALA  32           HB1      ALA  32  -9.499  -4.309   3.979
  215    HB2  ALA  32           HB2      ALA  32 -10.540  -3.844   2.633
  216    HB3  ALA  32           HB3      ALA  32  -9.659  -5.373   2.581
  217    HA   PRO  33           HA       PRO  33 -13.431  -3.639   7.097
  218    HB2  PRO  33           HB2      PRO  33 -11.602  -3.059   9.033
  219    HB3  PRO  33           HB1      PRO  33 -12.415  -4.621   8.894
  220    HG2  PRO  33           HG2      PRO  33  -9.679  -3.821   7.986
  221    HG3  PRO  33           HG1      PRO  33 -10.203  -5.316   8.787
  222    HD2  PRO  33           HD2      PRO  33  -9.764  -5.183   6.122
  223    HD3  PRO  33           HD1      PRO  33 -11.011  -6.231   6.827
  224    H    GLU  34           HN       GLU  34 -10.409  -2.517   5.795
  225    HA   GLU  34           HA       GLU  34 -11.325   0.253   6.014
  226    HB2  GLU  34           HB2      GLU  34  -8.592  -0.771   6.789
  227    HB3  GLU  34           HB1      GLU  34  -8.982   0.929   6.570
  228    HG2  GLU  34           HG2      GLU  34 -10.467   0.913   8.422
  229    HG3  GLU  34           HG1      GLU  34 -10.394  -0.844   8.544
  230    H    GLU  35           HN       GLU  35 -11.331   1.153   4.085
  231    HA   GLU  35           HA       GLU  35  -9.665   0.095   1.930
  232    HB2  GLU  35           HB2      GLU  35 -11.878   2.170   1.946
  233    HB3  GLU  35           HB1      GLU  35 -11.014   1.652   0.506
  234    HG2  GLU  35           HG2      GLU  35 -12.644  -0.169   2.261
  235    HG3  GLU  35           HG1      GLU  35 -13.230   0.585   0.778
  236    H    TRP  36           HN       TRP  36  -7.612   0.888   2.089
  237    HA   TRP  36           HA       TRP  36  -7.205   3.658   2.876
  238    HB2  TRP  36           HB2      TRP  36  -4.968   1.949   1.886
  239    HB3  TRP  36           HB1      TRP  36  -4.953   3.185   3.129
  240    HD1  TRP  36           HD1      TRP  36  -7.308   1.831   4.954
  241    HE1  TRP  36           HE1      TRP  36  -6.697  -0.271   6.319
  242    HE3  TRP  36           HE3      TRP  36  -3.161   0.351   2.350
  243    HZ2  TRP  36           HZ2      TRP  36  -4.700  -2.274   6.290
  244    HZ3  TRP  36           HZ3      TRP  36  -1.975  -1.655   3.079
  245    HH2  TRP  36           HH2      TRP  36  -2.719  -2.948   4.995
  246    H    LEU  37           HN       LEU  37  -5.096   4.471   1.419
  247    HA   LEU  37           HA       LEU  37  -6.240   5.183  -1.102
  248    HB2  LEU  37           HB2      LEU  37  -4.791   6.695   0.176
  249    HB3  LEU  37           HB1      LEU  37  -3.456   5.577   0.012
  250    HG   LEU  37           HG       LEU  37  -3.512   5.940  -2.450
  251   HD11  LEU  37          HD11      LEU  37  -5.789   6.599  -2.759
  252   HD12  LEU  37          HD12      LEU  37  -4.744   7.924  -3.276
  253   HD13  LEU  37          HD13      LEU  37  -5.570   8.007  -1.719
  254   HD21  LEU  37          HD21      LEU  37  -3.167   8.439  -0.791
  255   HD22  LEU  37          HD22      LEU  37  -2.485   8.151  -2.393
  256   HD23  LEU  37          HD23      LEU  37  -1.956   7.176  -1.020
  257    H    ASP  38           HN       ASP  38  -6.347   3.669  -2.703
  258    HA   ASP  38           HA       ASP  38  -4.300   1.698  -2.996
  259    HB2  ASP  38           HB2      ASP  38  -6.704   1.406  -3.784
  260    HB3  ASP  38           HB1      ASP  38  -6.258   2.423  -5.155
  261    H    ILE  39           HN       ILE  39  -2.505   1.790  -4.011
  262    HA   ILE  39           HA       ILE  39  -1.358   4.215  -4.791
  263    HB   ILE  39           HB       ILE  39  -0.464   1.424  -5.507
  264   HG12  ILE  39          HG12      ILE  39  -0.206   3.064  -3.006
  265   HG13  ILE  39          HG11      ILE  39  -0.701   1.390  -3.188
  266   HG21  ILE  39          HG21      ILE  39   1.784   2.398  -5.582
  267   HG22  ILE  39          HG22      ILE  39   1.090   3.997  -5.307
  268   HG23  ILE  39          HG23      ILE  39   0.708   3.112  -6.783
  269   HD11  ILE  39          HD11      ILE  39   1.588   0.755  -3.727
  270   HD12  ILE  39          HD12      ILE  39   1.494   1.553  -2.156
  271   HD13  ILE  39          HD13      ILE  39   2.100   2.435  -3.560
  272    H    LEU  40           HN       LEU  40  -3.068   1.768  -6.571
  273    HA   LEU  40           HA       LEU  40  -2.605   3.270  -9.066
  274    HB2  LEU  40           HB2      LEU  40  -3.447   0.397  -8.748
  275    HB3  LEU  40           HB1      LEU  40  -3.144   1.216 -10.266
  276    HG   LEU  40           HG       LEU  40  -1.095   0.556  -8.145
  277   HD11  LEU  40          HD11      LEU  40  -1.580  -0.488 -10.932
  278   HD12  LEU  40          HD12      LEU  40  -1.743  -1.378  -9.417
  279   HD13  LEU  40          HD13      LEU  40  -0.153  -0.844  -9.962
  280   HD21  LEU  40          HD21      LEU  40   0.552   1.464  -9.704
  281   HD22  LEU  40          HD22      LEU  40  -0.603   2.706  -9.220
  282   HD23  LEU  40          HD23      LEU  40  -0.739   1.944 -10.803
  283    H    GLY  41           HN       GLY  41  -4.767   2.808  -6.671
  284    HA2  GLY  41           HA2      GLY  41  -7.009   3.199  -6.410
  285    HA3  GLY  41           HA1      GLY  41  -7.003   3.895  -8.020
  286    H    ASN  42           HN       ASN  42  -5.849   0.655  -7.594
  287    HA   ASN  42           HA       ASN  42  -8.189  -0.207  -9.137
  288    HB2  ASN  42           HB2      ASN  42  -6.901  -1.891 -10.153
  289    HB3  ASN  42           HB1      ASN  42  -5.957  -0.421 -10.211
  290   HD21  ASN  42          HD21      ASN  42  -5.095  -0.739  -7.359
  291   HD22  ASN  42          HD22      ASN  42  -3.916  -1.995  -7.420
  292    H    GLY  43           HN       GLY  43  -6.571  -0.889  -6.087
  293    HA2  GLY  43           HA2      GLY  43  -8.472  -1.427  -4.526
  294    HA3  GLY  43           HA1      GLY  43  -8.816  -2.759  -5.612
  295    H    LEU  44           HN       LEU  44  -5.754  -3.171  -5.841
  296    HA   LEU  44           HA       LEU  44  -5.768  -4.891  -3.462
  297    HB2  LEU  44           HB2      LEU  44  -4.094  -6.295  -4.834
  298    HB3  LEU  44           HB1      LEU  44  -5.797  -6.385  -5.186
  299    HG   LEU  44           HG       LEU  44  -4.223  -6.387  -7.157
  300   HD11  LEU  44          HD11      LEU  44  -6.369  -4.278  -7.091
  301   HD12  LEU  44          HD12      LEU  44  -6.607  -5.998  -7.404
  302   HD13  LEU  44          HD13      LEU  44  -5.679  -5.014  -8.537
  303   HD21  LEU  44          HD21      LEU  44  -2.685  -4.670  -6.452
  304   HD22  LEU  44          HD22      LEU  44  -3.983  -3.477  -6.435
  305   HD23  LEU  44          HD23      LEU  44  -3.467  -4.196  -7.960
  306    H    LEU  45           HN       LEU  45  -4.158  -2.243  -4.690
  307    HA   LEU  45           HA       LEU  45  -1.776  -2.857  -3.070
  308    HB2  LEU  45           HB2      LEU  45  -1.103  -2.988  -5.329
  309    HB3  LEU  45           HB1      LEU  45  -1.991  -1.547  -5.759
  310    HG   LEU  45           HG       LEU  45  -0.386  -0.164  -4.569
  311   HD11  LEU  45          HD11      LEU  45   1.012  -2.759  -3.941
  312   HD12  LEU  45          HD12      LEU  45   0.185  -1.721  -2.778
  313   HD13  LEU  45          HD13      LEU  45   1.633  -1.141  -3.607
  314   HD21  LEU  45          HD21      LEU  45   0.026  -0.719  -6.895
  315   HD22  LEU  45          HD22      LEU  45   0.894  -2.176  -6.406
  316   HD23  LEU  45          HD23      LEU  45   1.545  -0.584  -6.010
  317    H    ARG  46           HN       ARG  46  -2.089  -1.665  -1.221
  318    HA   ARG  46           HA       ARG  46  -2.759   1.195  -1.529
  319    HB2  ARG  46           HB2      ARG  46  -4.243  -0.725   0.272
  320    HB3  ARG  46           HB1      ARG  46  -4.475   1.017   0.215
  321    HG2  ARG  46           HG2      ARG  46  -5.280   0.904  -2.008
  322    HG3  ARG  46           HG1      ARG  46  -4.881  -0.801  -2.127
  323    HD2  ARG  46           HD2      ARG  46  -6.927   0.433  -0.287
  324    HD3  ARG  46           HD1      ARG  46  -7.275  -0.452  -1.771
  325    HE   ARG  46           HE       ARG  46  -5.730  -2.045  -0.027
  326   HH11  ARG  46          HH11      ARG  46  -8.947  -0.835  -0.546
  327   HH12  ARG  46          HH12      ARG  46  -9.728  -2.055   0.411
  328   HH21  ARG  46          HH21      ARG  46  -6.735  -3.692   1.232
  329   HH22  ARG  46          HH22      ARG  46  -8.459  -3.696   1.394
  330    H    LYS  47           HN       LYS  47  -2.062   2.530   0.112
  331    HA   LYS  47           HA       LYS  47  -0.337   1.288   2.170
  332    HB2  LYS  47           HB2      LYS  47   0.758   2.742   0.329
  333    HB3  LYS  47           HB1      LYS  47  -0.011   4.105   1.133
  334    HG2  LYS  47           HG2      LYS  47   1.156   3.041   3.257
  335    HG3  LYS  47           HG1      LYS  47   2.236   2.388   2.023
  336    HD2  LYS  47           HD2      LYS  47   3.111   4.467   2.890
  337    HD3  LYS  47           HD1      LYS  47   2.654   4.652   1.206
  338    HE2  LYS  47           HE2      LYS  47   0.732   5.899   1.752
  339    HE3  LYS  47           HE1      LYS  47   0.814   5.423   3.449
  340    HZ1  LYS  47           HZ1      LYS  47   2.723   6.778   3.782
  341    HZ2  LYS  47           HZ2      LYS  47   1.580   7.732   2.962
  342    HZ3  LYS  47           HZ3      LYS  47   2.885   7.072   2.118
  343    H    LYS  48           HN       LYS  48  -0.862   1.712   4.257
  344    HA   LYS  48           HA       LYS  48  -2.722   3.942   4.799
  345    HB2  LYS  48           HB2      LYS  48  -3.583   1.723   5.424
  346    HB3  LYS  48           HB1      LYS  48  -2.174   1.459   6.441
  347    HG2  LYS  48           HG2      LYS  48  -3.259   3.886   7.292
  348    HG3  LYS  48           HG1      LYS  48  -4.635   2.814   7.039
  349    HD2  LYS  48           HD2      LYS  48  -2.193   2.095   8.655
  350    HD3  LYS  48           HD1      LYS  48  -3.683   2.732   9.345
  351    HE2  LYS  48           HE2      LYS  48  -3.529   0.219   7.692
  352    HE3  LYS  48           HE1      LYS  48  -3.448   0.246   9.455
  353    HZ1  LYS  48           HZ1      LYS  48  -5.624   1.057   9.605
  354    HZ2  LYS  48           HZ2      LYS  48  -5.697  -0.192   8.464
  355    HZ3  LYS  48           HZ3      LYS  48  -5.710   1.425   7.958
  356    H    THR  49           HN       THR  49  -1.937   5.632   5.884
  357    HA   THR  49           HA       THR  49   0.735   5.594   6.955
  358    HB   THR  49           HB       THR  49   0.033   7.984   7.659
  359    HG1  THR  49           HG1      THR  49  -2.036   8.335   7.348
  360   HG21  THR  49          HG21      THR  49   1.480   7.459   5.735
  361   HG22  THR  49          HG22      THR  49   0.417   8.829   5.411
  362   HG23  THR  49          HG23      THR  49   0.046   7.243   4.731
  363    H    LEU  50           HN       LEU  50   0.826   4.306   8.779
  364    HA   LEU  50           HA       LEU  50  -0.930   4.510  11.003
  365    HB2  LEU  50           HB2      LEU  50   2.036   4.014  11.206
  366    HB3  LEU  50           HB1      LEU  50   0.760   3.388  12.235
  367    HG   LEU  50           HG       LEU  50   1.046   2.591   9.345
  368   HD11  LEU  50          HD11      LEU  50   2.187   1.245  11.786
  369   HD12  LEU  50          HD12      LEU  50   3.101   2.034  10.500
  370   HD13  LEU  50          HD13      LEU  50   2.167   0.578  10.152
  371   HD21  LEU  50          HD21      LEU  50  -0.294   0.672  10.062
  372   HD22  LEU  50          HD22      LEU  50  -1.133   2.196  10.350
  373   HD23  LEU  50          HD23      LEU  50  -0.375   1.339  11.692
  374    H    VAL  51           HN       VAL  51   2.221   5.819  10.323
  375    HA   VAL  51           HA       VAL  51   1.484   8.439  11.429
  376    HB   VAL  51           HB       VAL  51   4.178   7.102  11.720
  377   HG11  VAL  51          HG11      VAL  51   4.392   9.487  11.457
  378   HG12  VAL  51          HG12      VAL  51   4.740   9.048  13.130
  379   HG13  VAL  51          HG13      VAL  51   3.183   9.766  12.713
  380   HG21  VAL  51          HG21      VAL  51   2.577   6.091  13.226
  381   HG22  VAL  51          HG22      VAL  51   2.092   7.679  13.812
  382   HG23  VAL  51          HG23      VAL  51   3.719   7.079  14.137
  383    HA   PRO  52           HA       PRO  52   3.389   9.161   7.436
  384    HB2  PRO  52           HB2      PRO  52   2.012  11.313   6.799
  385    HB3  PRO  52           HB1      PRO  52   1.213   9.752   7.057
  386    HG2  PRO  52           HG2      PRO  52   1.256  12.155   8.817
  387    HG3  PRO  52           HG1      PRO  52  -0.017  10.942   8.607
  388    HD2  PRO  52           HD2      PRO  52   2.052  11.036  10.613
  389    HD3  PRO  52           HD1      PRO  52   0.763   9.825  10.422
  390    H    GLY  53           HN       GLY  53   5.192   9.688   9.343
  391    HA2  GLY  53           HA2      GLY  53   7.200  10.820   9.371
  392    HA3  GLY  53           HA1      GLY  53   6.538  11.958   8.211
  393    HA   PRO  54           HA       PRO  54   6.535  14.067  12.382
  394    HB2  PRO  54           HB2      PRO  54   8.814  15.478  12.237
  395    HB3  PRO  54           HB1      PRO  54   8.795  13.823  12.858
  396    HG2  PRO  54           HG2      PRO  54   9.594  14.823  10.153
  397    HG3  PRO  54           HG1      PRO  54  10.370  13.595  11.167
  398    HD2  PRO  54           HD2      PRO  54   8.692  13.012   9.072
  399    HD3  PRO  54           HD1      PRO  54   8.961  11.942  10.460
  400    HA   PRO  55           HA       PRO  55   5.007  17.801  10.505
  401    HB2  PRO  55           HB2      PRO  55   6.245  19.810  11.961
  402    HB3  PRO  55           HB1      PRO  55   4.781  18.953  12.456
  403    HG2  PRO  55           HG2      PRO  55   7.616  18.494  13.276
  404    HG3  PRO  55           HG1      PRO  55   6.140  18.439  14.256
  405    HD2  PRO  55           HD2      PRO  55   7.342  16.197  13.425
  406    HD3  PRO  55           HD1      PRO  55   5.572  16.314  13.503
  407    H    GLY  56           HN       GLY  56   5.837  17.872   8.473
  408    HA2  GLY  56           HA2      GLY  56   6.957  19.140   6.844
  409    HA3  GLY  56           HA1      GLY  56   8.103  19.668   8.066
  410    H    SER  57           HN       SER  57   7.052  16.521   6.769
  411    HA   SER  57           HA       SER  57   9.721  15.488   6.871
  412    HB2  SER  57           HB2      SER  57   8.265  13.684   5.422
  413    HB3  SER  57           HB1      SER  57   8.356  13.706   7.189
  414    HG   SER  57           HG       SER  57   6.268  14.262   5.518
  415    H    SER  58           HN       SER  58  10.166  14.048   4.743
  416    HA   SER  58           HA       SER  58   9.703  15.637   2.326
  417    HB2  SER  58           HB2      SER  58  12.362  14.393   3.078
  418    HB3  SER  58           HB1      SER  58  12.017  15.323   1.618
  419    HG   SER  58           HG       SER  58  11.571  16.459   4.150
  420    H    ARG  59           HN       ARG  59   9.366  14.357   0.511
  421    HA   ARG  59           HA       ARG  59   9.120  11.501   1.107
  422    HB2  ARG  59           HB2      ARG  59   7.762  13.304  -0.867
  423    HB3  ARG  59           HB1      ARG  59   7.691  11.543  -1.037
  424    HG2  ARG  59           HG2      ARG  59   6.714  11.385   1.191
  425    HG3  ARG  59           HG1      ARG  59   6.789  13.137   1.354
  426    HD2  ARG  59           HD2      ARG  59   5.278  13.335  -0.595
  427    HD3  ARG  59           HD1      ARG  59   5.150  11.573  -0.636
  428    HE   ARG  59           HE       ARG  59   4.530  12.556   1.954
  429   HH11  ARG  59          HH11      ARG  59   3.157  12.330  -1.278
  430   HH12  ARG  59          HH12      ARG  59   1.514  12.319  -0.699
  431   HH21  ARG  59          HH21      ARG  59   2.410  12.578   2.690
  432   HH22  ARG  59          HH22      ARG  59   1.085  12.504   1.562
  433    HA   PRO  60           HA       PRO  60  12.968  10.857  -1.052
  434    HB2  PRO  60           HB2      PRO  60  12.336   8.146  -1.501
  435    HB3  PRO  60           HB1      PRO  60  13.277   8.806  -0.160
  436    HG2  PRO  60           HG2      PRO  60  10.384   8.088  -0.280
  437    HG3  PRO  60           HG1      PRO  60  11.531   7.920   1.063
  438    HD2  PRO  60           HD2      PRO  60   9.731   9.863   1.102
  439    HD3  PRO  60           HD1      PRO  60  11.403  10.189   1.614
  440    H    VAL  61           HN       VAL  61  13.619  10.800  -3.118
  441    HA   VAL  61           HA       VAL  61  11.554  10.674  -5.186
  442    HB   VAL  61           HB       VAL  61  14.444  11.478  -5.530
  443   HG11  VAL  61          HG11      VAL  61  13.625  12.700  -7.472
  444   HG12  VAL  61          HG12      VAL  61  11.988  12.130  -7.139
  445   HG13  VAL  61          HG13      VAL  61  13.250  10.979  -7.585
  446   HG21  VAL  61          HG21      VAL  61  12.121  13.283  -4.872
  447   HG22  VAL  61          HG22      VAL  61  13.762  13.804  -5.256
  448   HG23  VAL  61          HG23      VAL  61  13.451  12.877  -3.787
  449    H    LYS  62           HN       LYS  62  11.878   9.377  -7.068
  450    HA   LYS  62           HA       LYS  62  12.936   6.811  -6.555
  451    HB2  LYS  62           HB2      LYS  62  11.983   8.041  -9.137
  452    HB3  LYS  62           HB1      LYS  62  12.453   6.357  -8.958
  453    HG2  LYS  62           HG2      LYS  62  10.699   6.363  -7.035
  454    HG3  LYS  62           HG1      LYS  62  10.065   7.775  -7.885
  455    HD2  LYS  62           HD2      LYS  62  10.017   6.403  -9.972
  456    HD3  LYS  62           HD1      LYS  62  10.462   5.001  -8.999
  457    HE2  LYS  62           HE2      LYS  62   8.129   4.875  -9.208
  458    HE3  LYS  62           HE1      LYS  62   8.405   5.527  -7.592
  459    HZ1  LYS  62           HZ1      LYS  62   7.708   7.097 -10.016
  460    HZ2  LYS  62           HZ2      LYS  62   8.007   7.750  -8.486
  461    HZ3  LYS  62           HZ3      LYS  62   6.664   6.742  -8.727
  462    H    GLY  63           HN       GLY  63  14.980   6.460  -6.335
  463    HA2  GLY  63           HA2      GLY  63  16.956   6.193  -7.977
  464    HA3  GLY  63           HA1      GLY  63  16.907   7.954  -7.963
  465    H    GLN  64           HN       GLN  64  15.972   7.835  -5.105
  466    HA   GLN  64           HA       GLN  64  18.644   7.726  -3.926
  467    HB2  GLN  64           HB2      GLN  64  16.327   8.136  -2.144
  468    HB3  GLN  64           HB1      GLN  64  17.847   9.025  -2.242
  469    HG2  GLN  64           HG2      GLN  64  15.462   9.363  -4.058
  470    HG3  GLN  64           HG1      GLN  64  15.905  10.419  -2.727
  471   HE21  GLN  64          HE21      GLN  64  18.226   9.088  -5.030
  472   HE22  GLN  64          HE22      GLN  64  18.616  10.605  -5.760
  473    H    VAL  65           HN       VAL  65  19.358   6.154  -2.529
  474    HA   VAL  65           HA       VAL  65  17.587   3.880  -2.210
  475    HB   VAL  65           HB       VAL  65  19.394   2.617  -1.326
  476   HG11  VAL  65          HG11      VAL  65  21.018   2.701  -3.136
  477   HG12  VAL  65          HG12      VAL  65  20.413   4.289  -3.610
  478   HG13  VAL  65          HG13      VAL  65  19.371   2.872  -3.737
  479   HG21  VAL  65          HG21      VAL  65  20.950   5.188  -1.202
  480   HG22  VAL  65          HG22      VAL  65  21.653   3.585  -0.999
  481   HG23  VAL  65          HG23      VAL  65  20.443   4.163   0.146
  482    H    VAL  66           HN       VAL  66  16.554   3.401  -0.461
  483    HA   VAL  66           HA       VAL  66  16.863   5.164   1.867
  484    HB   VAL  66           HB       VAL  66  14.451   5.164   2.153
  485   HG11  VAL  66          HG11      VAL  66  15.358   6.953   0.798
  486   HG12  VAL  66          HG12      VAL  66  13.791   6.467   0.158
  487   HG13  VAL  66          HG13      VAL  66  15.271   5.943  -0.644
  488   HG21  VAL  66          HG21      VAL  66  14.287   3.657  -0.450
  489   HG22  VAL  66          HG22      VAL  66  12.942   4.185   0.559
  490   HG23  VAL  66          HG23      VAL  66  14.040   2.936   1.140
  491    H    THR  67           HN       THR  67  16.416   4.299   3.871
  492    HA   THR  67           HA       THR  67  16.562   1.384   3.983
  493    HB   THR  67           HB       THR  67  17.002   1.813   6.444
  494    HG1  THR  67           HG1      THR  67  17.580   3.923   7.016
  495   HG21  THR  67          HG21      THR  67  19.330   2.501   6.082
  496   HG22  THR  67          HG22      THR  67  18.920   2.978   4.435
  497   HG23  THR  67          HG23      THR  67  18.808   1.286   4.918
  498    H    VAL  68           HN       VAL  68  14.655   0.417   4.060
  499    HA   VAL  68           HA       VAL  68  12.619   1.647   5.756
  500    HB   VAL  68           HB       VAL  68  10.959   0.195   4.613
  501   HG11  VAL  68          HG11      VAL  68  10.831   1.503   2.579
  502   HG12  VAL  68          HG12      VAL  68  12.519   1.986   2.750
  503   HG13  VAL  68          HG13      VAL  68  11.321   2.532   3.927
  504   HG21  VAL  68          HG21      VAL  68  13.240  -0.416   2.731
  505   HG22  VAL  68          HG22      VAL  68  11.553  -0.887   2.511
  506   HG23  VAL  68          HG23      VAL  68  12.490  -1.557   3.847
  507    H    HIS  69           HN       HIS  69  11.652   0.461   7.361
  508    HA   HIS  69           HA       HIS  69  12.797  -2.206   7.874
  509    HB2  HIS  69           HB2      HIS  69  12.862  -0.728   9.828
  510    HB3  HIS  69           HB1      HIS  69  11.148  -0.372   9.661
  511    HD1  HIS  69           HD1      HIS  69  12.588  -1.800  12.224
  512    HD2  HIS  69           HD2      HIS  69  10.317  -3.594   9.256
  513    HE1  HIS  69           HE1      HIS  69  11.681  -3.965  13.200
  514    HE2  HIS  69           HE2      HIS  69  10.152  -4.857  11.483
  515    H    LEU  70           HN       LEU  70  11.630  -3.818   6.973
  516    HA   LEU  70           HA       LEU  70   8.726  -3.420   6.984
  517    HB2  LEU  70           HB2      LEU  70   8.427  -4.217   4.902
  518    HB3  LEU  70           HB1      LEU  70  10.033  -3.543   4.696
  519    HG   LEU  70           HG       LEU  70   9.535  -6.441   5.342
  520   HD11  LEU  70          HD11      LEU  70  10.002  -5.175   2.644
  521   HD12  LEU  70          HD12      LEU  70   8.478  -5.855   3.209
  522   HD13  LEU  70          HD13      LEU  70   9.878  -6.903   2.979
  523   HD21  LEU  70          HD21      LEU  70  11.771  -5.595   5.870
  524   HD22  LEU  70          HD22      LEU  70  11.946  -5.016   4.213
  525   HD23  LEU  70          HD23      LEU  70  11.808  -6.745   4.537
  526    H    GLN  71           HN       GLN  71   7.525  -4.890   7.849
  527    HA   GLN  71           HA       GLN  71   8.506  -7.650   8.062
  528    HB2  GLN  71           HB2      GLN  71   6.562  -6.777  10.097
  529    HB3  GLN  71           HB1      GLN  71   7.883  -7.922  10.245
  530    HG2  GLN  71           HG2      GLN  71   8.686  -6.338  11.598
  531    HG3  GLN  71           HG1      GLN  71   9.331  -5.740  10.075
  532   HE21  GLN  71          HE21      GLN  71   6.567  -4.941   9.263
  533   HE22  GLN  71          HE22      GLN  71   6.339  -3.439  10.078
  534    H    THR  72           HN       THR  72   7.286  -8.796   6.883
  535    HA   THR  72           HA       THR  72   4.787  -7.610   5.967
  536    HB   THR  72           HB       THR  72   6.494  -9.744   4.716
  537    HG1  THR  72           HG1      THR  72   6.360  -7.254   3.532
  538   HG21  THR  72          HG21      THR  72   5.198  -9.246   2.702
  539   HG22  THR  72          HG22      THR  72   4.222  -8.102   3.626
  540   HG23  THR  72          HG23      THR  72   4.169  -9.821   4.017
  541    H    SER  73           HN       SER  73   2.994  -8.432   6.717
  542    HA   SER  73           HA       SER  73   2.891 -11.250   7.533
  543    HB2  SER  73           HB2      SER  73   0.604  -9.408   8.046
  544    HB3  SER  73           HB1      SER  73   1.330 -10.623   9.108
  545    HG   SER  73           HG       SER  73   1.931  -7.939   8.798
  546    H    LEU  74           HN       LEU  74   1.677 -12.629   6.350
  547    HA   LEU  74           HA       LEU  74   0.446 -12.010   3.946
  548    HB2  LEU  74           HB2      LEU  74   0.470 -14.268   5.837
  549    HB3  LEU  74           HB1      LEU  74  -0.907 -14.204   4.748
  550    HG   LEU  74           HG       LEU  74   0.459 -14.333   2.852
  551   HD11  LEU  74          HD11      LEU  74   2.176 -12.774   3.513
  552   HD12  LEU  74          HD12      LEU  74   2.879 -14.266   2.882
  553   HD13  LEU  74          HD13      LEU  74   2.843 -13.972   4.622
  554   HD21  LEU  74          HD21      LEU  74   0.126 -16.462   3.993
  555   HD22  LEU  74          HD22      LEU  74   1.614 -16.199   4.903
  556   HD23  LEU  74          HD23      LEU  74   1.677 -16.415   3.155
  557    H    GLU  75           HN       GLU  75  -1.866 -12.219   3.429
  558    HA   GLU  75           HA       GLU  75  -3.484 -10.372   4.644
  559    HB2  GLU  75           HB2      GLU  75  -5.382 -11.613   3.517
  560    HB3  GLU  75           HB1      GLU  75  -4.046 -11.126   2.485
  561    HG2  GLU  75           HG2      GLU  75  -3.150 -13.385   2.550
  562    HG3  GLU  75           HG1      GLU  75  -4.459 -13.884   3.617
  563    H    ASN  76           HN       ASN  76  -2.732 -13.537   5.705
  564    HA   ASN  76           HA       ASN  76  -5.073 -13.865   7.389
  565    HB2  ASN  76           HB2      ASN  76  -2.575 -15.560   7.182
  566    HB3  ASN  76           HB1      ASN  76  -4.059 -16.000   8.017
  567   HD21  ASN  76          HD21      ASN  76  -2.498 -15.637   4.945
  568   HD22  ASN  76          HD22      ASN  76  -3.727 -16.392   3.993
  569    H    GLY  77           HN       GLY  77  -2.041 -12.382   7.609
  570    HA2  GLY  77           HA2      GLY  77  -1.507 -11.054   9.544
  571    HA3  GLY  77           HA1      GLY  77  -2.248 -12.291  10.551
  572    H    THR  78           HN       THR  78  -0.709 -14.132   8.489
  573    HA   THR  78           HA       THR  78   1.407 -14.732  10.279
  574    HB   THR  78           HB       THR  78   1.009 -15.739   7.456
  575    HG1  THR  78           HG1      THR  78   0.125 -17.572   8.987
  576   HG21  THR  78          HG21      THR  78   3.201 -16.275   8.290
  577   HG22  THR  78          HG22      THR  78   2.214 -17.738   8.333
  578   HG23  THR  78          HG23      THR  78   2.528 -16.842   9.820
  579    H    ARG  79           HN       ARG  79   3.087 -13.384  10.459
  580    HA   ARG  79           HA       ARG  79   4.158 -11.916   8.264
  581    HB2  ARG  79           HB2      ARG  79   5.226 -12.424  11.037
  582    HB3  ARG  79           HB1      ARG  79   6.008 -11.378   9.853
  583    HG2  ARG  79           HG2      ARG  79   3.539 -10.369   9.755
  584    HG3  ARG  79           HG1      ARG  79   3.550 -10.946  11.424
  585    HD2  ARG  79           HD2      ARG  79   5.465  -9.622  11.938
  586    HD3  ARG  79           HD1      ARG  79   5.718  -9.224  10.233
  587    HE   ARG  79           HE       ARG  79   3.266  -8.245  10.663
  588   HH11  ARG  79          HH11      ARG  79   6.232  -7.912  12.479
  589   HH12  ARG  79          HH12      ARG  79   5.858  -6.317  13.060
  590   HH21  ARG  79          HH21      ARG  79   2.764  -6.144  11.398
  591   HH22  ARG  79          HH22      ARG  79   3.864  -5.313  12.463
  592    H    VAL  80           HN       VAL  80   5.662 -12.405   6.908
  593    HA   VAL  80           HA       VAL  80   6.785 -15.116   7.072
  594    HB   VAL  80           HB       VAL  80   6.677 -15.150   4.626
  595   HG11  VAL  80          HG11      VAL  80   4.845 -16.066   5.928
  596   HG12  VAL  80          HG12      VAL  80   4.247 -15.337   4.436
  597   HG13  VAL  80          HG13      VAL  80   4.076 -14.478   5.967
  598   HG21  VAL  80          HG21      VAL  80   5.267 -12.504   4.914
  599   HG22  VAL  80          HG22      VAL  80   5.423 -13.431   3.422
  600   HG23  VAL  80          HG23      VAL  80   6.858 -12.755   4.194
  601    H    GLN  81           HN       GLN  81   7.549 -11.889   7.081
  602    HA   GLN  81           HA       GLN  81  10.338 -12.418   6.864
  603    HB2  GLN  81           HB2      GLN  81  10.779 -10.897   4.970
  604    HB3  GLN  81           HB1      GLN  81   9.827 -12.290   4.488
  605    HG2  GLN  81           HG2      GLN  81   7.787 -10.832   4.693
  606    HG3  GLN  81           HG1      GLN  81   8.883  -9.469   4.862
  607   HE21  GLN  81          HE21      GLN  81   7.513 -11.799   2.760
  608   HE22  GLN  81          HE22      GLN  81   8.144 -11.168   1.281
  609    H    GLU  82           HN       GLU  82  11.408 -10.994   8.137
  610    HA   GLU  82           HA       GLU  82  10.133  -8.446   8.782
  611    HB2  GLU  82           HB2      GLU  82   9.286 -10.052  10.439
  612    HB3  GLU  82           HB1      GLU  82  10.932 -10.491  10.860
  613    HG2  GLU  82           HG2      GLU  82  11.339  -8.472  11.921
  614    HG3  GLU  82           HG1      GLU  82   9.984  -7.680  11.120
  615    H    GLU  83           HN       GLU  83  11.663  -7.085   8.178
  616    HA   GLU  83           HA       GLU  83  14.430  -7.582   9.062
  617    HB2  GLU  83           HB2      GLU  83  13.913  -5.992   6.589
  618    HB3  GLU  83           HB1      GLU  83  15.297  -6.986   7.002
  619    HG2  GLU  83           HG2      GLU  83  12.602  -8.053   6.207
  620    HG3  GLU  83           HG1      GLU  83  13.965  -7.840   5.109
  621    HA   PRO  84           HA       PRO  84  13.725  -3.615  10.930
  622    HB2  PRO  84           HB2      PRO  84  16.583  -3.605  11.548
  623    HB3  PRO  84           HB1      PRO  84  15.203  -3.695  12.646
  624    HG2  PRO  84           HG2      PRO  84  16.863  -5.789  12.223
  625    HG3  PRO  84           HG1      PRO  84  15.141  -5.993  12.597
  626    HD2  PRO  84           HD2      PRO  84  16.542  -6.143   9.951
  627    HD3  PRO  84           HD1      PRO  84  15.246  -7.172  10.601
  628    H    GLU  85           HN       GLU  85  15.948  -4.282   8.371
  629    HA   GLU  85           HA       GLU  85  15.746  -1.574   7.452
  630    HB2  GLU  85           HB2      GLU  85  17.576  -1.446   9.149
  631    HB3  GLU  85           HB1      GLU  85  18.490  -2.600   8.190
  632    HG2  GLU  85           HG2      GLU  85  18.687  -1.068   6.385
  633    HG3  GLU  85           HG1      GLU  85  17.549   0.052   7.138
  634    H    LEU  86           HN       LEU  86  15.504  -1.632   5.477
  635    HA   LEU  86           HA       LEU  86  17.029  -3.463   3.772
  636    HB2  LEU  86           HB2      LEU  86  14.808  -4.374   3.903
  637    HB3  LEU  86           HB1      LEU  86  14.089  -2.790   3.706
  638    HG   LEU  86           HG       LEU  86  15.018  -2.717   1.410
  639   HD11  LEU  86          HD11      LEU  86  15.765  -4.803   0.376
  640   HD12  LEU  86          HD12      LEU  86  15.667  -5.609   1.942
  641   HD13  LEU  86          HD13      LEU  86  16.829  -4.306   1.693
  642   HD21  LEU  86          HD21      LEU  86  13.157  -5.016   2.014
  643   HD22  LEU  86          HD22      LEU  86  13.348  -4.233   0.445
  644   HD23  LEU  86          HD23      LEU  86  12.693  -3.326   1.808
  645    H    VAL  87           HN       VAL  87  18.321  -2.160   2.586
  646    HA   VAL  87           HA       VAL  87  17.269   0.492   1.833
  647    HB   VAL  87           HB       VAL  87  19.402   0.480   3.109
  648   HG11  VAL  87          HG11      VAL  87  21.470  -0.241   2.019
  649   HG12  VAL  87          HG12      VAL  87  20.524  -0.913   0.691
  650   HG13  VAL  87          HG13      VAL  87  20.369  -1.588   2.313
  651   HG21  VAL  87          HG21      VAL  87  19.662   1.474   0.274
  652   HG22  VAL  87          HG22      VAL  87  20.602   2.029   1.660
  653   HG23  VAL  87          HG23      VAL  87  18.864   2.318   1.602
  654    H    PHE  88           HN       PHE  88  16.959   0.986  -0.280
  655    HA   PHE  88           HA       PHE  88  18.037  -0.687  -2.414
  656    HB2  PHE  88           HB2      PHE  88  15.882  -1.331  -3.301
  657    HB3  PHE  88           HB1      PHE  88  16.024  -1.908  -1.644
  658    HD1  PHE  88           HD2      PHE  88  14.853  -0.650   0.184
  659    HD2  PHE  88           HD1      PHE  88  14.173   0.117  -3.944
  660    HE1  PHE  88           HE2      PHE  88  12.749   0.482   0.750
  661    HE2  PHE  88           HE1      PHE  88  12.065   1.247  -3.393
  662    HZ   PHE  88           HZ       PHE  88  11.343   1.422  -1.055
  663    H    THR  89           HN       THR  89  17.704   0.197  -4.497
  664    HA   THR  89           HA       THR  89  17.545   3.052  -4.543
  665    HB   THR  89           HB       THR  89  17.560   1.173  -6.914
  666    HG1  THR  89           HG1      THR  89  19.612   0.817  -6.521
  667   HG21  THR  89          HG21      THR  89  17.035   3.517  -7.430
  668   HG22  THR  89          HG22      THR  89  18.607   3.050  -8.077
  669   HG23  THR  89          HG23      THR  89  18.511   4.028  -6.611
  670    H    LEU  90           HN       LEU  90  15.654   4.047  -4.359
  671    HA   LEU  90           HA       LEU  90  13.123   2.970  -4.878
  672    HB2  LEU  90           HB2      LEU  90  13.834   5.078  -3.568
  673    HB3  LEU  90           HB1      LEU  90  13.771   5.884  -5.098
  674    HG   LEU  90           HG       LEU  90  11.418   5.371  -5.349
  675   HD11  LEU  90          HD11      LEU  90  11.630   4.089  -2.634
  676   HD12  LEU  90          HD12      LEU  90  11.472   3.220  -4.160
  677   HD13  LEU  90          HD13      LEU  90  10.172   4.275  -3.608
  678   HD21  LEU  90          HD21      LEU  90  10.562   6.792  -3.576
  679   HD22  LEU  90          HD22      LEU  90  12.093   7.420  -4.180
  680   HD23  LEU  90          HD23      LEU  90  12.040   6.554  -2.644
  681    H    GLY  91           HN       GLY  91  11.928   2.770  -6.703
  682    HA2  GLY  91           HA2      GLY  91  11.130   3.309  -8.818
  683    HA3  GLY  91           HA1      GLY  91  12.389   4.529  -8.958
  684    H    ASP  92           HN       ASP  92  13.726   1.683  -7.918
  685    HA   ASP  92           HA       ASP  92  14.723   1.128 -10.618
  686    HB2  ASP  92           HB2      ASP  92  16.411   1.650  -8.891
  687    HB3  ASP  92           HB1      ASP  92  15.826   0.296  -7.927
  688    H    CYS  93           HN       CYS  93  12.536   0.031  -8.369
  689    HA   CYS  93           HA       CYS  93  11.396  -1.902  -8.025
  690    HB2  CYS  93           HB2      CYS  93  12.494  -2.895 -10.657
  691    HB3  CYS  93           HB1      CYS  93  10.986  -3.353  -9.868
  692    HG   CYS  93           HG       CYS  93   9.497  -1.614 -11.031
  693    H    ASP  94           HN       ASP  94  14.019  -1.548  -7.037
  694    HA   ASP  94           HA       ASP  94  15.525  -3.967  -7.353
  695    HB2  ASP  94           HB2      ASP  94  16.502  -1.712  -6.746
  696    HB3  ASP  94           HB1      ASP  94  15.750  -1.888  -5.165
  697    H    VAL  95           HN       VAL  95  12.757  -3.151  -5.917
  698    HA   VAL  95           HA       VAL  95  12.801  -5.377  -3.994
  699    HB   VAL  95           HB       VAL  95  11.158  -3.975  -2.652
  700   HG11  VAL  95          HG11      VAL  95  13.455  -4.318  -1.927
  701   HG12  VAL  95          HG12      VAL  95  12.932  -2.673  -1.564
  702   HG13  VAL  95          HG13      VAL  95  13.987  -2.979  -2.944
  703   HG21  VAL  95          HG21      VAL  95  11.313  -1.530  -2.979
  704   HG22  VAL  95          HG22      VAL  95  10.600  -2.350  -4.367
  705   HG23  VAL  95          HG23      VAL  95  12.279  -1.806  -4.431
  706    H    ILE  96           HN       ILE  96  10.063  -4.997  -3.280
  707    HA   ILE  96           HA       ILE  96   8.756  -6.046  -5.619
  708    HB   ILE  96           HB       ILE  96   6.770  -6.236  -4.164
  709   HG12  ILE  96          HG12      ILE  96   8.554  -5.049  -2.026
  710   HG13  ILE  96          HG11      ILE  96   7.170  -4.250  -2.762
  711   HG21  ILE  96          HG21      ILE  96   9.300  -7.296  -2.916
  712   HG22  ILE  96          HG22      ILE  96   8.400  -8.039  -4.238
  713   HG23  ILE  96          HG23      ILE  96   7.673  -7.917  -2.637
  714   HD11  ILE  96          HD11      ILE  96   6.613  -5.131  -0.571
  715   HD12  ILE  96          HD12      ILE  96   7.078  -6.752  -1.092
  716   HD13  ILE  96          HD13      ILE  96   5.690  -5.950  -1.830
  717    H    GLN  97           HN       GLN  97   7.279  -4.937  -6.828
  718    HA   GLN  97           HA       GLN  97   7.779  -2.212  -7.141
  719    HB2  GLN  97           HB2      GLN  97   6.790  -3.893  -8.838
  720    HB3  GLN  97           HB1      GLN  97   5.234  -3.438  -8.146
  721    HG2  GLN  97           HG2      GLN  97   5.541  -2.050 -10.022
  722    HG3  GLN  97           HG1      GLN  97   5.863  -1.044  -8.611
  723   HE21  GLN  97          HE21      GLN  97   8.081  -0.534  -8.099
  724   HE22  GLN  97          HE22      GLN  97   9.274  -0.564  -9.348
  725    H    ALA  98           HN       ALA  98   5.359  -3.876  -5.272
  726    HA   ALA  98           HA       ALA  98   3.595  -1.808  -4.664
  727    HB1  ALA  98           HB1      ALA  98   3.141  -3.051  -2.605
  728    HB2  ALA  98           HB2      ALA  98   4.605  -4.003  -2.855
  729    HB3  ALA  98           HB3      ALA  98   3.261  -4.136  -3.988
  730    H    LEU  99           HN       LEU  99   6.653  -2.698  -3.155
  731    HA   LEU  99           HA       LEU  99   6.522  -0.674  -1.150
  732    HB2  LEU  99           HB2      LEU  99   7.814  -2.736  -0.822
  733    HB3  LEU  99           HB1      LEU  99   8.897  -2.243  -2.116
  734    HG   LEU  99           HG       LEU  99   9.599  -0.290  -0.809
  735   HD11  LEU  99          HD11      LEU  99   7.532   0.086   0.428
  736   HD12  LEU  99          HD12      LEU  99   8.909  -0.038   1.522
  737   HD13  LEU  99          HD13      LEU  99   7.798  -1.397   1.345
  738   HD21  LEU  99          HD21      LEU  99  10.877  -2.332  -0.578
  739   HD22  LEU  99          HD22      LEU  99   9.800  -2.887   0.702
  740   HD23  LEU  99          HD23      LEU  99  10.813  -1.468   0.959
  741    H    ASP 100           HN       ASP 100   8.034  -1.023  -4.265
  742    HA   ASP 100           HA       ASP 100   9.850   1.113  -4.128
  743    HB2  ASP 100           HB2      ASP 100   9.977  -0.747  -5.741
  744    HB3  ASP 100           HB1      ASP 100   8.520  -0.175  -6.526
  745    H    LEU 101           HN       LEU 101   6.478   0.893  -4.960
  746    HA   LEU 101           HA       LEU 101   6.323   3.669  -5.754
  747    HB2  LEU 101           HB2      LEU 101   4.208   1.544  -5.445
  748    HB3  LEU 101           HB1      LEU 101   3.940   3.143  -6.094
  749    HG   LEU 101           HG       LEU 101   5.690   1.015  -7.310
  750   HD11  LEU 101          HD11      LEU 101   4.019   0.953  -9.075
  751   HD12  LEU 101          HD12      LEU 101   3.060   2.169  -8.231
  752   HD13  LEU 101          HD13      LEU 101   3.289   0.574  -7.516
  753   HD21  LEU 101          HD21      LEU 101   5.042   3.799  -8.269
  754   HD22  LEU 101          HD22      LEU 101   5.890   2.571  -9.208
  755   HD23  LEU 101          HD23      LEU 101   6.618   3.212  -7.734
  756    H    SER 102           HN       SER 102   5.586   1.686  -2.962
  757    HA   SER 102           HA       SER 102   3.759   3.504  -1.773
  758    HB2  SER 102           HB2      SER 102   3.634   1.209  -1.100
  759    HB3  SER 102           HB1      SER 102   5.330   1.197  -0.618
  760    HG   SER 102           HG       SER 102   4.611   2.937   0.912
  761    H    VAL 103           HN       VAL 103   7.213   3.198  -1.752
  762    HA   VAL 103           HA       VAL 103   7.739   4.645   0.599
  763    HB   VAL 103           HB       VAL 103   9.416   4.089  -1.811
  764   HG11  VAL 103          HG11      VAL 103  11.350   4.870  -0.528
  765   HG12  VAL 103          HG12      VAL 103  10.293   5.351   0.798
  766   HG13  VAL 103          HG13      VAL 103  10.189   6.179  -0.755
  767   HG21  VAL 103          HG21      VAL 103   9.104   2.101  -0.659
  768   HG22  VAL 103          HG22      VAL 103   9.084   2.896   0.912
  769   HG23  VAL 103          HG23      VAL 103  10.603   2.706   0.044
  770    HA   PRO 104           HA       PRO 104   8.382   8.557  -2.215
  771    HB2  PRO 104           HB2      PRO 104   7.082   8.439  -4.644
  772    HB3  PRO 104           HB1      PRO 104   8.809   8.139  -4.416
  773    HG2  PRO 104           HG2      PRO 104   6.563   6.177  -4.654
  774    HG3  PRO 104           HG1      PRO 104   8.190   6.108  -5.347
  775    HD2  PRO 104           HD2      PRO 104   7.549   4.684  -3.186
  776    HD3  PRO 104           HD1      PRO 104   9.152   5.417  -3.375
  777    H    LEU 105           HN       LEU 105   5.508   6.574  -2.297
  778    HA   LEU 105           HA       LEU 105   3.647   8.733  -2.147
  779    HB2  LEU 105           HB2      LEU 105   3.513   5.805  -1.507
  780    HB3  LEU 105           HB1      LEU 105   2.143   6.873  -1.219
  781    HG   LEU 105           HG       LEU 105   3.398   6.152  -3.863
  782   HD11  LEU 105          HD11      LEU 105   1.126   5.377  -4.365
  783   HD12  LEU 105          HD12      LEU 105   0.629   5.811  -2.728
  784   HD13  LEU 105          HD13      LEU 105   1.828   4.541  -2.979
  785   HD21  LEU 105          HD21      LEU 105   2.909   8.544  -3.881
  786   HD22  LEU 105          HD22      LEU 105   1.269   8.225  -3.317
  787   HD23  LEU 105          HD23      LEU 105   1.779   7.664  -4.910
  788    H    MET 106           HN       MET 106   5.652   7.083   0.127
  789    HA   MET 106           HA       MET 106   4.172   8.122   2.415
  790    HB2  MET 106           HB2      MET 106   4.906   6.284   3.458
  791    HB3  MET 106           HB1      MET 106   5.535   5.750   1.910
  792    HG2  MET 106           HG2      MET 106   7.635   7.099   2.556
  793    HG3  MET 106           HG1      MET 106   6.957   7.041   4.191
  794    HE1  MET 106           HE1      MET 106   6.601   4.790   5.570
  795    HE2  MET 106           HE2      MET 106   6.813   3.186   4.869
  796    HE3  MET 106           HE3      MET 106   5.535   4.244   4.274
  797    H    ASP 107           HN       ASP 107   5.270   9.279   4.117
  798    HA   ASP 107           HA       ASP 107   7.262  11.157   3.076
  799    HB2  ASP 107           HB2      ASP 107   5.382  11.122   5.390
  800    HB3  ASP 107           HB1      ASP 107   6.843  12.095   5.525
  801    H    VAL 108           HN       VAL 108   9.244  11.582   4.102
  802    HA   VAL 108           HA       VAL 108  10.639   9.384   5.142
  803    HB   VAL 108           HB       VAL 108  11.212  12.264   4.801
  804   HG11  VAL 108          HG11      VAL 108  13.267  12.185   6.156
  805   HG12  VAL 108          HG12      VAL 108  12.763  10.626   6.813
  806   HG13  VAL 108          HG13      VAL 108  11.811  12.075   7.146
  807   HG21  VAL 108          HG21      VAL 108  13.274  11.393   3.853
  808   HG22  VAL 108          HG22      VAL 108  11.874  10.564   3.176
  809   HG23  VAL 108          HG23      VAL 108  12.860   9.768   4.404
  810    H    GLY 109           HN       GLY 109  10.643   8.491   7.015
  811    HA2  GLY 109           HA2      GLY 109  10.850   8.433   9.350
  812    HA3  GLY 109           HA1      GLY 109  10.243  10.079   9.429
  813    H    GLU 110           HN       GLU 110   8.388   8.019   7.417
  814    HA   GLU 110           HA       GLU 110   6.379   7.891   9.536
  815    HB2  GLU 110           HB2      GLU 110   4.705   7.974   7.973
  816    HB3  GLU 110           HB1      GLU 110   5.925   9.010   7.244
  817    HG2  GLU 110           HG2      GLU 110   6.466   7.391   5.635
  818    HG3  GLU 110           HG1      GLU 110   5.632   6.114   6.521
  819    H    THR 111           HN       THR 111   4.878   6.026   9.398
  820    HA   THR 111           HA       THR 111   6.244   3.592   8.547
  821    HB   THR 111           HB       THR 111   4.601   3.757  11.075
  822    HG1  THR 111           HG1      THR 111   7.134   4.639  10.612
  823   HG21  THR 111          HG21      THR 111   5.724   1.645  11.601
  824   HG22  THR 111          HG22      THR 111   6.621   1.736  10.085
  825   HG23  THR 111          HG23      THR 111   4.869   1.531  10.063
  826    H    ALA 112           HN       ALA 112   5.039   2.629   7.080
  827    HA   ALA 112           HA       ALA 112   2.146   3.190   7.092
  828    HB1  ALA 112           HB1      ALA 112   3.297   4.387   5.316
  829    HB2  ALA 112           HB2      ALA 112   2.228   3.146   4.665
  830    HB3  ALA 112           HB3      ALA 112   3.969   2.869   4.722
  831    H    MET 113           HN       MET 113   0.830   1.478   6.993
  832    HA   MET 113           HA       MET 113   2.053  -1.138   6.498
  833    HB2  MET 113           HB2      MET 113   0.738  -1.105   8.524
  834    HB3  MET 113           HB1      MET 113  -0.627  -0.383   7.682
  835    HG2  MET 113           HG2      MET 113  -1.163  -2.339   6.590
  836    HG3  MET 113           HG1      MET 113   0.435  -3.044   6.824
  837    HE1  MET 113           HE1      MET 113  -2.784  -2.631  10.088
  838    HE2  MET 113           HE2      MET 113  -3.025  -2.217   8.391
  839    HE3  MET 113           HE3      MET 113  -1.939  -1.249   9.389
  840    H    VAL 114           HN       VAL 114   1.913  -1.913   4.553
  841    HA   VAL 114           HA       VAL 114  -0.077  -0.748   2.712
  842    HB   VAL 114           HB       VAL 114   2.459  -2.151   1.940
  843   HG11  VAL 114          HG11      VAL 114   0.814  -1.815   0.171
  844   HG12  VAL 114          HG12      VAL 114   2.291  -0.892  -0.117
  845   HG13  VAL 114          HG13      VAL 114   0.846  -0.079   0.486
  846   HG21  VAL 114          HG21      VAL 114   3.124  -0.398   3.428
  847   HG22  VAL 114          HG22      VAL 114   2.145   0.766   2.534
  848   HG23  VAL 114          HG23      VAL 114   3.556   0.028   1.772
  849    H    THR 115           HN       THR 115  -1.482  -2.129   1.743
  850    HA   THR 115           HA       THR 115  -0.754  -4.970   1.902
  851    HB   THR 115           HB       THR 115  -3.545  -3.828   1.692
  852    HG1  THR 115           HG1      THR 115  -1.972  -4.180   3.790
  853   HG21  THR 115          HG21      THR 115  -3.227  -5.977   0.528
  854   HG22  THR 115          HG22      THR 115  -4.261  -6.137   1.950
  855   HG23  THR 115          HG23      THR 115  -2.577  -6.664   2.017
  856    H    ALA 116           HN       ALA 116  -0.021  -5.645   0.143
  857    HA   ALA 116           HA       ALA 116  -1.061  -4.634  -2.442
  858    HB1  ALA 116           HB1      ALA 116   1.740  -5.533  -1.822
  859    HB2  ALA 116           HB2      ALA 116   1.224  -3.850  -1.954
  860    HB3  ALA 116           HB3      ALA 116   1.144  -4.913  -3.361
  861    H    ASP 117           HN       ASP 117  -1.756  -6.149  -3.819
  862    HA   ASP 117           HA       ASP 117  -2.040  -8.836  -3.228
  863    HB2  ASP 117           HB2      ASP 117  -3.006  -7.520  -5.225
  864    HB3  ASP 117           HB1      ASP 117  -1.472  -7.845  -5.996
  865    H    SER 118           HN       SER 118  -0.843 -10.675  -3.747
  866    HA   SER 118           HA       SER 118   1.891 -10.585  -3.325
  867    HB2  SER 118           HB2      SER 118   0.181 -12.562  -3.240
  868    HB3  SER 118           HB1      SER 118   0.648 -12.794  -4.926
  869    HG   SER 118           HG       SER 118   1.884 -13.995  -3.286
  870    H    LYS 119           HN       LYS 119   0.061 -10.334  -6.278
  871    HA   LYS 119           HA       LYS 119   2.022 -10.754  -8.189
  872    HB2  LYS 119           HB2      LYS 119   0.699  -9.152  -9.581
  873    HB3  LYS 119           HB1      LYS 119  -0.262 -10.432  -8.838
  874    HG2  LYS 119           HG2      LYS 119  -1.044  -8.896  -7.155
  875    HG3  LYS 119           HG1      LYS 119   0.032  -7.636  -7.765
  876    HD2  LYS 119           HD2      LYS 119  -2.251  -7.281  -8.526
  877    HD3  LYS 119           HD1      LYS 119  -1.178  -7.616  -9.883
  878    HE2  LYS 119           HE2      LYS 119  -1.931 -10.021  -9.715
  879    HE3  LYS 119           HE1      LYS 119  -3.174  -9.453  -8.595
  880    HZ1  LYS 119           HZ1      LYS 119  -2.820  -8.393 -11.349
  881    HZ2  LYS 119           HZ2      LYS 119  -4.087  -8.041 -10.279
  882    HZ3  LYS 119           HZ3      LYS 119  -3.941  -9.596 -10.937
  883    H    TYR 120           HN       TYR 120   1.510  -7.917  -6.109
  884    HA   TYR 120           HA       TYR 120   3.769  -6.578  -7.412
  885    HB2  TYR 120           HB2      TYR 120   1.865  -5.611  -5.268
  886    HB3  TYR 120           HB1      TYR 120   3.182  -4.652  -5.936
  887    HD1  TYR 120           HD1      TYR 120   3.082  -3.831  -8.208
  888    HD2  TYR 120           HD2      TYR 120  -0.147  -6.003  -6.506
  889    HE1  TYR 120           HE1      TYR 120   1.612  -2.994  -9.978
  890    HE2  TYR 120           HE2      TYR 120  -1.645  -5.177  -8.280
  891    HH   TYR 120           HH       TYR 120  -1.829  -3.398  -9.856
  892    H    CYS 121           HN       CYS 121   3.520  -8.933  -5.387
  893    HA   CYS 121           HA       CYS 121   5.672  -8.007  -3.621
  894    HB2  CYS 121           HB2      CYS 121   3.471  -9.959  -2.947
  895    HB3  CYS 121           HB1      CYS 121   4.773  -9.463  -1.870
  896    HG   CYS 121           HG       CYS 121   1.891  -7.942  -2.589
  897    H    TYR 122           HN       TYR 122   4.421 -11.313  -3.660
  898    HA   TYR 122           HA       TYR 122   6.526 -12.124  -5.523
  899    HB2  TYR 122           HB2      TYR 122   6.268 -13.674  -2.949
  900    HB3  TYR 122           HB1      TYR 122   7.560 -13.679  -4.128
  901    HD1  TYR 122           HD1      TYR 122   6.102 -11.835  -1.317
  902    HD2  TYR 122           HD2      TYR 122   9.352 -12.042  -4.062
  903    HE1  TYR 122           HE1      TYR 122   7.350 -10.218   0.044
  904    HE2  TYR 122           HE2      TYR 122  10.608 -10.442  -2.704
  905    HH   TYR 122           HH       TYR 122  10.292  -8.755  -1.052
  906    H    GLY 123           HN       GLY 123   3.686 -12.101  -5.957
  907    HA2  GLY 123           HA2      GLY 123   2.275 -14.387  -5.486
  908    HA3  GLY 123           HA1      GLY 123   2.178 -13.495  -6.991
  909    HA   PRO 124           HA       PRO 124   4.013 -17.085  -8.871
  910    HB2  PRO 124           HB2      PRO 124   4.965 -15.629 -11.138
  911    HB3  PRO 124           HB1      PRO 124   3.483 -16.574 -11.009
  912    HG2  PRO 124           HG2      PRO 124   3.590 -13.823 -11.303
  913    HG3  PRO 124           HG1      PRO 124   2.201 -14.730 -10.683
  914    HD2  PRO 124           HD2      PRO 124   4.289 -13.204  -9.188
  915    HD3  PRO 124           HD1      PRO 124   2.557 -13.391  -8.843
  916    H    GLN 125           HN       GLN 125   5.668 -14.921  -7.300
  917    HA   GLN 125           HA       GLN 125   8.291 -15.400  -8.561
  918    HB2  GLN 125           HB2      GLN 125   7.833 -13.412  -6.367
  919    HB3  GLN 125           HB1      GLN 125   9.043 -13.394  -7.640
  920    HG2  GLN 125           HG2      GLN 125   7.459 -12.689  -9.260
  921    HG3  GLN 125           HG1      GLN 125   6.110 -12.983  -8.161
  922   HE21  GLN 125          HE21      GLN 125   5.315 -10.940  -8.125
  923   HE22  GLN 125          HE22      GLN 125   6.147  -9.617  -7.395
  924    H    GLY 126           HN       GLY 126   6.661 -15.219  -5.450
  925    HA2  GLY 126           HA2      GLY 126   6.970 -16.443  -3.535
  926    HA3  GLY 126           HA1      GLY 126   8.257 -17.312  -4.321
  927    H    SER 127           HN       SER 127   7.987 -15.993  -1.701
  928    HA   SER 127           HA       SER 127   9.896 -13.854  -1.842
  929    HB2  SER 127           HB2      SER 127   8.008 -13.352  -0.490
  930    HB3  SER 127           HB1      SER 127   8.106 -14.890   0.345
  931    HG   SER 127           HG       SER 127   8.921 -13.216   1.641
  932    H    ARG 128           HN       ARG 128  11.572 -13.704  -0.145
  933    HA   ARG 128           HA       ARG 128  13.556 -15.551  -0.587
  934    HB2  ARG 128           HB2      ARG 128  13.214 -13.714   1.785
  935    HB3  ARG 128           HB1      ARG 128  14.708 -14.528   1.356
  936    HG2  ARG 128           HG2      ARG 128  14.917 -13.278  -0.650
  937    HG3  ARG 128           HG1      ARG 128  13.287 -12.621  -0.480
  938    HD2  ARG 128           HD2      ARG 128  15.552 -12.128   1.449
  939    HD3  ARG 128           HD1      ARG 128  15.079 -11.020   0.160
  940    HE   ARG 128           HE       ARG 128  12.872 -10.905   1.313
  941   HH11  ARG 128          HH11      ARG 128  15.779 -11.711   3.084
  942   HH12  ARG 128          HH12      ARG 128  15.137 -11.200   4.618
  943   HH21  ARG 128          HH21      ARG 128  12.027 -10.204   3.332
  944   HH22  ARG 128          HH22      ARG 128  13.002 -10.348   4.769
  945    H    SER 129           HN       SER 129  11.866 -15.181   2.531
  946    HA   SER 129           HA       SER 129  12.825 -17.689   3.456
  947    HB2  SER 129           HB2      SER 129  12.344 -15.819   4.995
  948    HB3  SER 129           HB1      SER 129  10.630 -15.957   4.608
  949    HG   SER 129           HG       SER 129  12.240 -17.571   6.203
  950    HA   PRO 130           HA       PRO 130   8.740 -19.468   2.101
  951    HB2  PRO 130           HB2      PRO 130   6.463 -17.930   2.327
  952    HB3  PRO 130           HB1      PRO 130   7.185 -18.817   3.665
  953    HG2  PRO 130           HG2      PRO 130   6.970 -16.000   3.399
  954    HG3  PRO 130           HG1      PRO 130   7.836 -16.892   4.655
  955    HD2  PRO 130           HD2      PRO 130   8.869 -15.695   2.118
  956    HD3  PRO 130           HD1      PRO 130   9.642 -15.810   3.708
  957    H    TYR 131           HN       TYR 131   8.717 -19.773  -0.141
  958    HA   TYR 131           HA       TYR 131   8.078 -17.907  -2.073
  959    HB2  TYR 131           HB2      TYR 131   8.692 -20.137  -2.754
  960    HB3  TYR 131           HB1      TYR 131   7.322 -20.832  -1.894
  961    HD1  TYR 131           HD1      TYR 131   5.063 -20.676  -2.825
  962    HD2  TYR 131           HD2      TYR 131   8.413 -19.120  -4.934
  963    HE1  TYR 131           HE1      TYR 131   3.711 -20.567  -4.870
  964    HE2  TYR 131           HE2      TYR 131   7.064 -19.001  -6.986
  965    HH   TYR 131           HH       TYR 131   5.056 -20.136  -7.934
  966    H    ILE 132           HN       ILE 132   6.573 -16.422  -1.537
  967    HA   ILE 132           HA       ILE 132   4.187 -16.956  -0.150
  968    HB   ILE 132           HB       ILE 132   4.746 -14.633  -2.000
  969   HG12  ILE 132          HG12      ILE 132   6.515 -14.607  -0.428
  970   HG13  ILE 132          HG11      ILE 132   5.350 -13.397   0.105
  971   HG21  ILE 132          HG21      ILE 132   2.841 -14.947   0.310
  972   HG22  ILE 132          HG22      ILE 132   2.411 -14.856  -1.400
  973   HG23  ILE 132          HG23      ILE 132   3.109 -13.454  -0.590
  974   HD11  ILE 132          HD11      ILE 132   5.583 -16.164   1.233
  975   HD12  ILE 132          HD12      ILE 132   4.555 -14.856   1.823
  976   HD13  ILE 132          HD13      ILE 132   6.315 -14.713   1.916
  977    HA   PRO 133           HA       PRO 133   1.822 -18.848  -3.459
  978    HB2  PRO 133           HB2      PRO 133  -0.643 -18.117  -2.371
  979    HB3  PRO 133           HB1      PRO 133   0.236 -19.607  -2.026
  980    HG2  PRO 133           HG2      PRO 133   0.096 -17.085  -0.451
  981    HG3  PRO 133           HG1      PRO 133   0.182 -18.762   0.117
  982    HD2  PRO 133           HD2      PRO 133   2.311 -17.136   0.189
  983    HD3  PRO 133           HD1      PRO 133   2.477 -18.868  -0.165
  984    HA   PRO 134           HA       PRO 134   1.062 -15.374  -6.058
  985    HB2  PRO 134           HB2      PRO 134  -0.685 -16.485  -7.835
  986    HB3  PRO 134           HB1      PRO 134   1.061 -16.761  -7.871
  987    HG2  PRO 134           HG2      PRO 134  -1.095 -18.500  -6.721
  988    HG3  PRO 134           HG1      PRO 134   0.326 -18.964  -7.677
  989    HD2  PRO 134           HD2      PRO 134   0.272 -19.239  -5.002
  990    HD3  PRO 134           HD1      PRO 134   1.759 -18.804  -5.868
  991    H    HIS 135           HN       HIS 135  -0.267 -13.724  -6.071
  992    HA   HIS 135           HA       HIS 135  -2.074 -12.397  -5.780
  993    HB2  HIS 135           HB2      HIS 135  -3.324 -14.976  -6.414
  994    HB3  HIS 135           HB1      HIS 135  -4.347 -13.898  -5.476
  995    HD1  HIS 135           HD1      HIS 135  -3.183 -14.559  -8.863
  996    HD2  HIS 135           HD2      HIS 135  -4.839 -11.355  -6.795
  997    HE1  HIS 135           HE1      HIS 135  -4.010 -12.969 -10.626
  998    HE2  HIS 135           HE2      HIS 135  -5.220 -11.163  -9.349
  999    H    ALA 136           HN       ALA 136  -0.865 -14.295  -3.466
 1000    HA   ALA 136           HA       ALA 136  -2.841 -13.991  -1.422
 1001    HB1  ALA 136           HB1      ALA 136  -1.077 -15.696  -1.255
 1002    HB2  ALA 136           HB2      ALA 136  -1.078 -14.611   0.136
 1003    HB3  ALA 136           HB3      ALA 136   0.134 -14.418  -1.129
 1004    H    ALA 137           HN       ALA 137  -3.347 -12.181  -0.351
 1005    HA   ALA 137           HA       ALA 137  -2.070  -9.768  -1.227
 1006    HB1  ALA 137           HB1      ALA 137  -3.716  -8.652   0.291
 1007    HB2  ALA 137           HB2      ALA 137  -4.299 -10.249   0.748
 1008    HB3  ALA 137           HB3      ALA 137  -4.442  -9.709  -0.919
 1009    H    LEU 138           HN       LEU 138  -0.251  -9.066  -0.425
 1010    HA   LEU 138           HA       LEU 138   0.664  -9.979   2.154
 1011    HB2  LEU 138           HB2      LEU 138   1.872  -9.210  -0.295
 1012    HB3  LEU 138           HB1      LEU 138   2.482  -8.149   0.957
 1013    HG   LEU 138           HG       LEU 138   3.287 -10.025   2.235
 1014   HD11  LEU 138          HD11      LEU 138   1.474 -11.556   1.761
 1015   HD12  LEU 138          HD12      LEU 138   3.039 -12.307   1.449
 1016   HD13  LEU 138          HD13      LEU 138   2.051 -11.736   0.105
 1017   HD21  LEU 138          HD21      LEU 138   4.020 -10.386  -0.655
 1018   HD22  LEU 138          HD22      LEU 138   4.968 -10.894   0.743
 1019   HD23  LEU 138          HD23      LEU 138   4.709  -9.176   0.426
 1020    H    CYS 139           HN       CYS 139   0.715  -8.797   3.941
 1021    HA   CYS 139           HA       CYS 139   0.046  -5.933   3.760
 1022    HB2  CYS 139           HB2      CYS 139  -1.533  -7.692   4.946
 1023    HB3  CYS 139           HB1      CYS 139  -0.354  -7.565   6.236
 1024    HG   CYS 139           HG       CYS 139  -2.558  -5.245   5.140
 1025    H    LEU 140           HN       LEU 140   1.991  -4.970   3.860
 1026    HA   LEU 140           HA       LEU 140   3.912  -5.953   5.863
 1027    HB2  LEU 140           HB2      LEU 140   5.646  -4.967   4.359
 1028    HB3  LEU 140           HB1      LEU 140   4.807  -6.365   3.712
 1029    HG   LEU 140           HG       LEU 140   3.334  -4.219   2.767
 1030   HD11  LEU 140          HD11      LEU 140   5.051  -2.661   3.500
 1031   HD12  LEU 140          HD12      LEU 140   5.001  -2.744   1.737
 1032   HD13  LEU 140          HD13      LEU 140   6.278  -3.580   2.623
 1033   HD21  LEU 140          HD21      LEU 140   5.568  -5.733   1.419
 1034   HD22  LEU 140          HD22      LEU 140   4.299  -4.818   0.602
 1035   HD23  LEU 140          HD23      LEU 140   3.888  -6.253   1.545
 1036    H    GLU 141           HN       GLU 141   4.670  -4.582   7.329
 1037    HA   GLU 141           HA       GLU 141   3.816  -1.786   7.163
 1038    HB2  GLU 141           HB2      GLU 141   3.259  -2.999   9.217
 1039    HB3  GLU 141           HB1      GLU 141   4.956  -3.382   9.464
 1040    HG2  GLU 141           HG2      GLU 141   5.424  -0.965   9.668
 1041    HG3  GLU 141           HG1      GLU 141   3.688  -0.659   9.546
 1042    H    VAL 142           HN       VAL 142   5.249  -0.289   6.534
 1043    HA   VAL 142           HA       VAL 142   8.093  -1.002   6.697
 1044    HB   VAL 142           HB       VAL 142   8.387   0.601   4.728
 1045   HG11  VAL 142          HG11      VAL 142   8.638  -1.835   4.595
 1046   HG12  VAL 142          HG12      VAL 142   7.946  -1.164   3.119
 1047   HG13  VAL 142          HG13      VAL 142   6.909  -1.990   4.283
 1048   HG21  VAL 142          HG21      VAL 142   6.438   0.787   3.235
 1049   HG22  VAL 142          HG22      VAL 142   6.190   1.631   4.764
 1050   HG23  VAL 142          HG23      VAL 142   5.428   0.065   4.489
 1051    H    THR 143           HN       THR 143   9.251   0.175   7.978
 1052    HA   THR 143           HA       THR 143   8.498   2.910   8.682
 1053    HB   THR 143           HB       THR 143  10.954   1.402   9.614
 1054    HG1  THR 143           HG1      THR 143   8.484   1.453  11.041
 1055   HG21  THR 143          HG21      THR 143   9.311   3.628  10.850
 1056   HG22  THR 143          HG22      THR 143  10.903   3.792  10.106
 1057   HG23  THR 143          HG23      THR 143  10.714   2.857  11.589
 1058    H    LEU 144           HN       LEU 144   9.120   4.405   7.181
 1059    HA   LEU 144           HA       LEU 144  11.642   4.093   5.772
 1060    HB2  LEU 144           HB2      LEU 144   9.695   5.095   4.635
 1061    HB3  LEU 144           HB1      LEU 144   9.687   6.400   5.805
 1062    HG   LEU 144           HG       LEU 144  11.881   7.153   4.992
 1063   HD11  LEU 144          HD11      LEU 144  12.854   6.171   2.976
 1064   HD12  LEU 144          HD12      LEU 144  11.589   4.944   2.956
 1065   HD13  LEU 144          HD13      LEU 144  12.761   4.979   4.273
 1066   HD21  LEU 144          HD21      LEU 144  11.135   8.060   2.899
 1067   HD22  LEU 144          HD22      LEU 144   9.750   7.975   3.989
 1068   HD23  LEU 144          HD23      LEU 144   9.944   6.775   2.716
 1069    H    LYS 145           HN       LYS 145  13.328   4.291   7.014
 1070    HA   LYS 145           HA       LYS 145  13.232   6.125   9.286
 1071    HB2  LYS 145           HB2      LYS 145  15.411   4.133   8.682
 1072    HB3  LYS 145           HB1      LYS 145  14.955   4.825  10.237
 1073    HG2  LYS 145           HG2      LYS 145  12.917   3.560  10.265
 1074    HG3  LYS 145           HG1      LYS 145  13.234   2.954   8.637
 1075    HD2  LYS 145           HD2      LYS 145  14.994   2.439  11.033
 1076    HD3  LYS 145           HD1      LYS 145  13.767   1.316  10.422
 1077    HE2  LYS 145           HE2      LYS 145  14.928   0.891   8.483
 1078    HE3  LYS 145           HE1      LYS 145  15.892   2.367   8.588
 1079    HZ1  LYS 145           HZ1      LYS 145  16.192  -0.129  10.169
 1080    HZ2  LYS 145           HZ2      LYS 145  16.919   1.330  10.635
 1081    HZ3  LYS 145           HZ3      LYS 145  17.336   0.615   9.159
 1082    H    THR 146           HN       THR 146  14.941   5.549   6.288
 1083    HA   THR 146           HA       THR 146  16.159   8.168   6.488
 1084    HB   THR 146           HB       THR 146  17.907   5.765   5.957
 1085    HG1  THR 146           HG1      THR 146  17.056   6.839   8.349
 1086   HG21  THR 146          HG21      THR 146  18.722   7.870   5.017
 1087   HG22  THR 146          HG22      THR 146  19.746   7.356   6.357
 1088   HG23  THR 146          HG23      THR 146  18.572   8.649   6.592
 1089    H    ALA 147           HN       ALA 147  16.814   9.004   4.493
 1090    HA   ALA 147           HA       ALA 147  16.623   7.286   2.129
 1091    HB1  ALA 147           HB1      ALA 147  14.484   8.496   2.296
 1092    HB2  ALA 147           HB2      ALA 147  15.419   9.031   0.900
 1093    HB3  ALA 147           HB3      ALA 147  15.359  10.025   2.355
 1094    H    VAL 148           HN       VAL 148  18.377   7.588   0.790
 1095    HA   VAL 148           HA       VAL 148  19.856  10.104   1.157
 1096    HB   VAL 148           HB       VAL 148  22.019   8.941   1.046
 1097   HG11  VAL 148          HG11      VAL 148  21.130   9.509   3.224
 1098   HG12  VAL 148          HG12      VAL 148  21.986   7.967   3.308
 1099   HG13  VAL 148          HG13      VAL 148  20.220   7.998   3.276
 1100   HG21  VAL 148          HG21      VAL 148  21.399   6.926  -0.127
 1101   HG22  VAL 148          HG22      VAL 148  20.379   6.420   1.223
 1102   HG23  VAL 148          HG23      VAL 148  22.130   6.513   1.424
 1103    H    ASP 149           HN       ASP 149  20.452  11.069  -0.645
 1104    HA   ASP 149           HA       ASP 149  19.577   9.817  -3.102
 1105    HB2  ASP 149           HB2      ASP 149  19.486  11.963  -4.052
 1106    HB3  ASP 149           HB1      ASP 149  18.963  12.186  -2.396
 1107    H    LEU 150           HN       LEU 150  20.889   8.902  -4.486
 1108    HA   LEU 150           HA       LEU 150  23.625   9.829  -4.696
 1109    HB2  LEU 150           HB2      LEU 150  24.600   7.705  -4.478
 1110    HB3  LEU 150           HB1      LEU 150  23.472   7.870  -3.153
 1111    HG   LEU 150           HG       LEU 150  23.289   5.644  -3.825
 1112   HD11  LEU 150          HD11      LEU 150  21.034   6.972  -5.286
 1113   HD12  LEU 150          HD12      LEU 150  21.114   6.731  -3.541
 1114   HD13  LEU 150          HD13      LEU 150  21.066   5.337  -4.619
 1115   HD21  LEU 150          HD21      LEU 150  23.154   6.549  -6.689
 1116   HD22  LEU 150          HD22      LEU 150  22.985   4.885  -6.131
 1117   HD23  LEU 150          HD23      LEU 150  24.508   5.742  -5.898
 1118    H    GLU 151           HN       GLU 151  20.817   9.304  -6.161
 1119    HA   GLU 151           HA       GLU 151  21.759   8.163  -8.636
 1120    HB2  GLU 151           HB2      GLU 151  19.257   8.453  -7.443
 1121    HB3  GLU 151           HB1      GLU 151  19.207   9.544  -8.822
 1122    HG2  GLU 151           HG2      GLU 151  19.917   6.620  -8.935
 1123    HG3  GLU 151           HG1      GLU 151  18.344   7.310  -9.345
 1124    H    HIS 152           HN       HIS 152  23.239   9.429  -9.573
 1125    HA   HIS 152           HA       HIS 152  24.129  11.094 -10.809
 1126    HB2  HIS 152           HB2      HIS 152  21.358  12.303 -10.769
 1127    HB3  HIS 152           HB1      HIS 152  22.684  12.825 -11.806
 1128    HD1  HIS 152           HD1      HIS 152  23.710  10.208 -12.895
 1129    HD2  HIS 152           HD2      HIS 152  19.659  11.013 -12.435
 1130    HE1  HIS 152           HE1      HIS 152  22.533   8.715 -14.539
 1131    HE2  HIS 152           HE2      HIS 152  20.088   9.009 -14.013
 1132    H    HIS 153           HN       HIS 153  22.981  11.421  -7.781
 1133    HA   HIS 153           HA       HIS 153  23.730  12.555  -5.987
 1134    HB2  HIS 153           HB2      HIS 153  25.657  13.735  -7.980
 1135    HB3  HIS 153           HB1      HIS 153  25.668  14.159  -6.271
 1136    HD1  HIS 153           HD1      HIS 153  27.360  12.871  -5.011
 1137    HD2  HIS 153           HD2      HIS 153  25.778  10.672  -8.167
 1138    HE1  HIS 153           HE1      HIS 153  28.524  10.643  -4.941
 1139    HE2  HIS 153           HE2      HIS 153  27.719   9.427  -7.006
 1140    H    HIS 154           HN       HIS 154  22.897  14.151  -4.871
 1141    HA   HIS 154           HA       HIS 154  21.170  16.073  -5.699
 1142    HB2  HIS 154           HB2      HIS 154  21.900  17.372  -3.628
 1143    HB3  HIS 154           HB1      HIS 154  21.418  15.700  -3.367
 1144    HD1  HIS 154           HD1      HIS 154  24.335  18.010  -3.052
 1145    HD2  HIS 154           HD2      HIS 154  23.546  13.933  -2.727
 1146    HE1  HIS 154           HE1      HIS 154  26.341  17.010  -1.916
 1147    HE2  HIS 154           HE2      HIS 154  25.839  14.548  -1.704
 1148    H    HIS 155           HN       HIS 155  21.375  17.566  -7.216
 1149    HA   HIS 155           HA       HIS 155  23.905  18.979  -7.526
 1150    HB2  HIS 155           HB2      HIS 155  21.407  18.819  -9.176
 1151    HB3  HIS 155           HB1      HIS 155  22.534  20.153  -9.414
 1152    HD1  HIS 155           HD1      HIS 155  24.819  19.617 -10.462
 1153    HD2  HIS 155           HD2      HIS 155  22.341  16.304 -10.004
 1154    HE1  HIS 155           HE1      HIS 155  25.903  17.767 -11.781
 1155    HE2  HIS 155           HE2      HIS 155  24.314  15.816 -11.608
 1156    H    HIS 156           HN       HIS 156  20.928  19.264  -5.941
 1157    HA   HIS 156           HA       HIS 156  21.148  22.084  -5.475
 1158    HB2  HIS 156           HB2      HIS 156  19.449  21.793  -3.742
 1159    HB3  HIS 156           HB1      HIS 156  18.962  20.963  -5.207
 1160    HD1  HIS 156           HD1      HIS 156  19.466  20.471  -1.619
 1161    HD2  HIS 156           HD2      HIS 156  19.214  18.063  -5.001
 1162    HE1  HIS 156           HE1      HIS 156  19.026  18.155  -0.763
 1163    HE2  HIS 156           HE2      HIS 156  18.758  16.731  -2.820
 1164    H    HIS 157           HN       HIS 157  23.221  22.444  -4.921
 1165    HA   HIS 157           HA       HIS 157  25.054  22.700  -3.624
 1166    HB2  HIS 157           HB2      HIS 157  23.404  21.487  -1.391
 1167    HB3  HIS 157           HB1      HIS 157  24.947  22.313  -1.199
 1168    HD1  HIS 157           HD1      HIS 157  22.928  23.533   0.455
 1169    HD2  HIS 157           HD2      HIS 157  23.178  24.491  -3.583
 1170    HE1  HIS 157           HE1      HIS 157  21.741  25.731   0.205
 1171    HE2  HIS 157           HE2      HIS 157  21.713  26.167  -2.271
  Start of MODEL   14
    1    H1   MET   1           HT1      MET   1 -34.002  15.036 -46.299
    2    H2   MET   1           HT2      MET   1 -33.976  15.062 -47.995
    3    H3   MET   1           HT3      MET   1 -33.445  13.687 -47.159
    4    HA   MET   1           HA       MET   1 -36.215  14.731 -47.226
    5    HB2  MET   1           HB2      MET   1 -35.018  12.186 -48.353
    6    HB3  MET   1           HB1      MET   1 -36.721  12.617 -48.394
    7    HG2  MET   1           HG2      MET   1 -34.494  14.102 -49.766
    8    HG3  MET   1           HG1      MET   1 -35.640  13.009 -50.538
    9    HE1  MET   1           HE1      MET   1 -38.250  13.491 -50.702
   10    HE2  MET   1           HE2      MET   1 -39.024  14.954 -50.092
   11    HE3  MET   1           HE3      MET   1 -38.350  13.774 -48.963
   12    H    GLY   2           HN       GLY   2 -33.960  12.265 -46.016
   13    HA2  GLY   2           HA2      GLY   2 -35.538  12.102 -43.573
   14    HA3  GLY   2           HA1      GLY   2 -35.403  10.609 -44.497
   15    H    GLN   3           HN       GLN   3 -34.297   9.755 -42.591
   16    HA   GLN   3           HA       GLN   3 -31.486  10.637 -42.482
   17    HB2  GLN   3           HB2      GLN   3 -32.836  10.935 -40.357
   18    HB3  GLN   3           HB1      GLN   3 -32.968   9.182 -40.287
   19    HG2  GLN   3           HG2      GLN   3 -30.380   9.240 -40.440
   20    HG3  GLN   3           HG1      GLN   3 -30.568  10.913 -39.919
   21   HE21  GLN   3          HE21      GLN   3 -30.831   7.587 -39.038
   22   HE22  GLN   3          HE22      GLN   3 -31.074   7.844 -37.340
   23    HA   PRO   4           HA       PRO   4 -30.422   6.537 -43.962
   24    HB2  PRO   4           HB2      PRO   4 -27.917   7.067 -42.461
   25    HB3  PRO   4           HB1      PRO   4 -28.141   6.612 -44.154
   26    HG2  PRO   4           HG2      PRO   4 -27.444   9.098 -43.483
   27    HG3  PRO   4           HG1      PRO   4 -28.566   8.790 -44.821
   28    HD2  PRO   4           HD2      PRO   4 -29.142   9.716 -42.036
   29    HD3  PRO   4           HD1      PRO   4 -29.885  10.220 -43.570
   30    HA   PRO   5           HA       PRO   5 -31.413   4.109 -40.385
   31    HB2  PRO   5           HB2      PRO   5 -30.072   1.871 -41.763
   32    HB3  PRO   5           HB1      PRO   5 -31.755   2.028 -41.254
   33    HG2  PRO   5           HG2      PRO   5 -31.059   2.147 -43.841
   34    HG3  PRO   5           HG1      PRO   5 -32.376   3.138 -43.183
   35    HD2  PRO   5           HD2      PRO   5 -29.561   3.917 -43.843
   36    HD3  PRO   5           HD1      PRO   5 -31.072   4.813 -44.112
   37    H    ALA   6           HN       ALA   6 -30.366   4.034 -38.513
   38    HA   ALA   6           HA       ALA   6 -27.488   4.054 -38.403
   39    HB1  ALA   6           HB1      ALA   6 -28.813   5.399 -36.847
   40    HB2  ALA   6           HB2      ALA   6 -27.807   4.238 -35.979
   41    HB3  ALA   6           HB3      ALA   6 -29.532   3.932 -36.183
   42    H    GLU   7           HN       GLU   7 -26.946   2.585 -36.136
   43    HA   GLU   7           HA       GLU   7 -26.181   0.538 -35.535
   44    HB2  GLU   7           HB2      GLU   7 -28.571  -0.764 -36.820
   45    HB3  GLU   7           HB1      GLU   7 -27.728  -1.210 -35.343
   46    HG2  GLU   7           HG2      GLU   7 -29.527   1.182 -35.700
   47    HG3  GLU   7           HG1      GLU   7 -29.941  -0.314 -34.874
   48    H    GLU   8           HN       GLU   8 -24.392   0.413 -36.830
   49    HA   GLU   8           HA       GLU   8 -24.642   0.331 -39.658
   50    HB2  GLU   8           HB2      GLU   8 -22.139   0.155 -39.624
   51    HB3  GLU   8           HB1      GLU   8 -22.815   1.540 -38.787
   52    HG2  GLU   8           HG2      GLU   8 -22.146  -0.937 -37.269
   53    HG3  GLU   8           HG1      GLU   8 -20.877   0.205 -37.715
   54    H    ALA   9           HN       ALA   9 -24.535  -1.224 -41.076
   55    HA   ALA   9           HA       ALA   9 -23.685  -3.905 -40.200
   56    HB1  ALA   9           HB1      ALA   9 -25.597  -3.192 -42.430
   57    HB2  ALA   9           HB2      ALA   9 -26.056  -3.817 -40.846
   58    HB3  ALA   9           HB3      ALA   9 -25.120  -4.821 -41.952
   59    H    GLU  10           HN       GLU  10 -22.552  -1.305 -41.643
   60    HA   GLU  10           HA       GLU  10 -21.378  -2.523 -44.009
   61    HB2  GLU  10           HB2      GLU  10 -22.236  -0.167 -44.029
   62    HB3  GLU  10           HB1      GLU  10 -20.972   0.257 -42.883
   63    HG2  GLU  10           HG2      GLU  10 -20.375   0.894 -45.147
   64    HG3  GLU  10           HG1      GLU  10 -19.271  -0.324 -44.513
   65    H    GLN  11           HN       GLN  11 -20.073  -0.614 -41.297
   66    HA   GLN  11           HA       GLN  11 -17.979  -2.640 -40.985
   67    HB2  GLN  11           HB2      GLN  11 -17.552   0.354 -40.958
   68    HB3  GLN  11           HB1      GLN  11 -16.346  -0.831 -40.473
   69    HG2  GLN  11           HG2      GLN  11 -16.481  -1.792 -42.765
   70    HG3  GLN  11           HG1      GLN  11 -17.529  -0.444 -43.208
   71   HE21  GLN  11          HE21      GLN  11 -14.316  -1.424 -42.356
   72   HE22  GLN  11          HE22      GLN  11 -13.526   0.047 -42.821
   73    HA   PRO  12           HA       PRO  12 -19.800  -1.769 -36.900
   74    HB2  PRO  12           HB2      PRO  12 -20.118  -4.511 -36.360
   75    HB3  PRO  12           HB1      PRO  12 -21.374  -3.393 -36.891
   76    HG2  PRO  12           HG2      PRO  12 -20.321  -5.566 -38.346
   77    HG3  PRO  12           HG1      PRO  12 -21.402  -4.305 -38.955
   78    HD2  PRO  12           HD2      PRO  12 -18.462  -4.581 -39.250
   79    HD3  PRO  12           HD1      PRO  12 -19.642  -3.811 -40.331
   80    H    GLY  13           HN       GLY  13 -19.185  -3.041 -34.731
   81    HA2  GLY  13           HA2      GLY  13 -17.422  -4.293 -33.635
   82    HA3  GLY  13           HA1      GLY  13 -16.332  -3.755 -34.906
   83    H    ALA  14           HN       ALA  14 -18.381  -2.502 -32.312
   84    HA   ALA  14           HA       ALA  14 -16.246  -0.685 -31.536
   85    HB1  ALA  14           HB1      ALA  14 -17.597   0.623 -33.109
   86    HB2  ALA  14           HB2      ALA  14 -17.729   1.259 -31.468
   87    HB3  ALA  14           HB3      ALA  14 -19.038   0.292 -32.147
   88    H    LEU  15           HN       LEU  15 -15.989  -1.771 -29.644
   89    HA   LEU  15           HA       LEU  15 -18.300  -2.107 -27.875
   90    HB2  LEU  15           HB2      LEU  15 -15.432  -3.013 -27.574
   91    HB3  LEU  15           HB1      LEU  15 -16.729  -3.383 -26.453
   92    HG   LEU  15           HG       LEU  15 -16.619  -4.285 -29.332
   93   HD11  LEU  15          HD11      LEU  15 -16.092  -5.762 -26.763
   94   HD12  LEU  15          HD12      LEU  15 -14.919  -5.388 -28.026
   95   HD13  LEU  15          HD13      LEU  15 -16.238  -6.514 -28.351
   96   HD21  LEU  15          HD21      LEU  15 -18.521  -5.006 -27.104
   97   HD22  LEU  15          HD22      LEU  15 -18.513  -5.695 -28.727
   98   HD23  LEU  15          HD23      LEU  15 -18.900  -3.990 -28.494
   99    H    ALA  16           HN       ALA  16 -15.021  -0.734 -27.759
  100    HA   ALA  16           HA       ALA  16 -15.726   0.778 -25.374
  101    HB1  ALA  16           HB1      ALA  16 -13.364   1.358 -25.254
  102    HB2  ALA  16           HB2      ALA  16 -13.087   0.636 -26.839
  103    HB3  ALA  16           HB3      ALA  16 -13.545  -0.385 -25.474
  104    H    ARG  17           HN       ARG  17 -17.313   2.083 -26.549
  105    HA   ARG  17           HA       ARG  17 -16.251   4.012 -28.443
  106    HB2  ARG  17           HB2      ARG  17 -18.602   4.896 -28.466
  107    HB3  ARG  17           HB1      ARG  17 -18.435   3.222 -28.968
  108    HG2  ARG  17           HG2      ARG  17 -19.507   2.410 -27.124
  109    HG3  ARG  17           HG1      ARG  17 -19.055   3.791 -26.122
  110    HD2  ARG  17           HD2      ARG  17 -21.466   3.720 -26.674
  111    HD3  ARG  17           HD1      ARG  17 -20.664   5.189 -27.221
  112    HE   ARG  17           HE       ARG  17 -20.637   3.375 -29.347
  113   HH11  ARG  17          HH11      ARG  17 -22.925   5.225 -27.461
  114   HH12  ARG  17          HH12      ARG  17 -24.109   5.308 -28.731
  115   HH21  ARG  17          HH21      ARG  17 -22.167   3.501 -31.044
  116   HH22  ARG  17          HH22      ARG  17 -23.675   4.335 -30.783
  117    H    GLU  18           HN       GLU  18 -16.366   3.768 -25.139
  118    HA   GLU  18           HA       GLU  18 -15.823   5.195 -23.451
  119    HB2  GLU  18           HB2      GLU  18 -14.228   6.178 -25.039
  120    HB3  GLU  18           HB1      GLU  18 -15.486   7.243 -25.646
  121    HG2  GLU  18           HG2      GLU  18 -15.640   8.287 -23.421
  122    HG3  GLU  18           HG1      GLU  18 -14.324   7.248 -22.871
  123    H    PHE  19           HN       PHE  19 -17.396   5.692 -22.085
  124    HA   PHE  19           HA       PHE  19 -19.186   7.862 -22.549
  125    HB2  PHE  19           HB2      PHE  19 -21.297   6.573 -22.492
  126    HB3  PHE  19           HB1      PHE  19 -20.349   6.235 -23.932
  127    HD1  PHE  19           HD2      PHE  19 -18.983   4.099 -23.994
  128    HD2  PHE  19           HD1      PHE  19 -21.979   4.848 -21.068
  129    HE1  PHE  19           HE2      PHE  19 -19.104   1.689 -23.504
  130    HE2  PHE  19           HE1      PHE  19 -22.102   2.444 -20.572
  131    HZ   PHE  19           HZ       PHE  19 -20.712   0.855 -21.837
  132    H    LEU  20           HN       LEU  20 -20.731   8.130 -20.752
  133    HA   LEU  20           HA       LEU  20 -21.268   8.306 -18.570
  134    HB2  LEU  20           HB2      LEU  20 -19.924   5.624 -18.295
  135    HB3  LEU  20           HB1      LEU  20 -20.864   6.407 -17.039
  136    HG   LEU  20           HG       LEU  20 -21.872   5.380 -19.687
  137   HD11  LEU  20          HD11      LEU  20 -22.464   4.542 -16.851
  138   HD12  LEU  20          HD12      LEU  20 -21.502   3.649 -18.027
  139   HD13  LEU  20          HD13      LEU  20 -23.227   3.886 -18.299
  140   HD21  LEU  20          HD21      LEU  20 -22.982   7.476 -19.141
  141   HD22  LEU  20          HD22      LEU  20 -23.379   6.863 -17.538
  142   HD23  LEU  20          HD23      LEU  20 -24.087   6.113 -18.967
  143    H    ALA  21           HN       ALA  21 -19.731  10.055 -18.756
  144    HA   ALA  21           HA       ALA  21 -17.985  11.336 -18.107
  145    HB1  ALA  21           HB1      ALA  21 -18.044   9.569 -15.661
  146    HB2  ALA  21           HB2      ALA  21 -19.079  10.974 -15.930
  147    HB3  ALA  21           HB3      ALA  21 -17.332  11.179 -15.775
  148    H    ALA  22           HN       ALA  22 -16.277   9.250 -16.089
  149    HA   ALA  22           HA       ALA  22 -14.483   8.488 -18.298
  150    HB1  ALA  22           HB1      ALA  22 -13.483  10.146 -16.775
  151    HB2  ALA  22           HB2      ALA  22 -12.625   8.604 -16.739
  152    HB3  ALA  22           HB3      ALA  22 -13.725   9.033 -15.426
  153    H    MET  23           HN       MET  23 -15.666   7.531 -15.075
  154    HA   MET  23           HA       MET  23 -15.433   4.731 -15.919
  155    HB2  MET  23           HB2      MET  23 -14.349   5.893 -13.351
  156    HB3  MET  23           HB1      MET  23 -14.542   4.170 -13.642
  157    HG2  MET  23           HG2      MET  23 -12.967   4.275 -15.475
  158    HG3  MET  23           HG1      MET  23 -12.816   6.019 -15.272
  159    HE1  MET  23           HE1      MET  23 -12.789   6.316 -12.088
  160    HE2  MET  23           HE2      MET  23 -11.699   7.177 -13.175
  161    HE3  MET  23           HE3      MET  23 -11.050   6.297 -11.788
  162    H    GLU  24           HN       GLU  24 -17.615   6.802 -15.324
  163    HA   GLU  24           HA       GLU  24 -19.627   6.994 -14.299
  164    HB2  GLU  24           HB2      GLU  24 -20.118   4.910 -15.412
  165    HB3  GLU  24           HB1      GLU  24 -19.310   3.989 -14.151
  166    HG2  GLU  24           HG2      GLU  24 -21.631   3.751 -13.796
  167    HG3  GLU  24           HG1      GLU  24 -21.032   4.839 -12.549
  168    HA   PRO  25           HA       PRO  25 -17.923   7.238 -10.129
  169    HB2  PRO  25           HB2      PRO  25 -19.680   9.518  -9.770
  170    HB3  PRO  25           HB1      PRO  25 -17.919   9.470  -9.818
  171    HG2  PRO  25           HG2      PRO  25 -19.447  10.610 -11.772
  172    HG3  PRO  25           HG1      PRO  25 -17.838   9.928 -12.054
  173    HD2  PRO  25           HD2      PRO  25 -20.524   8.747 -12.630
  174    HD3  PRO  25           HD1      PRO  25 -19.026   8.666 -13.582
  175    H    GLU  26           HN       GLU  26 -18.878   5.467  -9.182
  176    HA   GLU  26           HA       GLU  26 -21.670   5.602  -8.369
  177    HB2  GLU  26           HB2      GLU  26 -19.569   3.504  -7.787
  178    HB3  GLU  26           HB1      GLU  26 -21.283   3.369  -7.429
  179    HG2  GLU  26           HG2      GLU  26 -21.755   3.492  -9.854
  180    HG3  GLU  26           HG1      GLU  26 -20.015   3.500 -10.155
  181    HA   PRO  27           HA       PRO  27 -20.912   7.286  -4.326
  182    HB2  PRO  27           HB2      PRO  27 -22.874   5.303  -3.321
  183    HB3  PRO  27           HB1      PRO  27 -22.899   7.065  -3.206
  184    HG2  PRO  27           HG2      PRO  27 -24.536   5.782  -4.878
  185    HG3  PRO  27           HG1      PRO  27 -23.788   7.326  -5.331
  186    HD2  PRO  27           HD2      PRO  27 -23.047   4.545  -6.157
  187    HD3  PRO  27           HD1      PRO  27 -23.096   6.033  -7.124
  188    H    ALA  28           HN       ALA  28 -19.183   6.834  -3.144
  189    HA   ALA  28           HA       ALA  28 -18.143   4.198  -2.840
  190    HB1  ALA  28           HB1      ALA  28 -16.449   5.261  -1.411
  191    HB2  ALA  28           HB2      ALA  28 -17.362   6.769  -1.464
  192    HB3  ALA  28           HB3      ALA  28 -16.655   6.115  -2.940
  193    HA   PRO  29           HA       PRO  29 -20.061   2.587   0.794
  194    HB2  PRO  29           HB2      PRO  29 -17.781   2.122   2.356
  195    HB3  PRO  29           HB1      PRO  29 -18.548   0.972   1.256
  196    HG2  PRO  29           HG2      PRO  29 -16.167   2.705   0.831
  197    HG3  PRO  29           HG1      PRO  29 -16.517   1.092   0.182
  198    HD2  PRO  29           HD2      PRO  29 -16.711   3.281  -1.348
  199    HD3  PRO  29           HD1      PRO  29 -17.851   1.929  -1.521
  200    H    ALA  30           HN       ALA  30 -20.982   3.540   2.489
  201    HA   ALA  30           HA       ALA  30 -20.004   6.026   3.463
  202    HB1  ALA  30           HB1      ALA  30 -22.273   4.324   4.480
  203    HB2  ALA  30           HB2      ALA  30 -22.398   5.631   3.304
  204    HB3  ALA  30           HB3      ALA  30 -21.941   5.985   4.969
  205    HA   PRO  31           HA       PRO  31 -18.765   3.601   7.388
  206    HB2  PRO  31           HB2      PRO  31 -19.096   0.759   6.968
  207    HB3  PRO  31           HB1      PRO  31 -19.860   1.783   8.182
  208    HG2  PRO  31           HG2      PRO  31 -21.219   0.603   6.125
  209    HG3  PRO  31           HG1      PRO  31 -21.738   2.099   6.923
  210    HD2  PRO  31           HD2      PRO  31 -20.291   1.735   4.327
  211    HD3  PRO  31           HD1      PRO  31 -21.608   2.856   4.737
  212    H    ALA  32           HN       ALA  32 -16.620   3.843   7.204
  213    HA   ALA  32           HA       ALA  32 -15.073   2.936   5.043
  214    HB1  ALA  32           HB1      ALA  32 -14.148   3.765   7.791
  215    HB2  ALA  32           HB2      ALA  32 -14.457   4.853   6.437
  216    HB3  ALA  32           HB3      ALA  32 -13.148   3.672   6.340
  217    HA   PRO  33           HA       PRO  33 -14.494  -1.221   6.648
  218    HB2  PRO  33           HB2      PRO  33 -14.212  -2.420   4.284
  219    HB3  PRO  33           HB1      PRO  33 -15.783  -1.796   4.798
  220    HG2  PRO  33           HG2      PRO  33 -13.863  -0.699   2.813
  221    HG3  PRO  33           HG1      PRO  33 -15.631  -0.606   2.833
  222    HD2  PRO  33           HD2      PRO  33 -13.797   1.386   3.685
  223    HD3  PRO  33           HD1      PRO  33 -15.561   1.394   3.886
  224    H    GLU  34           HN       GLU  34 -12.347   0.818   6.415
  225    HA   GLU  34           HA       GLU  34 -10.116   1.033   6.401
  226    HB2  GLU  34           HB2      GLU  34 -10.272  -1.961   6.594
  227    HB3  GLU  34           HB1      GLU  34  -8.726  -1.128   6.485
  228    HG2  GLU  34           HG2      GLU  34  -9.467   0.241   8.475
  229    HG3  GLU  34           HG1      GLU  34 -10.804  -0.891   8.641
  230    H    GLU  35           HN       GLU  35 -11.492   1.232   4.022
  231    HA   GLU  35           HA       GLU  35  -9.783   0.147   1.956
  232    HB2  GLU  35           HB2      GLU  35 -12.284   0.699   1.718
  233    HB3  GLU  35           HB1      GLU  35 -11.788   2.382   1.687
  234    HG2  GLU  35           HG2      GLU  35 -12.100   1.651  -0.557
  235    HG3  GLU  35           HG1      GLU  35 -10.372   1.871  -0.284
  236    H    TRP  36           HN       TRP  36  -7.753   0.928   2.427
  237    HA   TRP  36           HA       TRP  36  -7.250   3.642   3.156
  238    HB2  TRP  36           HB2      TRP  36  -5.162   1.876   1.956
  239    HB3  TRP  36           HB1      TRP  36  -4.984   3.083   3.213
  240    HD1  TRP  36           HD1      TRP  36  -7.398   1.730   5.064
  241    HE1  TRP  36           HE1      TRP  36  -6.795  -0.407   6.372
  242    HE3  TRP  36           HE3      TRP  36  -3.244   0.307   2.429
  243    HZ2  TRP  36           HZ2      TRP  36  -4.797  -2.411   6.297
  244    HZ3  TRP  36           HZ3      TRP  36  -2.061  -1.705   3.118
  245    HH2  TRP  36           HH2      TRP  36  -2.809  -3.044   5.002
  246    H    LEU  37           HN       LEU  37  -5.009   4.273   1.573
  247    HA   LEU  37           HA       LEU  37  -6.327   5.258  -0.786
  248    HB2  LEU  37           HB2      LEU  37  -4.706   6.626   0.486
  249    HB3  LEU  37           HB1      LEU  37  -3.436   5.496   0.061
  250    HG   LEU  37           HG       LEU  37  -3.744   6.059  -2.324
  251   HD11  LEU  37          HD11      LEU  37  -5.697   8.106  -1.272
  252   HD12  LEU  37          HD12      LEU  37  -6.087   6.698  -2.259
  253   HD13  LEU  37          HD13      LEU  37  -5.109   8.000  -2.932
  254   HD21  LEU  37          HD21      LEU  37  -2.069   7.224  -0.973
  255   HD22  LEU  37          HD22      LEU  37  -3.261   8.446  -0.536
  256   HD23  LEU  37          HD23      LEU  37  -2.741   8.281  -2.212
  257    H    ASP  38           HN       ASP  38  -6.696   3.861  -2.342
  258    HA   ASP  38           HA       ASP  38  -5.073   1.748  -3.192
  259    HB2  ASP  38           HB2      ASP  38  -6.384   2.065  -5.384
  260    HB3  ASP  38           HB1      ASP  38  -7.308   1.708  -3.929
  261    H    ILE  39           HN       ILE  39  -2.990   2.198  -3.452
  262    HA   ILE  39           HA       ILE  39  -1.730   4.412  -4.460
  263    HB   ILE  39           HB       ILE  39  -0.853   1.539  -4.783
  264   HG12  ILE  39          HG12      ILE  39  -0.583   3.526  -2.537
  265   HG13  ILE  39          HG11      ILE  39  -1.272   1.911  -2.487
  266   HG21  ILE  39          HG21      ILE  39   1.417   2.429  -4.898
  267   HG22  ILE  39          HG22      ILE  39   0.784   4.070  -4.818
  268   HG23  ILE  39          HG23      ILE  39   0.420   3.053  -6.211
  269   HD11  ILE  39          HD11      ILE  39   1.642   2.563  -2.862
  270   HD12  ILE  39          HD12      ILE  39   0.948   0.943  -2.824
  271   HD13  ILE  39          HD13      ILE  39   0.889   1.959  -1.387
  272    H    LEU  40           HN       LEU  40  -2.722   1.531  -6.299
  273    HA   LEU  40           HA       LEU  40  -2.099   2.987  -8.755
  274    HB2  LEU  40           HB2      LEU  40  -2.401   0.050  -8.227
  275    HB3  LEU  40           HB1      LEU  40  -2.382   0.708  -9.851
  276    HG   LEU  40           HG       LEU  40  -0.147   0.926  -7.838
  277   HD11  LEU  40          HD11      LEU  40  -0.446  -1.320  -8.744
  278   HD12  LEU  40          HD12      LEU  40   1.039  -0.580  -9.341
  279   HD13  LEU  40          HD13      LEU  40  -0.383  -0.671 -10.381
  280   HD21  LEU  40          HD21      LEU  40  -0.153   2.880  -9.246
  281   HD22  LEU  40          HD22      LEU  40  -0.350   1.886 -10.689
  282   HD23  LEU  40          HD23      LEU  40   1.148   1.807  -9.759
  283    H    GLY  41           HN       GLY  41  -4.600   2.649  -6.833
  284    HA2  GLY  41           HA2      GLY  41  -6.811   3.207  -7.139
  285    HA3  GLY  41           HA1      GLY  41  -6.486   3.360  -8.858
  286    H    ASN  42           HN       ASN  42  -5.416   0.430  -7.719
  287    HA   ASN  42           HA       ASN  42  -7.696  -0.896  -8.955
  288    HB2  ASN  42           HB2      ASN  42  -6.161  -2.892  -9.000
  289    HB3  ASN  42           HB1      ASN  42  -5.645  -1.511  -9.953
  290   HD21  ASN  42          HD21      ASN  42  -5.252  -1.472  -6.485
  291   HD22  ASN  42          HD22      ASN  42  -3.534  -1.674  -6.497
  292    H    GLY  43           HN       GLY  43  -6.425  -0.324  -5.842
  293    HA2  GLY  43           HA2      GLY  43  -7.446  -0.918  -3.825
  294    HA3  GLY  43           HA1      GLY  43  -8.441  -2.082  -4.691
  295    H    LEU  44           HN       LEU  44  -6.016  -3.245  -5.975
  296    HA   LEU  44           HA       LEU  44  -5.416  -5.260  -4.063
  297    HB2  LEU  44           HB2      LEU  44  -4.289  -4.554  -6.770
  298    HB3  LEU  44           HB1      LEU  44  -3.606  -5.846  -5.812
  299    HG   LEU  44           HG       LEU  44  -5.711  -7.066  -5.909
  300   HD11  LEU  44          HD11      LEU  44  -7.279  -5.217  -6.011
  301   HD12  LEU  44          HD12      LEU  44  -7.531  -6.318  -7.365
  302   HD13  LEU  44          HD13      LEU  44  -6.689  -4.789  -7.618
  303   HD21  LEU  44          HD21      LEU  44  -4.138  -7.555  -7.609
  304   HD22  LEU  44          HD22      LEU  44  -4.622  -6.143  -8.546
  305   HD23  LEU  44          HD23      LEU  44  -5.732  -7.501  -8.359
  306    H    LEU  45           HN       LEU  45  -4.147  -2.257  -4.917
  307    HA   LEU  45           HA       LEU  45  -1.818  -2.602  -3.151
  308    HB2  LEU  45           HB2      LEU  45  -1.299  -2.256  -5.596
  309    HB3  LEU  45           HB1      LEU  45  -2.056  -0.701  -5.472
  310    HG   LEU  45           HG       LEU  45  -0.332   0.204  -4.216
  311   HD11  LEU  45          HD11      LEU  45   1.355  -1.118  -3.034
  312   HD12  LEU  45          HD12      LEU  45   0.589  -2.603  -3.594
  313   HD13  LEU  45          HD13      LEU  45  -0.268  -1.534  -2.484
  314   HD21  LEU  45          HD21      LEU  45   1.721  -0.404  -5.385
  315   HD22  LEU  45          HD22      LEU  45   0.351  -0.300  -6.496
  316   HD23  LEU  45          HD23      LEU  45   0.940  -1.876  -5.969
  317    H    ARG  46           HN       ARG  46  -2.237  -1.583  -1.258
  318    HA   ARG  46           HA       ARG  46  -3.243   1.180  -1.359
  319    HB2  ARG  46           HB2      ARG  46  -4.308  -0.844   0.602
  320    HB3  ARG  46           HB1      ARG  46  -4.835   0.811   0.392
  321    HG2  ARG  46           HG2      ARG  46  -5.696   0.247  -1.831
  322    HG3  ARG  46           HG1      ARG  46  -5.208  -1.429  -1.575
  323    HD2  ARG  46           HD2      ARG  46  -7.211   0.131   0.052
  324    HD3  ARG  46           HD1      ARG  46  -7.574  -1.161  -1.093
  325    HE   ARG  46           HE       ARG  46  -5.776  -2.023   0.949
  326   HH11  ARG  46          HH11      ARG  46  -9.165  -1.529   0.201
  327   HH12  ARG  46          HH12      ARG  46  -9.698  -2.625   1.445
  328   HH21  ARG  46          HH21      ARG  46  -6.517  -3.447   2.589
  329   HH22  ARG  46          HH22      ARG  46  -8.226  -3.700   2.782
  330    H    LYS  47           HN       LYS  47  -2.388   2.512   0.210
  331    HA   LYS  47           HA       LYS  47  -0.445   1.315   2.093
  332    HB2  LYS  47           HB2      LYS  47   0.312   2.896   0.153
  333    HB3  LYS  47           HB1      LYS  47  -0.396   4.168   1.127
  334    HG2  LYS  47           HG2      LYS  47   1.108   3.205   3.011
  335    HG3  LYS  47           HG1      LYS  47   2.006   2.493   1.673
  336    HD2  LYS  47           HD2      LYS  47   3.068   4.528   2.089
  337    HD3  LYS  47           HD1      LYS  47   2.063   4.840   0.683
  338    HE2  LYS  47           HE2      LYS  47   0.556   6.124   1.864
  339    HE3  LYS  47           HE1      LYS  47   0.959   5.370   3.403
  340    HZ1  LYS  47           HZ1      LYS  47   2.787   7.193   1.932
  341    HZ2  LYS  47           HZ2      LYS  47   2.983   6.603   3.517
  342    HZ3  LYS  47           HZ3      LYS  47   1.739   7.693   3.159
  343    H    LYS  48           HN       LYS  48  -0.957   1.586   4.243
  344    HA   LYS  48           HA       LYS  48  -2.857   3.738   4.933
  345    HB2  LYS  48           HB2      LYS  48  -3.471   1.389   5.629
  346    HB3  LYS  48           HB1      LYS  48  -2.058   1.399   6.677
  347    HG2  LYS  48           HG2      LYS  48  -3.110   3.585   7.620
  348    HG3  LYS  48           HG1      LYS  48  -4.595   2.954   6.915
  349    HD2  LYS  48           HD2      LYS  48  -2.874   1.663   9.026
  350    HD3  LYS  48           HD1      LYS  48  -4.507   2.300   9.219
  351    HE2  LYS  48           HE2      LYS  48  -4.970   0.534   7.275
  352    HE3  LYS  48           HE1      LYS  48  -3.566  -0.234   8.016
  353    HZ1  LYS  48           HZ1      LYS  48  -5.655  -1.021   8.977
  354    HZ2  LYS  48           HZ2      LYS  48  -6.039   0.558   9.452
  355    HZ3  LYS  48           HZ3      LYS  48  -4.706  -0.229  10.141
  356    H    THR  49           HN       THR  49  -2.023   5.485   5.857
  357    HA   THR  49           HA       THR  49   0.650   5.508   6.912
  358    HB   THR  49           HB       THR  49  -0.110   7.902   7.588
  359    HG1  THR  49           HG1      THR  49  -1.888   8.507   6.032
  360   HG21  THR  49          HG21      THR  49  -0.007   7.087   4.683
  361   HG22  THR  49          HG22      THR  49   1.392   7.382   5.718
  362   HG23  THR  49          HG23      THR  49   0.291   8.705   5.321
  363    H    LEU  50           HN       LEU  50   0.810   4.267   8.731
  364    HA   LEU  50           HA       LEU  50  -0.993   4.395  10.944
  365    HB2  LEU  50           HB2      LEU  50   1.948   3.829  11.198
  366    HB3  LEU  50           HB1      LEU  50   0.621   3.129  12.102
  367    HG   LEU  50           HG       LEU  50   1.092   2.570   9.183
  368   HD11  LEU  50          HD11      LEU  50   2.116   0.481   9.896
  369   HD12  LEU  50          HD12      LEU  50   1.978   0.982  11.583
  370   HD13  LEU  50          HD13      LEU  50   3.026   1.876  10.477
  371   HD21  LEU  50          HD21      LEU  50  -0.542   1.158  11.283
  372   HD22  LEU  50          HD22      LEU  50  -0.346   0.645   9.608
  373   HD23  LEU  50          HD23      LEU  50  -1.171   2.159   9.978
  374    H    VAL  51           HN       VAL  51   2.204   5.647  10.313
  375    HA   VAL  51           HA       VAL  51   1.477   8.251  11.469
  376    HB   VAL  51           HB       VAL  51   4.177   6.919  11.673
  377   HG11  VAL  51          HG11      VAL  51   3.206   9.534  12.828
  378   HG12  VAL  51          HG12      VAL  51   4.285   9.356  11.446
  379   HG13  VAL  51          HG13      VAL  51   4.813   8.840  13.049
  380   HG21  VAL  51          HG21      VAL  51   2.098   7.416  13.796
  381   HG22  VAL  51          HG22      VAL  51   3.750   6.891  14.124
  382   HG23  VAL  51          HG23      VAL  51   2.657   5.849  13.209
  383    HA   PRO  52           HA       PRO  52   3.196   8.974   7.409
  384    HB2  PRO  52           HB2      PRO  52   1.660  11.055   6.829
  385    HB3  PRO  52           HB1      PRO  52   0.990   9.441   7.096
  386    HG2  PRO  52           HG2      PRO  52   0.818  11.832   8.823
  387    HG3  PRO  52           HG1      PRO  52  -0.246  10.422   8.756
  388    HD2  PRO  52           HD2      PRO  52   2.007  10.936  10.530
  389    HD3  PRO  52           HD1      PRO  52   0.793   9.638  10.612
  390    H    GLY  53           HN       GLY  53   5.063   9.770   9.287
  391    HA2  GLY  53           HA2      GLY  53   7.015  10.988   8.935
  392    HA3  GLY  53           HA1      GLY  53   6.134  12.040   7.839
  393    HA   PRO  54           HA       PRO  54   6.459  13.917  12.254
  394    HB2  PRO  54           HB2      PRO  54   9.226  14.720  11.691
  395    HB3  PRO  54           HB1      PRO  54   8.556  13.972  13.143
  396    HG2  PRO  54           HG2      PRO  54  10.200  12.647  11.466
  397    HG3  PRO  54           HG1      PRO  54   8.905  11.835  12.366
  398    HD2  PRO  54           HD2      PRO  54   8.968  12.700   9.500
  399    HD3  PRO  54           HD1      PRO  54   8.317  11.210  10.216
  400    HA   PRO  55           HA       PRO  55   5.459  17.726  10.260
  401    HB2  PRO  55           HB2      PRO  55   6.899  19.046  12.519
  402    HB3  PRO  55           HB1      PRO  55   5.270  19.334  11.900
  403    HG2  PRO  55           HG2      PRO  55   5.636  17.973  14.159
  404    HG3  PRO  55           HG1      PRO  55   4.375  17.505  13.003
  405    HD2  PRO  55           HD2      PRO  55   7.016  16.237  13.545
  406    HD3  PRO  55           HD1      PRO  55   5.472  15.488  13.092
  407    H    GLY  56           HN       GLY  56   6.633  17.976   8.428
  408    HA2  GLY  56           HA2      GLY  56   8.144  19.395   7.252
  409    HA3  GLY  56           HA1      GLY  56   9.162  19.450   8.684
  410    H    SER  57           HN       SER  57   7.774  16.629   7.043
  411    HA   SER  57           HA       SER  57  10.377  15.412   6.912
  412    HB2  SER  57           HB2      SER  57   8.853  13.578   5.822
  413    HB3  SER  57           HB1      SER  57   8.762  13.867   7.560
  414    HG   SER  57           HG       SER  57   6.932  14.410   5.533
  415    H    SER  58           HN       SER  58  10.354  13.931   4.712
  416    HA   SER  58           HA       SER  58   9.820  15.582   2.378
  417    HB2  SER  58           HB2      SER  58  12.120  16.185   3.074
  418    HB3  SER  58           HB1      SER  58  12.567  14.480   3.033
  419    HG   SER  58           HG       SER  58  13.085  14.918   1.038
  420    H    ARG  59           HN       ARG  59   9.434  14.304   0.540
  421    HA   ARG  59           HA       ARG  59   9.368  11.436   1.051
  422    HB2  ARG  59           HB2      ARG  59   8.290  12.973  -1.323
  423    HB3  ARG  59           HB1      ARG  59   8.021  11.263  -0.962
  424    HG2  ARG  59           HG2      ARG  59   6.900  11.966   1.150
  425    HG3  ARG  59           HG1      ARG  59   7.019  13.634   0.590
  426    HD2  ARG  59           HD2      ARG  59   5.654  11.419  -0.930
  427    HD3  ARG  59           HD1      ARG  59   4.823  12.566   0.120
  428    HE   ARG  59           HE       ARG  59   6.126  14.200  -1.563
  429   HH11  ARG  59          HH11      ARG  59   4.225  11.336  -2.213
  430   HH12  ARG  59          HH12      ARG  59   3.553  11.960  -3.688
  431   HH21  ARG  59          HH21      ARG  59   5.245  15.019  -3.503
  432   HH22  ARG  59          HH22      ARG  59   4.125  14.050  -4.417
  433    HA   PRO  60           HA       PRO  60  13.390  10.946  -0.858
  434    HB2  PRO  60           HB2      PRO  60  12.867   8.229  -1.370
  435    HB3  PRO  60           HB1      PRO  60  13.692   8.892   0.041
  436    HG2  PRO  60           HG2      PRO  60  10.838   8.097  -0.287
  437    HG3  PRO  60           HG1      PRO  60  11.900   7.929   1.126
  438    HD2  PRO  60           HD2      PRO  60  10.047   9.829   1.083
  439    HD3  PRO  60           HD1      PRO  60  11.669  10.181   1.713
  440    H    VAL  61           HN       VAL  61  14.188  10.725  -2.921
  441    HA   VAL  61           HA       VAL  61  12.189  10.759  -5.053
  442    HB   VAL  61           HB       VAL  61  15.157  11.194  -5.367
  443   HG11  VAL  61          HG11      VAL  61  12.796  12.103  -7.003
  444   HG12  VAL  61          HG12      VAL  61  13.932  10.821  -7.424
  445   HG13  VAL  61          HG13      VAL  61  14.484  12.494  -7.332
  446   HG21  VAL  61          HG21      VAL  61  13.065  13.248  -4.662
  447   HG22  VAL  61          HG22      VAL  61  14.703  13.627  -5.187
  448   HG23  VAL  61          HG23      VAL  61  14.441  12.758  -3.674
  449    H    LYS  62           HN       LYS  62  12.333   9.328  -6.839
  450    HA   LYS  62           HA       LYS  62  13.351   6.725  -6.219
  451    HB2  LYS  62           HB2      LYS  62  12.189   7.871  -8.769
  452    HB3  LYS  62           HB1      LYS  62  12.656   6.186  -8.570
  453    HG2  LYS  62           HG2      LYS  62  11.070   6.276  -6.506
  454    HG3  LYS  62           HG1      LYS  62  10.400   7.687  -7.327
  455    HD2  LYS  62           HD2      LYS  62   9.938   6.379  -9.286
  456    HD3  LYS  62           HD1      LYS  62  10.724   4.970  -8.580
  457    HE2  LYS  62           HE2      LYS  62   9.005   5.232  -6.683
  458    HE3  LYS  62           HE1      LYS  62   8.127   6.254  -7.819
  459    HZ1  LYS  62           HZ1      LYS  62   7.272   4.104  -8.083
  460    HZ2  LYS  62           HZ2      LYS  62   8.804   3.382  -8.096
  461    HZ3  LYS  62           HZ3      LYS  62   8.297   4.326  -9.412
  462    H    GLY  63           HN       GLY  63  15.234   5.990  -6.494
  463    HA2  GLY  63           HA2      GLY  63  17.215   5.817  -8.006
  464    HA3  GLY  63           HA1      GLY  63  17.197   7.580  -7.997
  465    H    GLN  64           HN       GLN  64  16.298   7.609  -5.189
  466    HA   GLN  64           HA       GLN  64  18.920   7.445  -3.969
  467    HB2  GLN  64           HB2      GLN  64  16.444   7.976  -2.371
  468    HB3  GLN  64           HB1      GLN  64  18.062   8.650  -2.184
  469    HG2  GLN  64           HG2      GLN  64  16.036   9.394  -4.278
  470    HG3  GLN  64           HG1      GLN  64  16.480  10.339  -2.865
  471   HE21  GLN  64          HE21      GLN  64  18.703   8.656  -5.044
  472   HE22  GLN  64          HE22      GLN  64  19.502  10.092  -5.596
  473    H    VAL  65           HN       VAL  65  19.610   5.849  -2.593
  474    HA   VAL  65           HA       VAL  65  17.835   3.592  -2.284
  475    HB   VAL  65           HB       VAL  65  19.632   2.362  -1.317
  476   HG11  VAL  65          HG11      VAL  65  20.647   4.025  -3.612
  477   HG12  VAL  65          HG12      VAL  65  19.712   2.532  -3.718
  478   HG13  VAL  65          HG13      VAL  65  21.353   2.501  -3.069
  479   HG21  VAL  65          HG21      VAL  65  21.134   4.966  -1.147
  480   HG22  VAL  65          HG22      VAL  65  21.879   3.379  -0.934
  481   HG23  VAL  65          HG23      VAL  65  20.620   3.920   0.181
  482    H    VAL  66           HN       VAL  66  16.521   3.376  -0.693
  483    HA   VAL  66           HA       VAL  66  16.814   5.147   1.636
  484    HB   VAL  66           HB       VAL  66  14.351   5.077   1.807
  485   HG11  VAL  66          HG11      VAL  66  15.280   6.970   0.690
  486   HG12  VAL  66          HG12      VAL  66  13.888   6.441  -0.257
  487   HG13  VAL  66          HG13      VAL  66  15.519   6.052  -0.794
  488   HG21  VAL  66          HG21      VAL  66  14.378   3.808  -0.928
  489   HG22  VAL  66          HG22      VAL  66  12.978   4.176   0.083
  490   HG23  VAL  66          HG23      VAL  66  14.099   2.902   0.564
  491    H    THR  67           HN       THR  67  16.349   4.369   3.656
  492    HA   THR  67           HA       THR  67  16.504   1.459   3.879
  493    HB   THR  67           HB       THR  67  16.981   1.924   6.296
  494    HG1  THR  67           HG1      THR  67  17.593   4.123   6.771
  495   HG21  THR  67          HG21      THR  67  19.263   2.708   5.929
  496   HG22  THR  67          HG22      THR  67  18.821   3.246   4.306
  497   HG23  THR  67          HG23      THR  67  18.790   1.527   4.711
  498    H    VAL  68           HN       VAL  68  14.608   0.485   3.977
  499    HA   VAL  68           HA       VAL  68  12.570   1.702   5.696
  500    HB   VAL  68           HB       VAL  68  10.929   0.192   4.606
  501   HG11  VAL  68          HG11      VAL  68  11.224   2.502   3.844
  502   HG12  VAL  68          HG12      VAL  68  10.747   1.425   2.534
  503   HG13  VAL  68          HG13      VAL  68  12.422   1.952   2.671
  504   HG21  VAL  68          HG21      VAL  68  12.493  -1.560   3.884
  505   HG22  VAL  68          HG22      VAL  68  13.183  -0.448   2.702
  506   HG23  VAL  68          HG23      VAL  68  11.506  -0.967   2.550
  507    H    HIS  69           HN       HIS  69  11.614   0.485   7.310
  508    HA   HIS  69           HA       HIS  69  12.828  -2.158   7.809
  509    HB2  HIS  69           HB2      HIS  69  12.846  -0.677   9.784
  510    HB3  HIS  69           HB1      HIS  69  11.115  -0.406   9.625
  511    HD1  HIS  69           HD1      HIS  69  12.641  -1.851  12.172
  512    HD2  HIS  69           HD2      HIS  69  10.362  -3.609   9.186
  513    HE1  HIS  69           HE1      HIS  69  11.864  -4.092  13.065
  514    HE2  HIS  69           HE2      HIS  69  10.309  -4.966  11.358
  515    H    LEU  70           HN       LEU  70  11.657  -3.874   7.167
  516    HA   LEU  70           HA       LEU  70   8.758  -3.488   6.971
  517    HB2  LEU  70           HB2      LEU  70   8.563  -4.632   4.967
  518    HB3  LEU  70           HB1      LEU  70   9.982  -3.635   4.722
  519    HG   LEU  70           HG       LEU  70  10.245  -6.446   5.677
  520   HD11  LEU  70          HD11      LEU  70   8.902  -6.595   3.666
  521   HD12  LEU  70          HD12      LEU  70  10.551  -7.130   3.329
  522   HD13  LEU  70          HD13      LEU  70  10.020  -5.528   2.813
  523   HD21  LEU  70          HD21      LEU  70  12.018  -4.533   4.166
  524   HD22  LEU  70          HD22      LEU  70  12.407  -6.229   4.436
  525   HD23  LEU  70          HD23      LEU  70  12.243  -5.137   5.806
  526    H    GLN  71           HN       GLN  71   7.535  -4.995   7.762
  527    HA   GLN  71           HA       GLN  71   8.527  -7.717   8.149
  528    HB2  GLN  71           HB2      GLN  71   6.591  -6.833  10.197
  529    HB3  GLN  71           HB1      GLN  71   7.910  -7.976  10.332
  530    HG2  GLN  71           HG2      GLN  71   8.654  -6.377  11.724
  531    HG3  GLN  71           HG1      GLN  71   9.396  -5.849  10.215
  532   HE21  GLN  71          HE21      GLN  71   6.745  -4.960   9.215
  533   HE22  GLN  71          HE22      GLN  71   6.498  -3.442   9.989
  534    H    THR  72           HN       THR  72   7.184  -9.022   7.207
  535    HA   THR  72           HA       THR  72   4.796  -7.742   6.093
  536    HB   THR  72           HB       THR  72   6.578  -9.844   4.890
  537    HG1  THR  72           HG1      THR  72   6.349  -7.147   4.047
  538   HG21  THR  72          HG21      THR  72   4.311  -8.249   3.729
  539   HG22  THR  72          HG22      THR  72   4.308  -9.982   4.072
  540   HG23  THR  72          HG23      THR  72   5.368  -9.331   2.819
  541    H    SER  73           HN       SER  73   2.948  -8.593   6.707
  542    HA   SER  73           HA       SER  73   2.835 -11.416   7.482
  543    HB2  SER  73           HB2      SER  73   0.495  -9.565   7.733
  544    HB3  SER  73           HB1      SER  73   1.004 -10.874   8.797
  545    HG   SER  73           HG       SER  73   1.302  -8.769   9.695
  546    H    LEU  74           HN       LEU  74   1.450 -12.803   6.429
  547    HA   LEU  74           HA       LEU  74   0.479 -12.226   3.865
  548    HB2  LEU  74           HB2      LEU  74   0.472 -14.437   5.793
  549    HB3  LEU  74           HB1      LEU  74  -0.865 -14.441   4.651
  550    HG   LEU  74           HG       LEU  74   0.577 -14.616   2.818
  551   HD11  LEU  74          HD11      LEU  74   2.188 -12.955   3.445
  552   HD12  LEU  74          HD12      LEU  74   3.005 -14.447   2.971
  553   HD13  LEU  74          HD13      LEU  74   2.842 -14.032   4.680
  554   HD21  LEU  74          HD21      LEU  74   0.304 -16.712   4.018
  555   HD22  LEU  74          HD22      LEU  74   1.705 -16.331   5.015
  556   HD23  LEU  74          HD23      LEU  74   1.906 -16.623   3.288
  557    H    GLU  75           HN       GLU  75  -1.808 -12.433   3.229
  558    HA   GLU  75           HA       GLU  75  -3.566 -10.718   4.510
  559    HB2  GLU  75           HB2      GLU  75  -5.333 -11.785   3.137
  560    HB3  GLU  75           HB1      GLU  75  -3.895 -11.398   2.206
  561    HG2  GLU  75           HG2      GLU  75  -3.186 -13.747   2.368
  562    HG3  GLU  75           HG1      GLU  75  -4.675 -14.118   3.233
  563    H    ASN  76           HN       ASN  76  -2.631 -13.876   5.313
  564    HA   ASN  76           HA       ASN  76  -5.017 -14.468   6.859
  565    HB2  ASN  76           HB2      ASN  76  -4.029 -16.692   7.159
  566    HB3  ASN  76           HB1      ASN  76  -4.055 -16.236   5.461
  567   HD21  ASN  76          HD21      ASN  76  -2.436 -17.457   4.717
  568   HD22  ASN  76          HD22      ASN  76  -0.792 -17.317   5.244
  569    H    GLY  77           HN       GLY  77  -2.162 -12.829   7.322
  570    HA2  GLY  77           HA2      GLY  77  -1.870 -11.639   9.375
  571    HA3  GLY  77           HA1      GLY  77  -2.532 -13.020  10.237
  572    H    THR  78           HN       THR  78  -0.582 -14.503   8.184
  573    HA   THR  78           HA       THR  78   1.415 -14.915  10.206
  574    HB   THR  78           HB       THR  78   1.247 -16.042   7.404
  575    HG1  THR  78           HG1      THR  78  -0.511 -16.804   8.481
  576   HG21  THR  78          HG21      THR  78   2.720 -17.808   8.285
  577   HG22  THR  78          HG22      THR  78   2.837 -16.936   9.814
  578   HG23  THR  78          HG23      THR  78   3.490 -16.222   8.338
  579    H    ARG  79           HN       ARG  79   2.944 -13.414  10.461
  580    HA   ARG  79           HA       ARG  79   4.122 -11.963   8.318
  581    HB2  ARG  79           HB2      ARG  79   4.950 -12.389  11.177
  582    HB3  ARG  79           HB1      ARG  79   5.878 -11.410  10.045
  583    HG2  ARG  79           HG2      ARG  79   3.517 -10.305   9.622
  584    HG3  ARG  79           HG1      ARG  79   3.223 -10.894  11.260
  585    HD2  ARG  79           HD2      ARG  79   5.002  -9.620  12.138
  586    HD3  ARG  79           HD1      ARG  79   5.662  -9.304  10.534
  587    HE   ARG  79           HE       ARG  79   3.158  -8.188  10.500
  588   HH11  ARG  79          HH11      ARG  79   5.980  -7.838  12.511
  589   HH12  ARG  79          HH12      ARG  79   5.740  -6.151  12.817
  590   HH21  ARG  79          HH21      ARG  79   2.817  -5.936  10.887
  591   HH22  ARG  79          HH22      ARG  79   3.937  -5.058  11.879
  592    H    VAL  80           HN       VAL  80   5.611 -12.532   6.965
  593    HA   VAL  80           HA       VAL  80   6.744 -15.225   7.283
  594    HB   VAL  80           HB       VAL  80   6.837 -15.253   4.831
  595   HG11  VAL  80          HG11      VAL  80   4.897 -16.162   5.971
  596   HG12  VAL  80          HG12      VAL  80   4.426 -15.416   4.443
  597   HG13  VAL  80          HG13      VAL  80   4.140 -14.569   5.964
  598   HG21  VAL  80          HG21      VAL  80   5.423 -12.597   5.002
  599   HG22  VAL  80          HG22      VAL  80   5.732 -13.507   3.522
  600   HG23  VAL  80          HG23      VAL  80   7.080 -12.842   4.448
  601    H    GLN  81           HN       GLN  81   7.569 -11.992   7.278
  602    HA   GLN  81           HA       GLN  81  10.370 -12.571   7.210
  603    HB2  GLN  81           HB2      GLN  81  10.920 -11.050   5.350
  604    HB3  GLN  81           HB1      GLN  81   9.943 -12.406   4.805
  605    HG2  GLN  81           HG2      GLN  81   7.949 -10.960   4.868
  606    HG3  GLN  81           HG1      GLN  81   8.983  -9.597   5.300
  607   HE21  GLN  81          HE21      GLN  81   7.285  -9.985   3.013
  608   HE22  GLN  81          HE22      GLN  81   8.297  -9.817   1.620
  609    H    GLU  82           HN       GLU  82  11.579 -10.925   8.161
  610    HA   GLU  82           HA       GLU  82  10.259  -8.438   8.851
  611    HB2  GLU  82           HB2      GLU  82   9.586  -9.922  10.674
  612    HB3  GLU  82           HB1      GLU  82  11.269 -10.349  10.962
  613    HG2  GLU  82           HG2      GLU  82  11.754  -8.030  11.566
  614    HG3  GLU  82           HG1      GLU  82  10.066  -7.610  11.271
  615    H    GLU  83           HN       GLU  83  11.722  -7.101   8.069
  616    HA   GLU  83           HA       GLU  83  14.551  -7.574   8.711
  617    HB2  GLU  83           HB2      GLU  83  13.675  -6.079   6.250
  618    HB3  GLU  83           HB1      GLU  83  15.193  -6.918   6.545
  619    HG2  GLU  83           HG2      GLU  83  12.518  -8.209   6.045
  620    HG3  GLU  83           HG1      GLU  83  13.815  -8.034   4.866
  621    HA   PRO  84           HA       PRO  84  13.858  -3.694  10.775
  622    HB2  PRO  84           HB2      PRO  84  16.751  -3.756  11.272
  623    HB3  PRO  84           HB1      PRO  84  15.417  -3.784  12.430
  624    HG2  PRO  84           HG2      PRO  84  16.951  -5.947  11.966
  625    HG3  PRO  84           HG1      PRO  84  15.227  -6.076  12.361
  626    HD2  PRO  84           HD2      PRO  84  16.582  -6.295   9.700
  627    HD3  PRO  84           HD1      PRO  84  15.238  -7.249  10.363
  628    H    GLU  85           HN       GLU  85  16.048  -4.304   8.191
  629    HA   GLU  85           HA       GLU  85  15.736  -1.635   7.235
  630    HB2  GLU  85           HB2      GLU  85  17.575  -1.273   8.829
  631    HB3  GLU  85           HB1      GLU  85  18.518  -2.521   8.021
  632    HG2  GLU  85           HG2      GLU  85  18.885  -1.223   6.149
  633    HG3  GLU  85           HG1      GLU  85  17.500  -0.180   6.472
  634    H    LEU  86           HN       LEU  86  15.350  -1.824   5.319
  635    HA   LEU  86           HA       LEU  86  16.937  -3.594   3.621
  636    HB2  LEU  86           HB2      LEU  86  14.656  -4.457   3.871
  637    HB3  LEU  86           HB1      LEU  86  14.000  -2.900   3.430
  638    HG   LEU  86           HG       LEU  86  14.993  -3.133   1.208
  639   HD11  LEU  86          HD11      LEU  86  15.677  -5.939   2.080
  640   HD12  LEU  86          HD12      LEU  86  16.843  -4.643   1.816
  641   HD13  LEU  86          HD13      LEU  86  15.896  -5.264   0.465
  642   HD21  LEU  86          HD21      LEU  86  13.175  -5.368   2.090
  643   HD22  LEU  86          HD22      LEU  86  13.428  -4.881   0.417
  644   HD23  LEU  86          HD23      LEU  86  12.688  -3.760   1.559
  645    H    VAL  87           HN       VAL  87  18.332  -2.042   2.838
  646    HA   VAL  87           HA       VAL  87  17.231   0.488   1.879
  647    HB   VAL  87           HB       VAL  87  19.431   0.365   3.110
  648   HG11  VAL  87          HG11      VAL  87  20.410  -0.821   0.525
  649   HG12  VAL  87          HG12      VAL  87  20.357  -1.631   2.092
  650   HG13  VAL  87          HG13      VAL  87  21.430  -0.252   1.844
  651   HG21  VAL  87          HG21      VAL  87  20.556   2.001   1.676
  652   HG22  VAL  87          HG22      VAL  87  18.827   2.324   1.824
  653   HG23  VAL  87          HG23      VAL  87  19.466   1.584   0.353
  654    H    PHE  88           HN       PHE  88  16.941   0.971  -0.271
  655    HA   PHE  88           HA       PHE  88  17.889  -0.849  -2.325
  656    HB2  PHE  88           HB2      PHE  88  15.706  -1.477  -3.137
  657    HB3  PHE  88           HB1      PHE  88  15.850  -1.946  -1.450
  658    HD1  PHE  88           HD2      PHE  88  14.656  -0.676   0.297
  659    HD2  PHE  88           HD1      PHE  88  14.087   0.095  -3.850
  660    HE1  PHE  88           HE2      PHE  88  12.557   0.489   0.808
  661    HE2  PHE  88           HE1      PHE  88  11.980   1.260  -3.351
  662    HZ   PHE  88           HZ       PHE  88  11.197   1.443  -1.029
  663    H    THR  89           HN       THR  89  17.248  -0.171  -4.478
  664    HA   THR  89           HA       THR  89  17.443   2.710  -4.672
  665    HB   THR  89           HB       THR  89  17.259   0.768  -6.975
  666    HG1  THR  89           HG1      THR  89  18.932   0.222  -5.337
  667   HG21  THR  89          HG21      THR  89  18.618   2.457  -8.120
  668   HG22  THR  89          HG22      THR  89  18.649   3.438  -6.657
  669   HG23  THR  89          HG23      THR  89  17.129   3.169  -7.503
  670    H    LEU  90           HN       LEU  90  15.573   3.789  -4.439
  671    HA   LEU  90           HA       LEU  90  12.989   2.852  -4.989
  672    HB2  LEU  90           HB2      LEU  90  13.790   4.966  -3.710
  673    HB3  LEU  90           HB1      LEU  90  13.764   5.735  -5.263
  674    HG   LEU  90           HG       LEU  90  11.388   5.312  -5.498
  675   HD11  LEU  90          HD11      LEU  90  11.304   3.175  -4.307
  676   HD12  LEU  90          HD12      LEU  90  10.107   4.306  -3.679
  677   HD13  LEU  90          HD13      LEU  90  11.596   4.013  -2.783
  678   HD21  LEU  90          HD21      LEU  90  10.582   6.800  -3.778
  679   HD22  LEU  90          HD22      LEU  90  12.178   7.338  -4.294
  680   HD23  LEU  90          HD23      LEU  90  11.992   6.466  -2.773
  681    H    GLY  91           HN       GLY  91  11.872   2.603  -6.866
  682    HA2  GLY  91           HA2      GLY  91  11.118   3.268  -8.985
  683    HA3  GLY  91           HA1      GLY  91  12.498   4.346  -9.120
  684    H    ASP  92           HN       ASP  92  13.522   1.370  -8.045
  685    HA   ASP  92           HA       ASP  92  14.272   0.607 -10.794
  686    HB2  ASP  92           HB2      ASP  92  16.165   1.536  -9.451
  687    HB3  ASP  92           HB1      ASP  92  15.934   0.232  -8.293
  688    H    CYS  93           HN       CYS  93  12.190  -0.150  -8.616
  689    HA   CYS  93           HA       CYS  93  11.272  -1.973  -7.620
  690    HB2  CYS  93           HB2      CYS  93  10.822  -3.875  -9.167
  691    HB3  CYS  93           HB1      CYS  93  10.395  -2.301  -9.831
  692    HG   CYS  93           HG       CYS  93  13.462  -3.034 -10.733
  693    H    ASP  94           HN       ASP  94  13.823  -1.613  -6.821
  694    HA   ASP  94           HA       ASP  94  15.385  -3.989  -6.924
  695    HB2  ASP  94           HB2      ASP  94  16.234  -1.661  -6.417
  696    HB3  ASP  94           HB1      ASP  94  15.446  -1.777  -4.851
  697    H    VAL  95           HN       VAL  95  12.599  -3.057  -5.468
  698    HA   VAL  95           HA       VAL  95  12.591  -5.254  -3.506
  699    HB   VAL  95           HB       VAL  95  10.791  -3.830  -2.373
  700   HG11  VAL  95          HG11      VAL  95  13.030  -4.121  -1.445
  701   HG12  VAL  95          HG12      VAL  95  12.434  -2.482  -1.170
  702   HG13  VAL  95          HG13      VAL  95  13.614  -2.790  -2.442
  703   HG21  VAL  95          HG21      VAL  95  11.029  -1.373  -2.795
  704   HG22  VAL  95          HG22      VAL  95  10.314  -2.271  -4.134
  705   HG23  VAL  95          HG23      VAL  95  12.004  -1.763  -4.214
  706    H    ILE  96           HN       ILE  96   9.777  -4.885  -3.007
  707    HA   ILE  96           HA       ILE  96   8.621  -5.995  -5.394
  708    HB   ILE  96           HB       ILE  96   6.548  -6.134  -4.094
  709   HG12  ILE  96          HG12      ILE  96   8.119  -4.820  -1.860
  710   HG13  ILE  96          HG11      ILE  96   6.846  -4.040  -2.794
  711   HG21  ILE  96          HG21      ILE  96   8.225  -7.912  -3.896
  712   HG22  ILE  96          HG22      ILE  96   7.309  -7.716  -2.403
  713   HG23  ILE  96          HG23      ILE  96   8.946  -7.076  -2.522
  714   HD11  ILE  96          HD11      ILE  96   6.047  -4.784  -0.623
  715   HD12  ILE  96          HD12      ILE  96   6.504  -6.441  -1.014
  716   HD13  ILE  96          HD13      ILE  96   5.228  -5.637  -1.928
  717    H    GLN  97           HN       GLN  97   7.100  -4.920  -6.650
  718    HA   GLN  97           HA       GLN  97   7.698  -2.229  -7.092
  719    HB2  GLN  97           HB2      GLN  97   6.720  -3.939  -8.738
  720    HB3  GLN  97           HB1      GLN  97   5.153  -3.468  -8.087
  721    HG2  GLN  97           HG2      GLN  97   5.501  -2.157 -10.021
  722    HG3  GLN  97           HG1      GLN  97   5.756  -1.091  -8.641
  723   HE21  GLN  97          HE21      GLN  97   7.962  -0.556  -8.064
  724   HE22  GLN  97          HE22      GLN  97   9.194  -0.606  -9.273
  725    H    ALA  98           HN       ALA  98   5.068  -3.739  -5.333
  726    HA   ALA  98           HA       ALA  98   3.415  -1.570  -4.815
  727    HB1  ALA  98           HB1      ALA  98   4.229  -3.769  -2.917
  728    HB2  ALA  98           HB2      ALA  98   2.922  -3.857  -4.096
  729    HB3  ALA  98           HB3      ALA  98   2.815  -2.731  -2.749
  730    H    LEU  99           HN       LEU  99   6.301  -2.617  -3.094
  731    HA   LEU  99           HA       LEU  99   6.225  -0.567  -1.130
  732    HB2  LEU  99           HB2      LEU  99   7.462  -2.648  -0.757
  733    HB3  LEU  99           HB1      LEU  99   8.570  -2.221  -2.056
  734    HG   LEU  99           HG       LEU  99   9.318  -0.253  -0.776
  735   HD11  LEU  99          HD11      LEU  99   8.651   0.012   1.556
  736   HD12  LEU  99          HD12      LEU  99   7.512  -1.324   1.388
  737   HD13  LEU  99          HD13      LEU  99   7.269   0.166   0.474
  738   HD21  LEU  99          HD21      LEU  99  10.530  -1.423   0.971
  739   HD22  LEU  99          HD22      LEU  99  10.532  -2.344  -0.533
  740   HD23  LEU  99          HD23      LEU  99   9.467  -2.821   0.792
  741    H    ASP 100           HN       ASP 100   7.844  -0.960  -4.187
  742    HA   ASP 100           HA       ASP 100   9.610   1.213  -4.055
  743    HB2  ASP 100           HB2      ASP 100   9.808  -0.633  -5.654
  744    HB3  ASP 100           HB1      ASP 100   8.330  -0.128  -6.448
  745    H    LEU 101           HN       LEU 101   6.248   0.933  -4.832
  746    HA   LEU 101           HA       LEU 101   6.045   3.669  -5.742
  747    HB2  LEU 101           HB2      LEU 101   3.935   1.567  -5.256
  748    HB3  LEU 101           HB1      LEU 101   3.673   3.109  -6.024
  749    HG   LEU 101           HG       LEU 101   5.401   0.892  -7.109
  750   HD11  LEU 101          HD11      LEU 101   2.722   1.922  -8.040
  751   HD12  LEU 101          HD12      LEU 101   3.007   0.402  -7.192
  752   HD13  LEU 101          HD13      LEU 101   3.677   0.650  -8.804
  753   HD21  LEU 101          HD21      LEU 101   5.537   2.274  -9.125
  754   HD22  LEU 101          HD22      LEU 101   6.262   3.075  -7.734
  755   HD23  LEU 101          HD23      LEU 101   4.664   3.565  -8.297
  756    H    SER 102           HN       SER 102   5.378   1.791  -2.841
  757    HA   SER 102           HA       SER 102   3.579   3.680  -1.710
  758    HB2  SER 102           HB2      SER 102   3.868   2.343   0.376
  759    HB3  SER 102           HB1      SER 102   3.439   1.370  -1.028
  760    HG   SER 102           HG       SER 102   6.132   1.619  -0.743
  761    H    VAL 103           HN       VAL 103   7.015   3.319  -1.767
  762    HA   VAL 103           HA       VAL 103   7.651   4.780   0.556
  763    HB   VAL 103           HB       VAL 103   9.228   4.182  -1.910
  764   HG11  VAL 103          HG11      VAL 103  10.090   6.256  -0.919
  765   HG12  VAL 103          HG12      VAL 103  11.225   4.928  -0.678
  766   HG13  VAL 103          HG13      VAL 103  10.204   5.467   0.655
  767   HG21  VAL 103          HG21      VAL 103   8.975   2.199  -0.771
  768   HG22  VAL 103          HG22      VAL 103   8.928   2.985   0.804
  769   HG23  VAL 103          HG23      VAL 103  10.460   2.818  -0.046
  770    HA   PRO 104           HA       PRO 104   8.166   8.673  -2.321
  771    HB2  PRO 104           HB2      PRO 104   6.771   8.486  -4.686
  772    HB3  PRO 104           HB1      PRO 104   8.511   8.220  -4.525
  773    HG2  PRO 104           HG2      PRO 104   6.296   6.203  -4.593
  774    HG3  PRO 104           HG1      PRO 104   7.862   6.167  -5.415
  775    HD2  PRO 104           HD2      PRO 104   7.470   4.749  -3.215
  776    HD3  PRO 104           HD1      PRO 104   9.007   5.591  -3.487
  777    H    LEU 105           HN       LEU 105   5.301   6.636  -2.290
  778    HA   LEU 105           HA       LEU 105   3.460   8.826  -2.035
  779    HB2  LEU 105           HB2      LEU 105   3.309   5.863  -1.686
  780    HB3  LEU 105           HB1      LEU 105   1.982   6.874  -1.125
  781    HG   LEU 105           HG       LEU 105   2.945   6.458  -3.943
  782   HD11  LEU 105          HD11      LEU 105   0.577   5.897  -4.302
  783   HD12  LEU 105          HD12      LEU 105   0.276   6.146  -2.582
  784   HD13  LEU 105          HD13      LEU 105   1.347   4.846  -3.112
  785   HD21  LEU 105          HD21      LEU 105   2.639   8.870  -3.596
  786   HD22  LEU 105          HD22      LEU 105   1.012   8.566  -2.987
  787   HD23  LEU 105          HD23      LEU 105   1.407   8.199  -4.666
  788    H    MET 106           HN       MET 106   5.635   7.313   0.046
  789    HA   MET 106           HA       MET 106   4.227   8.251   2.441
  790    HB2  MET 106           HB2      MET 106   4.887   6.314   3.323
  791    HB3  MET 106           HB1      MET 106   5.627   5.880   1.795
  792    HG2  MET 106           HG2      MET 106   7.669   7.178   2.643
  793    HG3  MET 106           HG1      MET 106   6.873   7.090   4.225
  794    HE1  MET 106           HE1      MET 106   6.246   4.813   5.418
  795    HE2  MET 106           HE2      MET 106   6.622   3.214   4.766
  796    HE3  MET 106           HE3      MET 106   5.414   4.225   3.978
  797    H    ASP 107           HN       ASP 107   5.414   9.435   4.067
  798    HA   ASP 107           HA       ASP 107   7.507  11.152   2.904
  799    HB2  ASP 107           HB2      ASP 107   5.398  11.518   4.889
  800    HB3  ASP 107           HB1      ASP 107   6.960  12.091   5.463
  801    H    VAL 108           HN       VAL 108   9.441  11.618   4.100
  802    HA   VAL 108           HA       VAL 108  10.704   9.370   5.193
  803    HB   VAL 108           HB       VAL 108  11.410  12.255   4.981
  804   HG11  VAL 108          HG11      VAL 108  13.482  11.911   6.289
  805   HG12  VAL 108          HG12      VAL 108  12.852  10.354   6.830
  806   HG13  VAL 108          HG13      VAL 108  12.025  11.848   7.282
  807   HG21  VAL 108          HG21      VAL 108  13.459  11.258   3.994
  808   HG22  VAL 108          HG22      VAL 108  11.976  10.763   3.183
  809   HG23  VAL 108          HG23      VAL 108  12.780   9.659   4.296
  810    H    GLY 109           HN       GLY 109  10.540   8.454   7.073
  811    HA2  GLY 109           HA2      GLY 109  10.823   8.513   9.438
  812    HA3  GLY 109           HA1      GLY 109  10.122  10.123   9.455
  813    H    GLU 110           HN       GLU 110   8.319   8.168   7.419
  814    HA   GLU 110           HA       GLU 110   6.350   7.863   9.550
  815    HB2  GLU 110           HB2      GLU 110   4.655   7.839   7.970
  816    HB3  GLU 110           HB1      GLU 110   5.781   9.043   7.357
  817    HG2  GLU 110           HG2      GLU 110   6.511   7.599   5.637
  818    HG3  GLU 110           HG1      GLU 110   5.740   6.201   6.385
  819    H    THR 111           HN       THR 111   4.910   5.961   9.370
  820    HA   THR 111           HA       THR 111   6.256   3.592   8.349
  821    HB   THR 111           HB       THR 111   4.862   3.690  11.030
  822    HG1  THR 111           HG1      THR 111   7.253   4.554  10.461
  823   HG21  THR 111          HG21      THR 111   4.742   1.516   9.879
  824   HG22  THR 111          HG22      THR 111   5.755   1.441  11.321
  825   HG23  THR 111          HG23      THR 111   6.501   1.516   9.724
  826    H    ALA 112           HN       ALA 112   4.987   2.677   6.921
  827    HA   ALA 112           HA       ALA 112   2.089   3.124   7.189
  828    HB1  ALA 112           HB1      ALA 112   3.084   4.383   5.322
  829    HB2  ALA 112           HB2      ALA 112   1.946   3.154   4.770
  830    HB3  ALA 112           HB3      ALA 112   3.681   2.870   4.637
  831    H    MET 113           HN       MET 113   0.773   1.425   6.956
  832    HA   MET 113           HA       MET 113   2.003  -1.205   6.547
  833    HB2  MET 113           HB2      MET 113   0.642  -1.323   8.459
  834    HB3  MET 113           HB1      MET 113  -0.581  -0.265   7.769
  835    HG2  MET 113           HG2      MET 113  -1.274  -2.038   6.250
  836    HG3  MET 113           HG1      MET 113  -0.032  -3.099   6.910
  837    HE1  MET 113           HE1      MET 113  -0.301  -4.539   8.987
  838    HE2  MET 113           HE2      MET 113  -1.285  -4.055  10.373
  839    HE3  MET 113           HE3      MET 113   0.039  -3.027   9.826
  840    H    VAL 114           HN       VAL 114   1.918  -1.969   4.522
  841    HA   VAL 114           HA       VAL 114  -0.135  -0.812   2.740
  842    HB   VAL 114           HB       VAL 114   2.430  -2.076   1.820
  843   HG11  VAL 114          HG11      VAL 114   0.695  -0.002   0.511
  844   HG12  VAL 114          HG12      VAL 114   0.647  -1.732   0.167
  845   HG13  VAL 114          HG13      VAL 114   2.101  -0.802  -0.191
  846   HG21  VAL 114          HG21      VAL 114   3.054  -0.320   3.362
  847   HG22  VAL 114          HG22      VAL 114   2.036   0.821   2.484
  848   HG23  VAL 114          HG23      VAL 114   3.456   0.123   1.704
  849    H    THR 115           HN       THR 115  -1.515  -2.185   1.814
  850    HA   THR 115           HA       THR 115  -0.756  -5.013   1.890
  851    HB   THR 115           HB       THR 115  -3.571  -3.913   1.781
  852    HG1  THR 115           HG1      THR 115  -1.868  -4.391   3.824
  853   HG21  THR 115          HG21      THR 115  -2.506  -6.717   2.056
  854   HG22  THR 115          HG22      THR 115  -3.282  -6.049   0.614
  855   HG23  THR 115          HG23      THR 115  -4.204  -6.252   2.109
  856    H    ALA 116           HN       ALA 116  -0.094  -5.677   0.138
  857    HA   ALA 116           HA       ALA 116  -1.174  -4.661  -2.413
  858    HB1  ALA 116           HB1      ALA 116   1.664  -5.432  -1.778
  859    HB2  ALA 116           HB2      ALA 116   1.060  -3.792  -2.020
  860    HB3  ALA 116           HB3      ALA 116   1.051  -4.938  -3.357
  861    H    ASP 117           HN       ASP 117  -1.876  -6.196  -3.781
  862    HA   ASP 117           HA       ASP 117  -2.074  -8.884  -3.180
  863    HB2  ASP 117           HB2      ASP 117  -3.132  -7.631  -5.164
  864    HB3  ASP 117           HB1      ASP 117  -1.610  -7.903  -5.973
  865    H    SER 118           HN       SER 118  -0.808 -10.712  -3.693
  866    HA   SER 118           HA       SER 118   1.922 -10.435  -3.305
  867    HB2  SER 118           HB2      SER 118   0.340 -12.532  -3.147
  868    HB3  SER 118           HB1      SER 118   0.859 -12.795  -4.811
  869    HG   SER 118           HG       SER 118   2.145 -13.829  -3.105
  870    H    LYS 119           HN       LYS 119   0.058 -10.378  -6.263
  871    HA   LYS 119           HA       LYS 119   2.086 -10.700  -8.135
  872    HB2  LYS 119           HB2      LYS 119   0.672  -9.200  -9.574
  873    HB3  LYS 119           HB1      LYS 119  -0.163 -10.594  -8.891
  874    HG2  LYS 119           HG2      LYS 119  -1.066  -9.111  -7.153
  875    HG3  LYS 119           HG1      LYS 119  -0.266  -7.750  -7.944
  876    HD2  LYS 119           HD2      LYS 119  -2.590  -7.838  -8.626
  877    HD3  LYS 119           HD1      LYS 119  -1.557  -8.227  -9.998
  878    HE2  LYS 119           HE2      LYS 119  -1.973 -10.592  -9.686
  879    HE3  LYS 119           HE1      LYS 119  -2.902 -10.262  -8.230
  880    HZ1  LYS 119           HZ1      LYS 119  -3.760  -9.013 -10.743
  881    HZ2  LYS 119           HZ2      LYS 119  -4.682  -9.510  -9.408
  882    HZ3  LYS 119           HZ3      LYS 119  -4.083 -10.662 -10.501
  883    H    TYR 120           HN       TYR 120   1.368  -7.935  -6.067
  884    HA   TYR 120           HA       TYR 120   3.481  -6.382  -7.381
  885    HB2  TYR 120           HB2      TYR 120   1.605  -5.588  -5.134
  886    HB3  TYR 120           HB1      TYR 120   2.767  -4.531  -5.928
  887    HD1  TYR 120           HD2      TYR 120  -0.403  -6.277  -6.224
  888    HD2  TYR 120           HD1      TYR 120   2.362  -3.671  -8.115
  889    HE1  TYR 120           HE2      TYR 120  -2.122  -5.653  -7.878
  890    HE2  TYR 120           HE1      TYR 120   0.673  -3.035  -9.778
  891    HH   TYR 120           HH       TYR 120  -1.558  -4.285 -10.718
  892    H    CYS 121           HN       CYS 121   3.320  -8.747  -5.274
  893    HA   CYS 121           HA       CYS 121   5.511  -7.722  -3.608
  894    HB2  CYS 121           HB2      CYS 121   3.367  -9.687  -2.799
  895    HB3  CYS 121           HB1      CYS 121   4.715  -9.170  -1.790
  896    HG   CYS 121           HG       CYS 121   1.775  -7.739  -2.247
  897    H    TYR 122           HN       TYR 122   4.322 -11.065  -3.574
  898    HA   TYR 122           HA       TYR 122   6.570 -11.860  -5.276
  899    HB2  TYR 122           HB2      TYR 122   6.113 -13.293  -2.662
  900    HB3  TYR 122           HB1      TYR 122   7.491 -13.380  -3.737
  901    HD1  TYR 122           HD2      TYR 122   9.187 -11.583  -3.748
  902    HD2  TYR 122           HD1      TYR 122   5.945 -11.571  -0.991
  903    HE1  TYR 122           HE2      TYR 122  10.376  -9.940  -2.357
  904    HE2  TYR 122           HE1      TYR 122   7.122  -9.940   0.394
  905    HH   TYR 122           HH       TYR 122   9.839  -8.226  -0.673
  906    H    GLY 123           HN       GLY 123   3.771 -11.935  -5.929
  907    HA2  GLY 123           HA2      GLY 123   2.435 -14.295  -5.437
  908    HA3  GLY 123           HA1      GLY 123   2.320 -13.409  -6.949
  909    HA   PRO 124           HA       PRO 124   4.553 -16.850  -8.737
  910    HB2  PRO 124           HB2      PRO 124   5.295 -15.807 -11.083
  911    HB3  PRO 124           HB1      PRO 124   3.591 -16.092 -10.711
  912    HG2  PRO 124           HG2      PRO 124   5.126 -13.538 -10.705
  913    HG3  PRO 124           HG1      PRO 124   3.449 -13.841 -11.187
  914    HD2  PRO 124           HD2      PRO 124   4.282 -12.804  -8.726
  915    HD3  PRO 124           HD1      PRO 124   2.683 -13.488  -9.078
  916    H    GLN 125           HN       GLN 125   5.914 -14.451  -7.223
  917    HA   GLN 125           HA       GLN 125   8.598 -14.616  -8.404
  918    HB2  GLN 125           HB2      GLN 125   7.519 -12.637  -6.385
  919    HB3  GLN 125           HB1      GLN 125   9.047 -12.530  -7.255
  920    HG2  GLN 125           HG2      GLN 125   7.922 -12.166  -9.319
  921    HG3  GLN 125           HG1      GLN 125   6.360 -12.526  -8.600
  922   HE21  GLN 125          HE21      GLN 125   5.343 -11.003  -7.343
  923   HE22  GLN 125          HE22      GLN 125   5.847  -9.356  -7.268
  924    H    GLY 126           HN       GLY 126   6.840 -14.719  -5.353
  925    HA2  GLY 126           HA2      GLY 126   7.234 -15.959  -3.466
  926    HA3  GLY 126           HA1      GLY 126   8.628 -16.672  -4.259
  927    H    SER 127           HN       SER 127   8.141 -15.519  -1.576
  928    HA   SER 127           HA       SER 127   9.847 -13.225  -1.524
  929    HB2  SER 127           HB2      SER 127   7.963 -12.964  -0.134
  930    HB3  SER 127           HB1      SER 127   8.112 -14.585   0.514
  931    HG   SER 127           HG       SER 127   9.145 -12.269   1.441
  932    H    ARG 128           HN       ARG 128  11.516 -13.074   0.265
  933    HA   ARG 128           HA       ARG 128  13.601 -14.765  -0.450
  934    HB2  ARG 128           HB2      ARG 128  14.798 -13.757   1.553
  935    HB3  ARG 128           HB1      ARG 128  14.196 -12.633   0.345
  936    HG2  ARG 128           HG2      ARG 128  12.349 -12.025   1.750
  937    HG3  ARG 128           HG1      ARG 128  12.779 -13.274   2.921
  938    HD2  ARG 128           HD2      ARG 128  13.491 -10.969   3.568
  939    HD3  ARG 128           HD1      ARG 128  14.803 -12.141   3.487
  940    HE   ARG 128           HE       ARG 128  14.611 -10.860   1.013
  941   HH11  ARG 128          HH11      ARG 128  15.466 -10.090   4.329
  942   HH12  ARG 128          HH12      ARG 128  16.620  -8.873   3.866
  943   HH21  ARG 128          HH21      ARG 128  16.136  -9.232   0.430
  944   HH22  ARG 128          HH22      ARG 128  17.007  -8.406   1.683
  945    H    SER 129           HN       SER 129  11.757 -14.780   2.622
  946    HA   SER 129           HA       SER 129  13.061 -17.235   3.376
  947    HB2  SER 129           HB2      SER 129  10.740 -15.801   4.695
  948    HB3  SER 129           HB1      SER 129  11.613 -17.179   5.369
  949    HG   SER 129           HG       SER 129  13.457 -15.915   5.519
  950    HA   PRO 130           HA       PRO 130   9.122 -19.226   1.861
  951    HB2  PRO 130           HB2      PRO 130   6.726 -17.910   2.179
  952    HB3  PRO 130           HB1      PRO 130   7.507 -18.840   3.451
  953    HG2  PRO 130           HG2      PRO 130   7.052 -16.036   3.415
  954    HG3  PRO 130           HG1      PRO 130   7.993 -16.947   4.611
  955    HD2  PRO 130           HD2      PRO 130   8.923 -15.487   2.170
  956    HD3  PRO 130           HD1      PRO 130   9.706 -15.640   3.752
  957    H    TYR 131           HN       TYR 131   9.142 -19.340  -0.407
  958    HA   TYR 131           HA       TYR 131   8.335 -17.392  -2.187
  959    HB2  TYR 131           HB2      TYR 131   9.172 -19.526  -2.980
  960    HB3  TYR 131           HB1      TYR 131   7.803 -20.374  -2.270
  961    HD1  TYR 131           HD1      TYR 131   5.552 -20.158  -3.306
  962    HD2  TYR 131           HD2      TYR 131   9.011 -18.459  -5.110
  963    HE1  TYR 131           HE1      TYR 131   4.331 -19.929  -5.431
  964    HE2  TYR 131           HE2      TYR 131   7.802 -18.224  -7.231
  965    HH   TYR 131           HH       TYR 131   4.398 -18.687  -7.486
  966    H    ILE 132           HN       ILE 132   6.715 -16.108  -1.550
  967    HA   ILE 132           HA       ILE 132   4.421 -16.901  -0.156
  968    HB   ILE 132           HB       ILE 132   4.794 -14.461  -1.898
  969   HG12  ILE 132          HG12      ILE 132   6.551 -14.434  -0.297
  970   HG13  ILE 132          HG11      ILE 132   5.326 -13.292   0.248
  971   HG21  ILE 132          HG21      ILE 132   3.081 -13.461  -0.443
  972   HG22  ILE 132          HG22      ILE 132   2.904 -15.016   0.375
  973   HG23  ILE 132          HG23      ILE 132   2.476 -14.862  -1.331
  974   HD11  ILE 132          HD11      ILE 132   5.671 -16.080   1.297
  975   HD12  ILE 132          HD12      ILE 132   4.549 -14.851   1.890
  976   HD13  ILE 132          HD13      ILE 132   6.293 -14.609   2.044
  977    HA   PRO 133           HA       PRO 133   1.945 -18.806  -3.375
  978    HB2  PRO 133           HB2      PRO 133  -0.262 -17.633  -1.746
  979    HB3  PRO 133           HB1      PRO 133  -0.044 -19.289  -2.326
  980    HG2  PRO 133           HG2      PRO 133   0.398 -18.671   0.232
  981    HG3  PRO 133           HG1      PRO 133   1.423 -19.840  -0.623
  982    HD2  PRO 133           HD2      PRO 133   1.993 -17.016   0.134
  983    HD3  PRO 133           HD1      PRO 133   3.089 -18.410   0.056
  984    HA   PRO 134           HA       PRO 134   1.181 -15.422  -6.064
  985    HB2  PRO 134           HB2      PRO 134  -0.625 -16.562  -7.762
  986    HB3  PRO 134           HB1      PRO 134   1.114 -16.882  -7.817
  987    HG2  PRO 134           HG2      PRO 134  -1.067 -18.507  -6.559
  988    HG3  PRO 134           HG1      PRO 134   0.321 -19.048  -7.523
  989    HD2  PRO 134           HD2      PRO 134   0.318 -19.215  -4.834
  990    HD3  PRO 134           HD1      PRO 134   1.799 -18.850  -5.745
  991    H    HIS 135           HN       HIS 135  -0.043 -13.722  -6.010
  992    HA   HIS 135           HA       HIS 135  -1.730 -12.282  -5.739
  993    HB2  HIS 135           HB2      HIS 135  -3.696 -12.788  -6.650
  994    HB3  HIS 135           HB1      HIS 135  -2.978 -14.348  -6.997
  995    HD1  HIS 135           HD1      HIS 135  -5.352 -12.677  -4.569
  996    HD2  HIS 135           HD2      HIS 135  -4.215 -16.496  -5.752
  997    HE1  HIS 135           HE1      HIS 135  -7.012 -14.231  -3.521
  998    HE2  HIS 135           HE2      HIS 135  -6.449 -16.503  -4.448
  999    H    ALA 136           HN       ALA 136  -0.805 -14.371  -3.420
 1000    HA   ALA 136           HA       ALA 136  -2.721 -13.992  -1.389
 1001    HB1  ALA 136           HB1      ALA 136  -0.921 -14.550   0.173
 1002    HB2  ALA 136           HB2      ALA 136   0.263 -14.351  -1.119
 1003    HB3  ALA 136           HB3      ALA 136  -0.928 -15.648  -1.209
 1004    H    ALA 137           HN       ALA 137  -3.302 -12.170  -0.374
 1005    HA   ALA 137           HA       ALA 137  -2.052  -9.734  -1.241
 1006    HB1  ALA 137           HB1      ALA 137  -4.302 -10.151   0.731
 1007    HB2  ALA 137           HB2      ALA 137  -4.475  -9.852  -0.995
 1008    HB3  ALA 137           HB3      ALA 137  -3.798  -8.605   0.053
 1009    H    LEU 138           HN       LEU 138  -0.319  -8.950  -0.368
 1010    HA   LEU 138           HA       LEU 138   0.569  -9.932   2.200
 1011    HB2  LEU 138           HB2      LEU 138   1.809  -9.143  -0.221
 1012    HB3  LEU 138           HB1      LEU 138   2.409  -8.088   1.046
 1013    HG   LEU 138           HG       LEU 138   3.198  -9.958   2.326
 1014   HD11  LEU 138          HD11      LEU 138   1.387 -11.493   1.891
 1015   HD12  LEU 138          HD12      LEU 138   2.943 -12.258   1.563
 1016   HD13  LEU 138          HD13      LEU 138   1.934 -11.695   0.227
 1017   HD21  LEU 138          HD21      LEU 138   3.927 -10.326  -0.568
 1018   HD22  LEU 138          HD22      LEU 138   4.855 -10.892   0.822
 1019   HD23  LEU 138          HD23      LEU 138   4.649  -9.164   0.545
 1020    H    CYS 139           HN       CYS 139   0.601  -8.808   4.002
 1021    HA   CYS 139           HA       CYS 139  -0.050  -5.939   3.911
 1022    HB2  CYS 139           HB2      CYS 139  -1.616  -7.749   5.057
 1023    HB3  CYS 139           HB1      CYS 139  -0.432  -7.617   6.348
 1024    HG   CYS 139           HG       CYS 139  -2.647  -5.292   5.267
 1025    H    LEU 140           HN       LEU 140   1.898  -4.997   4.016
 1026    HA   LEU 140           HA       LEU 140   3.764  -5.976   6.072
 1027    HB2  LEU 140           HB2      LEU 140   5.573  -5.138   4.579
 1028    HB3  LEU 140           HB1      LEU 140   4.706  -6.540   3.979
 1029    HG   LEU 140           HG       LEU 140   3.368  -4.333   2.914
 1030   HD11  LEU 140          HD11      LEU 140   6.354  -4.011   2.631
 1031   HD12  LEU 140          HD12      LEU 140   5.308  -2.963   3.586
 1032   HD13  LEU 140          HD13      LEU 140   5.116  -3.042   1.832
 1033   HD21  LEU 140          HD21      LEU 140   5.431  -6.136   1.652
 1034   HD22  LEU 140          HD22      LEU 140   4.222  -5.180   0.796
 1035   HD23  LEU 140          HD23      LEU 140   3.717  -6.504   1.845
 1036    H    GLU 141           HN       GLU 141   4.625  -4.572   7.423
 1037    HA   GLU 141           HA       GLU 141   3.828  -1.769   7.175
 1038    HB2  GLU 141           HB2      GLU 141   3.215  -2.357   9.284
 1039    HB3  GLU 141           HB1      GLU 141   4.424  -3.621   9.407
 1040    HG2  GLU 141           HG2      GLU 141   6.136  -1.986   9.884
 1041    HG3  GLU 141           HG1      GLU 141   4.984  -0.668   9.678
 1042    H    VAL 142           HN       VAL 142   5.260  -0.263   6.631
 1043    HA   VAL 142           HA       VAL 142   8.107  -0.976   6.732
 1044    HB   VAL 142           HB       VAL 142   8.360   0.511   4.667
 1045   HG11  VAL 142          HG11      VAL 142   7.891  -1.382   3.171
 1046   HG12  VAL 142          HG12      VAL 142   6.979  -2.165   4.464
 1047   HG13  VAL 142          HG13      VAL 142   8.713  -1.887   4.647
 1048   HG21  VAL 142          HG21      VAL 142   5.406  -0.093   4.480
 1049   HG22  VAL 142          HG22      VAL 142   6.397   0.545   3.169
 1050   HG23  VAL 142          HG23      VAL 142   6.149   1.500   4.630
 1051    H    THR 143           HN       THR 143   9.074   0.249   8.146
 1052    HA   THR 143           HA       THR 143   8.381   3.046   8.532
 1053    HB   THR 143           HB       THR 143  10.765   1.545   9.665
 1054    HG1  THR 143           HG1      THR 143   8.236   1.995  10.938
 1055   HG21  THR 143          HG21      THR 143  10.649   3.262  11.427
 1056   HG22  THR 143          HG22      THR 143   9.325   4.053  10.569
 1057   HG23  THR 143          HG23      THR 143  10.929   3.971   9.838
 1058    H    LEU 144           HN       LEU 144   9.075   4.475   7.050
 1059    HA   LEU 144           HA       LEU 144  11.593   4.071   5.658
 1060    HB2  LEU 144           HB2      LEU 144   9.681   5.061   4.472
 1061    HB3  LEU 144           HB1      LEU 144   9.651   6.386   5.620
 1062    HG   LEU 144           HG       LEU 144  11.890   7.087   4.835
 1063   HD11  LEU 144          HD11      LEU 144  11.524   4.961   2.727
 1064   HD12  LEU 144          HD12      LEU 144  12.659   4.870   4.074
 1065   HD13  LEU 144          HD13      LEU 144  12.852   6.118   2.842
 1066   HD21  LEU 144          HD21      LEU 144   9.835   6.800   2.651
 1067   HD22  LEU 144          HD22      LEU 144  11.150   7.973   2.697
 1068   HD23  LEU 144          HD23      LEU 144   9.854   8.056   3.887
 1069    H    LYS 145           HN       LYS 145  13.313   4.316   6.879
 1070    HA   LYS 145           HA       LYS 145  13.212   6.228   9.084
 1071    HB2  LYS 145           HB2      LYS 145  15.370   4.195   8.532
 1072    HB3  LYS 145           HB1      LYS 145  14.957   4.958  10.064
 1073    HG2  LYS 145           HG2      LYS 145  12.934   3.723  10.231
 1074    HG3  LYS 145           HG1      LYS 145  13.105   3.127   8.579
 1075    HD2  LYS 145           HD2      LYS 145  15.012   2.498  10.826
 1076    HD3  LYS 145           HD1      LYS 145  13.684   1.444  10.303
 1077    HE2  LYS 145           HE2      LYS 145  14.649   1.093   8.208
 1078    HE3  LYS 145           HE1      LYS 145  15.803   2.421   8.391
 1079    HZ1  LYS 145           HZ1      LYS 145  16.556   0.962  10.431
 1080    HZ2  LYS 145           HZ2      LYS 145  17.145   0.661   8.869
 1081    HZ3  LYS 145           HZ3      LYS 145  15.893  -0.291   9.500
 1082    H    THR 146           HN       THR 146  14.756   5.708   6.016
 1083    HA   THR 146           HA       THR 146  16.101   8.248   6.225
 1084    HB   THR 146           HB       THR 146  17.767   5.786   5.699
 1085    HG1  THR 146           HG1      THR 146  16.907   6.792   8.052
 1086   HG21  THR 146          HG21      THR 146  19.669   7.278   5.963
 1087   HG22  THR 146          HG22      THR 146  18.595   8.629   6.324
 1088   HG23  THR 146          HG23      THR 146  18.591   7.903   4.715
 1089    H    ALA 147           HN       ALA 147  16.881   9.046   4.224
 1090    HA   ALA 147           HA       ALA 147  16.656   7.323   1.878
 1091    HB1  ALA 147           HB1      ALA 147  14.571   8.623   1.958
 1092    HB2  ALA 147           HB2      ALA 147  15.576   9.104   0.591
 1093    HB3  ALA 147           HB3      ALA 147  15.510  10.113   2.034
 1094    H    VAL 148           HN       VAL 148  18.481   7.478   0.649
 1095    HA   VAL 148           HA       VAL 148  20.039   9.964   0.866
 1096    HB   VAL 148           HB       VAL 148  22.143   8.807   1.127
 1097   HG11  VAL 148          HG11      VAL 148  20.145   7.850   3.172
 1098   HG12  VAL 148          HG12      VAL 148  20.964   9.414   3.171
 1099   HG13  VAL 148          HG13      VAL 148  21.892   7.932   3.400
 1100   HG21  VAL 148          HG21      VAL 148  22.296   6.410   1.521
 1101   HG22  VAL 148          HG22      VAL 148  21.611   6.748  -0.069
 1102   HG23  VAL 148          HG23      VAL 148  20.560   6.249   1.256
 1103    H    ASP 149           HN       ASP 149  21.228  10.501  -0.971
 1104    HA   ASP 149           HA       ASP 149  20.132   9.330  -3.360
 1105    HB2  ASP 149           HB2      ASP 149  20.284  11.694  -3.422
 1106    HB3  ASP 149           HB1      ASP 149  21.959  11.680  -2.877
 1107    H    LEU 150           HN       LEU 150  20.989   7.679  -4.321
 1108    HA   LEU 150           HA       LEU 150  23.896   7.456  -4.489
 1109    HB2  LEU 150           HB2      LEU 150  22.717   5.954  -2.708
 1110    HB3  LEU 150           HB1      LEU 150  22.209   5.011  -4.097
 1111    HG   LEU 150           HG       LEU 150  24.592   4.700  -4.727
 1112   HD11  LEU 150          HD11      LEU 150  25.468   6.729  -3.662
 1113   HD12  LEU 150          HD12      LEU 150  26.332   5.286  -3.124
 1114   HD13  LEU 150          HD13      LEU 150  25.125   6.037  -2.077
 1115   HD21  LEU 150          HD21      LEU 150  23.414   3.016  -3.387
 1116   HD22  LEU 150          HD22      LEU 150  23.911   3.849  -1.913
 1117   HD23  LEU 150          HD23      LEU 150  25.124   3.108  -2.960
 1118    H    GLU 151           HN       GLU 151  21.447   8.230  -6.090
 1119    HA   GLU 151           HA       GLU 151  21.115   6.318  -8.189
 1120    HB2  GLU 151           HB2      GLU 151  19.628   8.365  -7.369
 1121    HB3  GLU 151           HB1      GLU 151  20.580   9.249  -8.551
 1122    HG2  GLU 151           HG2      GLU 151  18.851   6.837  -9.106
 1123    HG3  GLU 151           HG1      GLU 151  18.439   8.514  -9.445
 1124    H    HIS 152           HN       HIS 152  22.879   9.327  -7.750
 1125    HA   HIS 152           HA       HIS 152  24.238   8.994 -10.299
 1126    HB2  HIS 152           HB2      HIS 152  24.278  11.222  -8.255
 1127    HB3  HIS 152           HB1      HIS 152  25.251  11.227  -9.723
 1128    HD1  HIS 152           HD1      HIS 152  24.214  12.549 -11.525
 1129    HD2  HIS 152           HD2      HIS 152  21.351  10.832  -9.043
 1130    HE1  HIS 152           HE1      HIS 152  21.990  13.263 -12.457
 1131    HE2  HIS 152           HE2      HIS 152  20.272  12.190 -10.961
 1132    H    HIS 153           HN       HIS 153  24.986   6.949  -9.136
 1133    HA   HIS 153           HA       HIS 153  27.071   6.967  -7.257
 1134    HB2  HIS 153           HB2      HIS 153  27.595   4.708  -8.123
 1135    HB3  HIS 153           HB1      HIS 153  25.867   4.922  -7.858
 1136    HD1  HIS 153           HD1      HIS 153  28.403   4.521 -10.622
 1137    HD2  HIS 153           HD2      HIS 153  24.285   4.790 -10.123
 1138    HE1  HIS 153           HE1      HIS 153  27.406   3.900 -12.847
 1139    HE2  HIS 153           HE2      HIS 153  24.943   4.369 -12.581
 1140    H    HIS 154           HN       HIS 154  29.352   6.537  -7.617
 1141    HA   HIS 154           HA       HIS 154  30.483   8.166  -9.662
 1142    HB2  HIS 154           HB2      HIS 154  32.667   7.411  -8.817
 1143    HB3  HIS 154           HB1      HIS 154  31.623   7.941  -7.509
 1144    HD1  HIS 154           HD1      HIS 154  31.555   6.413  -5.543
 1145    HD2  HIS 154           HD2      HIS 154  32.706   4.435  -9.022
 1146    HE1  HIS 154           HE1      HIS 154  32.116   4.064  -4.840
 1147    HE2  HIS 154           HE2      HIS 154  32.645   2.842  -6.979
 1148    H    HIS 155           HN       HIS 155  31.586   7.603 -11.490
 1149    HA   HIS 155           HA       HIS 155  32.290   6.411 -13.275
 1150    HB2  HIS 155           HB2      HIS 155  33.509   5.061 -11.591
 1151    HB3  HIS 155           HB1      HIS 155  32.119   3.985 -11.483
 1152    HD1  HIS 155           HD1      HIS 155  34.471   5.269 -14.186
 1153    HD2  HIS 155           HD2      HIS 155  32.291   1.869 -13.178
 1154    HE1  HIS 155           HE1      HIS 155  35.066   3.539 -15.917
 1155    HE2  HIS 155           HE2      HIS 155  33.714   1.497 -15.312
 1156    H    HIS 156           HN       HIS 156  30.838   6.467 -14.833
 1157    HA   HIS 156           HA       HIS 156  28.505   4.672 -14.633
 1158    HB2  HIS 156           HB2      HIS 156  27.373   6.101 -16.247
 1159    HB3  HIS 156           HB1      HIS 156  27.927   7.062 -14.886
 1160    HD1  HIS 156           HD1      HIS 156  28.858   6.327 -18.511
 1161    HD2  HIS 156           HD2      HIS 156  29.462   9.211 -15.559
 1162    HE1  HIS 156           HE1      HIS 156  29.996   8.253 -19.657
 1163    HE2  HIS 156           HE2      HIS 156  30.133  10.061 -17.914
 1164    H    HIS 157           HN       HIS 157  27.694   4.017 -16.906
 1165    HA   HIS 157           HA       HIS 157  29.984   3.307 -18.614
 1166    HB2  HIS 157           HB2      HIS 157  27.352   1.867 -18.200
 1167    HB3  HIS 157           HB1      HIS 157  28.509   1.447 -19.454
 1168    HD1  HIS 157           HD1      HIS 157  27.737   0.955 -15.894
 1169    HD2  HIS 157           HD2      HIS 157  30.943   0.300 -18.460
 1170    HE1  HIS 157           HE1      HIS 157  29.261  -0.638 -14.678
 1171    HE2  HIS 157           HE2      HIS 157  31.074  -1.191 -16.346
  Start of MODEL   15
    1    H1   MET   1           HT1      MET   1 -41.424  32.010 -17.741
    2    H2   MET   1           HT2      MET   1 -42.728  32.513 -16.791
    3    H3   MET   1           HT3      MET   1 -42.919  32.323 -18.472
    4    HA   MET   1           HA       MET   1 -42.266  30.143 -16.583
    5    HB2  MET   1           HB2      MET   1 -44.542  29.362 -16.872
    6    HB3  MET   1           HB1      MET   1 -44.556  31.005 -16.245
    7    HG2  MET   1           HG2      MET   1 -45.020  31.842 -18.505
    8    HG3  MET   1           HG1      MET   1 -45.045  30.183 -19.102
    9    HE1  MET   1           HE1      MET   1 -48.113  28.733 -17.079
   10    HE2  MET   1           HE2      MET   1 -46.399  28.697 -16.676
   11    HE3  MET   1           HE3      MET   1 -46.921  28.369 -18.329
   12    H    GLY   2           HN       GLY   2 -42.643  27.996 -17.607
   13    HA2  GLY   2           HA2      GLY   2 -42.771  26.633 -19.554
   14    HA3  GLY   2           HA1      GLY   2 -42.327  28.028 -20.526
   15    H    GLN   3           HN       GLN   3 -40.378  27.876 -17.811
   16    HA   GLN   3           HA       GLN   3 -38.350  26.267 -19.200
   17    HB2  GLN   3           HB2      GLN   3 -37.827  28.588 -19.680
   18    HB3  GLN   3           HB1      GLN   3 -37.954  29.005 -17.977
   19    HG2  GLN   3           HG2      GLN   3 -35.638  28.880 -18.593
   20    HG3  GLN   3           HG1      GLN   3 -36.024  27.548 -17.501
   21   HE21  GLN   3          HE21      GLN   3 -34.374  26.244 -18.161
   22   HE22  GLN   3          HE22      GLN   3 -34.312  25.513 -19.727
   23    HA   PRO   4           HA       PRO   4 -38.053  24.560 -15.036
   24    HB2  PRO   4           HB2      PRO   4 -35.970  22.876 -16.238
   25    HB3  PRO   4           HB1      PRO   4 -37.500  22.401 -15.494
   26    HG2  PRO   4           HG2      PRO   4 -37.075  22.201 -18.148
   27    HG3  PRO   4           HG1      PRO   4 -38.669  22.578 -17.467
   28    HD2  PRO   4           HD2      PRO   4 -36.644  24.425 -18.682
   29    HD3  PRO   4           HD1      PRO   4 -38.409  24.393 -18.893
   30    HA   PRO   5           HA       PRO   5 -34.581  26.887 -13.572
   31    HB2  PRO   5           HB2      PRO   5 -34.365  24.866 -11.420
   32    HB3  PRO   5           HB1      PRO   5 -34.657  26.606 -11.302
   33    HG2  PRO   5           HG2      PRO   5 -36.609  24.850 -10.835
   34    HG3  PRO   5           HG1      PRO   5 -36.931  26.380 -11.670
   35    HD2  PRO   5           HD2      PRO   5 -36.623  23.628 -12.818
   36    HD3  PRO   5           HD1      PRO   5 -37.794  24.898 -13.234
   37    H    ALA   6           HN       ALA   6 -32.363  26.849 -13.509
   38    HA   ALA   6           HA       ALA   6 -31.010  24.891 -15.006
   39    HB1  ALA   6           HB1      ALA   6 -28.972  26.098 -14.415
   40    HB2  ALA   6           HB2      ALA   6 -29.848  26.978 -13.160
   41    HB3  ALA   6           HB3      ALA   6 -30.259  27.220 -14.858
   42    H    GLU   7           HN       GLU   7 -31.164  25.491 -11.507
   43    HA   GLU   7           HA       GLU   7 -29.759  22.956 -11.094
   44    HB2  GLU   7           HB2      GLU   7 -30.340  25.228  -9.192
   45    HB3  GLU   7           HB1      GLU   7 -29.648  23.691  -8.686
   46    HG2  GLU   7           HG2      GLU   7 -27.882  24.178 -10.519
   47    HG3  GLU   7           HG1      GLU   7 -28.458  25.837 -10.376
   48    H    GLU   8           HN       GLU   8 -30.730  21.230 -10.290
   49    HA   GLU   8           HA       GLU   8 -33.647  21.361 -10.228
   50    HB2  GLU   8           HB2      GLU   8 -31.950  19.737 -11.580
   51    HB3  GLU   8           HB1      GLU   8 -32.262  18.751 -10.159
   52    HG2  GLU   8           HG2      GLU   8 -34.336  18.249 -10.813
   53    HG3  GLU   8           HG1      GLU   8 -34.669  19.897 -11.352
   54    H    ALA   9           HN       ALA   9 -34.773  19.848  -8.720
   55    HA   ALA   9           HA       ALA   9 -33.647  20.190  -6.048
   56    HB1  ALA   9           HB1      ALA   9 -35.886  19.761  -5.224
   57    HB2  ALA   9           HB2      ALA   9 -36.429  19.329  -6.845
   58    HB3  ALA   9           HB3      ALA   9 -35.946  20.987  -6.491
   59    H    GLU  10           HN       GLU  10 -33.307  18.521  -4.627
   60    HA   GLU  10           HA       GLU  10 -32.698  15.978  -5.792
   61    HB2  GLU  10           HB2      GLU  10 -31.951  15.361  -3.512
   62    HB3  GLU  10           HB1      GLU  10 -31.239  16.866  -4.076
   63    HG2  GLU  10           HG2      GLU  10 -32.934  18.096  -2.747
   64    HG3  GLU  10           HG1      GLU  10 -33.489  16.549  -2.106
   65    H    GLN  11           HN       GLN  11 -35.472  17.336  -4.483
   66    HA   GLN  11           HA       GLN  11 -36.710  14.678  -4.422
   67    HB2  GLN  11           HB2      GLN  11 -38.331  15.607  -2.707
   68    HB3  GLN  11           HB1      GLN  11 -36.703  15.279  -2.136
   69    HG2  GLN  11           HG2      GLN  11 -36.428  17.378  -1.501
   70    HG3  GLN  11           HG1      GLN  11 -36.924  17.986  -3.078
   71   HE21  GLN  11          HE21      GLN  11 -37.489  18.966  -0.352
   72   HE22  GLN  11          HE22      GLN  11 -39.218  19.055  -0.254
   73    HA   PRO  12           HA       PRO  12 -38.804  16.968  -7.724
   74    HB2  PRO  12           HB2      PRO  12 -39.654  14.253  -8.466
   75    HB3  PRO  12           HB1      PRO  12 -38.785  15.460  -9.419
   76    HG2  PRO  12           HG2      PRO  12 -37.574  13.245  -8.493
   77    HG3  PRO  12           HG1      PRO  12 -36.724  14.795  -8.624
   78    HD2  PRO  12           HD2      PRO  12 -37.887  13.472  -6.206
   79    HD3  PRO  12           HD1      PRO  12 -36.354  14.359  -6.383
   80    H    GLY  13           HN       GLY  13 -40.116  14.384  -5.668
   81    HA2  GLY  13           HA2      GLY  13 -42.136  14.448  -4.497
   82    HA3  GLY  13           HA1      GLY  13 -42.571  15.912  -5.363
   83    H    ALA  14           HN       ALA  14 -42.089  14.729  -7.983
   84    HA   ALA  14           HA       ALA  14 -44.628  13.431  -8.367
   85    HB1  ALA  14           HB1      ALA  14 -43.780  15.032 -10.002
   86    HB2  ALA  14           HB2      ALA  14 -43.996  13.448 -10.745
   87    HB3  ALA  14           HB3      ALA  14 -42.382  14.002 -10.306
   88    H    LEU  15           HN       LEU  15 -43.694  11.712 -10.558
   89    HA   LEU  15           HA       LEU  15 -43.226   9.317  -9.127
   90    HB2  LEU  15           HB2      LEU  15 -43.033   9.979 -12.062
   91    HB3  LEU  15           HB1      LEU  15 -42.806   8.358 -11.428
   92    HG   LEU  15           HG       LEU  15 -45.332   9.989 -11.160
   93   HD11  LEU  15          HD11      LEU  15 -44.697   7.642 -12.950
   94   HD12  LEU  15          HD12      LEU  15 -44.946   9.309 -13.465
   95   HD13  LEU  15          HD13      LEU  15 -46.280   8.398 -12.760
   96   HD21  LEU  15          HD21      LEU  15 -46.311   7.888 -10.359
   97   HD22  LEU  15          HD22      LEU  15 -45.015   8.454  -9.306
   98   HD23  LEU  15          HD23      LEU  15 -44.718   7.129 -10.429
   99    H    ALA  16           HN       ALA  16 -41.371   9.403  -7.930
  100    HA   ALA  16           HA       ALA  16 -38.876   9.405  -9.467
  101    HB1  ALA  16           HB1      ALA  16 -39.148  11.628  -8.406
  102    HB2  ALA  16           HB2      ALA  16 -37.749  10.750  -7.788
  103    HB3  ALA  16           HB3      ALA  16 -39.227  10.839  -6.829
  104    H    ARG  17           HN       ARG  17 -38.706   7.209  -9.322
  105    HA   ARG  17           HA       ARG  17 -38.299   6.083  -6.646
  106    HB2  ARG  17           HB2      ARG  17 -38.127   3.891  -7.859
  107    HB3  ARG  17           HB1      ARG  17 -39.695   4.671  -7.998
  108    HG2  ARG  17           HG2      ARG  17 -39.470   5.054 -10.223
  109    HG3  ARG  17           HG1      ARG  17 -37.715   5.213 -10.132
  110    HD2  ARG  17           HD2      ARG  17 -38.546   3.178 -11.335
  111    HD3  ARG  17           HD1      ARG  17 -37.422   2.866 -10.017
  112    HE   ARG  17           HE       ARG  17 -39.301   2.133  -8.675
  113   HH11  ARG  17          HH11      ARG  17 -39.984   2.623 -12.075
  114   HH12  ARG  17          HH12      ARG  17 -41.244   1.424 -12.129
  115   HH21  ARG  17          HH21      ARG  17 -40.979   0.560  -8.736
  116   HH22  ARG  17          HH22      ARG  17 -41.808   0.257 -10.235
  117    H    GLU  18           HN       GLU  18 -36.294   4.975  -6.179
  118    HA   GLU  18           HA       GLU  18 -34.107   6.231  -7.693
  119    HB2  GLU  18           HB2      GLU  18 -32.760   6.130  -5.731
  120    HB3  GLU  18           HB1      GLU  18 -34.328   6.768  -5.247
  121    HG2  GLU  18           HG2      GLU  18 -34.892   4.880  -4.084
  122    HG3  GLU  18           HG1      GLU  18 -33.829   3.843  -5.034
  123    H    PHE  19           HN       PHE  19 -32.169   5.093  -7.971
  124    HA   PHE  19           HA       PHE  19 -32.144   2.216  -7.526
  125    HB2  PHE  19           HB2      PHE  19 -31.231   1.846  -9.827
  126    HB3  PHE  19           HB1      PHE  19 -32.922   2.332  -9.808
  127    HD1  PHE  19           HD1      PHE  19 -33.547   4.624 -10.480
  128    HD2  PHE  19           HD2      PHE  19 -29.563   3.181 -10.870
  129    HE1  PHE  19           HE1      PHE  19 -33.034   6.470 -12.024
  130    HE2  PHE  19           HE2      PHE  19 -29.039   5.024 -12.416
  131    HZ   PHE  19           HZ       PHE  19 -30.772   6.635 -13.037
  132    H    LEU  20           HN       LEU  20 -30.952   4.679  -6.463
  133    HA   LEU  20           HA       LEU  20 -28.204   4.683  -7.429
  134    HB2  LEU  20           HB2      LEU  20 -29.464   6.451  -5.334
  135    HB3  LEU  20           HB1      LEU  20 -27.951   6.722  -6.176
  136    HG   LEU  20           HG       LEU  20 -30.683   6.766  -7.456
  137   HD11  LEU  20          HD11      LEU  20 -30.360   8.659  -5.962
  138   HD12  LEU  20          HD12      LEU  20 -30.316   9.184  -7.644
  139   HD13  LEU  20          HD13      LEU  20 -28.817   9.025  -6.728
  140   HD21  LEU  20          HD21      LEU  20 -28.904   6.031  -8.980
  141   HD22  LEU  20          HD22      LEU  20 -27.980   7.484  -8.596
  142   HD23  LEU  20          HD23      LEU  20 -29.533   7.616  -9.423
  143    H    ALA  21           HN       ALA  21 -29.941   4.455  -4.337
  144    HA   ALA  21           HA       ALA  21 -27.623   2.967  -3.274
  145    HB1  ALA  21           HB1      ALA  21 -29.579   4.696  -1.741
  146    HB2  ALA  21           HB2      ALA  21 -27.922   5.141  -2.152
  147    HB3  ALA  21           HB3      ALA  21 -28.229   3.796  -1.050
  148    H    ALA  22           HN       ALA  22 -31.069   3.469  -2.565
  149    HA   ALA  22           HA       ALA  22 -32.757   2.072  -1.996
  150    HB1  ALA  22           HB1      ALA  22 -31.313   0.113  -3.775
  151    HB2  ALA  22           HB2      ALA  22 -32.443   1.352  -4.317
  152    HB3  ALA  22           HB3      ALA  22 -33.007   0.034  -3.291
  153    H    MET  23           HN       MET  23 -29.975   1.812  -0.593
  154    HA   MET  23           HA       MET  23 -29.041   0.691   1.142
  155    HB2  MET  23           HB2      MET  23 -31.883  -0.262   1.534
  156    HB3  MET  23           HB1      MET  23 -30.588  -0.484   2.703
  157    HG2  MET  23           HG2      MET  23 -30.350   1.924   2.913
  158    HG3  MET  23           HG1      MET  23 -31.618   2.162   1.717
  159    HE1  MET  23           HE1      MET  23 -32.917   3.768   3.456
  160    HE2  MET  23           HE2      MET  23 -31.588   3.510   4.586
  161    HE3  MET  23           HE3      MET  23 -33.253   3.292   5.124
  162    H    GLU  24           HN       GLU  24 -29.267  -0.606  -1.528
  163    HA   GLU  24           HA       GLU  24 -29.516  -3.418  -1.021
  164    HB2  GLU  24           HB2      GLU  24 -28.420  -1.992  -3.452
  165    HB3  GLU  24           HB1      GLU  24 -28.783  -3.710  -3.354
  166    HG2  GLU  24           HG2      GLU  24 -31.142  -3.165  -2.948
  167    HG3  GLU  24           HG1      GLU  24 -30.762  -1.453  -3.129
  168    HA   PRO  25           HA       PRO  25 -24.620  -3.246  -1.685
  169    HB2  PRO  25           HB2      PRO  25 -23.610  -0.855  -0.675
  170    HB3  PRO  25           HB1      PRO  25 -23.744  -1.269  -2.386
  171    HG2  PRO  25           HG2      PRO  25 -25.565   0.368  -0.680
  172    HG3  PRO  25           HG1      PRO  25 -25.080   0.618  -2.368
  173    HD2  PRO  25           HD2      PRO  25 -27.481  -0.371  -1.758
  174    HD3  PRO  25           HD1      PRO  25 -26.575  -0.984  -3.157
  175    H    GLU  26           HN       GLU  26 -23.749  -4.368  -0.081
  176    HA   GLU  26           HA       GLU  26 -24.826  -4.230   2.549
  177    HB2  GLU  26           HB2      GLU  26 -23.173  -6.021   3.061
  178    HB3  GLU  26           HB1      GLU  26 -24.197  -6.377   1.682
  179    HG2  GLU  26           HG2      GLU  26 -22.394  -5.786   0.168
  180    HG3  GLU  26           HG1      GLU  26 -21.360  -5.375   1.533
  181    HA   PRO  27           HA       PRO  27 -22.076  -1.365   4.448
  182    HB2  PRO  27           HB2      PRO  27 -22.236  -2.196   7.014
  183    HB3  PRO  27           HB1      PRO  27 -23.569  -1.372   6.193
  184    HG2  PRO  27           HG2      PRO  27 -23.161  -4.313   6.645
  185    HG3  PRO  27           HG1      PRO  27 -24.626  -3.341   6.879
  186    HD2  PRO  27           HD2      PRO  27 -24.245  -4.841   4.676
  187    HD3  PRO  27           HD1      PRO  27 -25.105  -3.288   4.624
  188    H    ALA  28           HN       ALA  28 -20.110  -1.208   5.699
  189    HA   ALA  28           HA       ALA  28 -18.395  -3.580   5.467
  190    HB1  ALA  28           HB1      ALA  28 -17.607  -1.585   4.282
  191    HB2  ALA  28           HB2      ALA  28 -16.512  -2.032   5.591
  192    HB3  ALA  28           HB3      ALA  28 -17.622  -0.678   5.795
  193    HA   PRO  29           HA       PRO  29 -18.419  -4.112   9.859
  194    HB2  PRO  29           HB2      PRO  29 -15.863  -5.141  10.085
  195    HB3  PRO  29           HB1      PRO  29 -17.309  -6.090   9.722
  196    HG2  PRO  29           HG2      PRO  29 -15.199  -5.056   7.894
  197    HG3  PRO  29           HG1      PRO  29 -16.116  -6.571   7.808
  198    HD2  PRO  29           HD2      PRO  29 -16.653  -4.467   6.210
  199    HD3  PRO  29           HD1      PRO  29 -17.920  -5.566   6.782
  200    H    ALA  30           HN       ALA  30 -17.444  -3.292  11.759
  201    HA   ALA  30           HA       ALA  30 -16.179  -0.768  11.450
  202    HB1  ALA  30           HB1      ALA  30 -16.252  -0.595  13.857
  203    HB2  ALA  30           HB2      ALA  30 -16.594  -2.320  13.999
  204    HB3  ALA  30           HB3      ALA  30 -17.782  -1.243  13.262
  205    HA   PRO  31           HA       PRO  31 -12.218  -2.886  13.072
  206    HB2  PRO  31           HB2      PRO  31 -12.514  -5.753  13.061
  207    HB3  PRO  31           HB1      PRO  31 -12.210  -4.690  14.434
  208    HG2  PRO  31           HG2      PRO  31 -14.540  -6.079  14.073
  209    HG3  PRO  31           HG1      PRO  31 -14.421  -4.571  15.000
  210    HD2  PRO  31           HD2      PRO  31 -15.354  -5.007  12.186
  211    HD3  PRO  31           HD1      PRO  31 -16.021  -3.945  13.447
  212    H    ALA  32           HN       ALA  32 -13.139  -2.493  10.421
  213    HA   ALA  32           HA       ALA  32 -11.781  -4.585   8.868
  214    HB1  ALA  32           HB1      ALA  32 -13.569  -2.351   7.904
  215    HB2  ALA  32           HB2      ALA  32 -14.079  -4.015   8.196
  216    HB3  ALA  32           HB3      ALA  32 -12.907  -3.659   6.926
  217    HA   PRO  33           HA       PRO  33  -8.287  -1.970   8.108
  218    HB2  PRO  33           HB2      PRO  33  -8.190  -3.068   5.374
  219    HB3  PRO  33           HB1      PRO  33  -7.002  -3.191   6.675
  220    HG2  PRO  33           HG2      PRO  33  -8.471  -5.305   5.914
  221    HG3  PRO  33           HG1      PRO  33  -8.018  -5.046   7.609
  222    HD2  PRO  33           HD2      PRO  33 -10.625  -4.506   6.237
  223    HD3  PRO  33           HD1      PRO  33 -10.321  -5.198   7.846
  224    H    GLU  34           HN       GLU  34 -10.848  -2.155   5.739
  225    HA   GLU  34           HA       GLU  34 -11.954  -0.607   4.517
  226    HB2  GLU  34           HB2      GLU  34 -10.170   1.427   5.861
  227    HB3  GLU  34           HB1      GLU  34 -11.530   1.811   4.821
  228    HG2  GLU  34           HG2      GLU  34 -12.978   0.555   6.457
  229    HG3  GLU  34           HG1      GLU  34 -11.581   0.523   7.532
  230    H    GLU  35           HN       GLU  35 -11.598   0.966   2.710
  231    HA   GLU  35           HA       GLU  35  -9.327   0.099   1.153
  232    HB2  GLU  35           HB2      GLU  35 -11.751   1.771   0.588
  233    HB3  GLU  35           HB1      GLU  35 -10.384   1.800  -0.513
  234    HG2  GLU  35           HG2      GLU  35 -12.191   0.241  -1.172
  235    HG3  GLU  35           HG1      GLU  35 -10.614  -0.520  -0.984
  236    H    TRP  36           HN       TRP  36  -7.473   1.005   1.822
  237    HA   TRP  36           HA       TRP  36  -7.209   3.761   2.532
  238    HB2  TRP  36           HB2      TRP  36  -4.941   2.063   1.530
  239    HB3  TRP  36           HB1      TRP  36  -4.907   3.351   2.720
  240    HD1  TRP  36           HD1      TRP  36  -7.303   2.109   4.564
  241    HE1  TRP  36           HE1      TRP  36  -6.742   0.081   6.042
  242    HE3  TRP  36           HE3      TRP  36  -3.120   0.470   2.122
  243    HZ2  TRP  36           HZ2      TRP  36  -4.748  -1.946   6.153
  244    HZ3  TRP  36           HZ3      TRP  36  -1.969  -1.496   2.969
  245    HH2  TRP  36           HH2      TRP  36  -2.751  -2.694   4.925
  246    H    LEU  37           HN       LEU  37  -5.111   4.753   1.190
  247    HA   LEU  37           HA       LEU  37  -6.116   5.448  -1.381
  248    HB2  LEU  37           HB2      LEU  37  -4.666   6.914   0.008
  249    HB3  LEU  37           HB1      LEU  37  -3.342   5.799  -0.238
  250    HG   LEU  37           HG       LEU  37  -3.482   6.250  -2.685
  251   HD11  LEU  37          HD11      LEU  37  -5.362   8.447  -1.829
  252   HD12  LEU  37          HD12      LEU  37  -5.797   7.017  -2.767
  253   HD13  LEU  37          HD13      LEU  37  -4.695   8.213  -3.446
  254   HD21  LEU  37          HD21      LEU  37  -2.424   8.462  -2.554
  255   HD22  LEU  37          HD22      LEU  37  -1.816   7.351  -1.327
  256   HD23  LEU  37          HD23      LEU  37  -2.969   8.612  -0.885
  257    H    ASP  38           HN       ASP  38  -6.204   3.913  -2.947
  258    HA   ASP  38           HA       ASP  38  -4.182   1.891  -3.118
  259    HB2  ASP  38           HB2      ASP  38  -6.610   1.568  -3.841
  260    HB3  ASP  38           HB1      ASP  38  -6.171   2.471  -5.292
  261    H    ILE  39           HN       ILE  39  -2.420   1.894  -4.197
  262    HA   ILE  39           HA       ILE  39  -1.293   4.288  -5.114
  263    HB   ILE  39           HB       ILE  39  -0.364   1.469  -5.667
  264   HG12  ILE  39          HG12      ILE  39  -0.248   3.181  -3.209
  265   HG13  ILE  39          HG11      ILE  39  -0.607   1.472  -3.357
  266   HG21  ILE  39          HG21      ILE  39   1.184   4.045  -5.495
  267   HG22  ILE  39          HG22      ILE  39   0.808   3.158  -6.972
  268   HG23  ILE  39          HG23      ILE  39   1.868   2.440  -5.758
  269   HD11  ILE  39          HD11      ILE  39   1.750   1.021  -3.830
  270   HD12  ILE  39          HD12      ILE  39   1.520   1.803  -2.265
  271   HD13  ILE  39          HD13      ILE  39   2.104   2.740  -3.640
  272    H    LEU  40           HN       LEU  40  -2.965   1.689  -6.727
  273    HA   LEU  40           HA       LEU  40  -2.538   3.069  -9.302
  274    HB2  LEU  40           HB2      LEU  40  -3.174   0.159  -8.824
  275    HB3  LEU  40           HB1      LEU  40  -2.984   0.915 -10.393
  276    HG   LEU  40           HG       LEU  40  -0.829   0.491  -8.317
  277   HD11  LEU  40          HD11      LEU  40  -1.249  -0.614 -11.091
  278   HD12  LEU  40          HD12      LEU  40  -1.424  -1.495  -9.575
  279   HD13  LEU  40          HD13      LEU  40   0.161  -0.907 -10.074
  280   HD21  LEU  40          HD21      LEU  40  -0.658   1.873 -10.998
  281   HD22  LEU  40          HD22      LEU  40   0.702   1.493  -9.941
  282   HD23  LEU  40          HD23      LEU  40  -0.521   2.655  -9.424
  283    H    GLY  41           HN       GLY  41  -4.662   2.805  -6.923
  284    HA2  GLY  41           HA2      GLY  41  -6.921   3.020  -6.671
  285    HA3  GLY  41           HA1      GLY  41  -6.952   3.623  -8.319
  286    H    ASN  42           HN       ASN  42  -5.677   0.471  -7.601
  287    HA   ASN  42           HA       ASN  42  -7.847  -0.650  -9.207
  288    HB2  ASN  42           HB2      ASN  42  -6.456  -2.461  -9.774
  289    HB3  ASN  42           HB1      ASN  42  -5.460  -1.032  -9.893
  290   HD21  ASN  42          HD21      ASN  42  -4.930  -0.892  -6.982
  291   HD22  ASN  42          HD22      ASN  42  -3.848  -2.197  -6.668
  292    H    GLY  43           HN       GLY  43  -6.522  -0.831  -5.984
  293    HA2  GLY  43           HA2      GLY  43  -8.108  -1.299  -4.215
  294    HA3  GLY  43           HA1      GLY  43  -8.885  -2.464  -5.281
  295    H    LEU  44           HN       LEU  44  -5.670  -2.769  -5.727
  296    HA   LEU  44           HA       LEU  44  -5.562  -5.111  -3.959
  297    HB2  LEU  44           HB2      LEU  44  -4.173  -4.436  -6.548
  298    HB3  LEU  44           HB1      LEU  44  -3.643  -5.756  -5.527
  299    HG   LEU  44           HG       LEU  44  -5.884  -6.791  -5.804
  300   HD11  LEU  44          HD11      LEU  44  -7.367  -6.048  -7.557
  301   HD12  LEU  44          HD12      LEU  44  -6.296  -4.694  -7.916
  302   HD13  LEU  44          HD13      LEU  44  -7.148  -4.757  -6.372
  303   HD21  LEU  44          HD21      LEU  44  -4.005  -7.509  -7.145
  304   HD22  LEU  44          HD22      LEU  44  -4.354  -6.249  -8.329
  305   HD23  LEU  44          HD23      LEU  44  -5.496  -7.570  -8.083
  306    H    LEU  45           HN       LEU  45  -4.019  -2.131  -4.772
  307    HA   LEU  45           HA       LEU  45  -1.743  -2.739  -3.010
  308    HB2  LEU  45           HB2      LEU  45  -0.910  -2.917  -5.176
  309    HB3  LEU  45           HB1      LEU  45  -1.856  -1.569  -5.753
  310    HG   LEU  45           HG       LEU  45  -0.382  -0.015  -4.567
  311   HD11  LEU  45          HD11      LEU  45   0.257  -1.502  -2.717
  312   HD12  LEU  45          HD12      LEU  45   1.646  -0.768  -3.517
  313   HD13  LEU  45          HD13      LEU  45   1.230  -2.450  -3.842
  314   HD21  LEU  45          HD21      LEU  45   1.599  -0.382  -5.956
  315   HD22  LEU  45          HD22      LEU  45   0.098  -0.622  -6.857
  316   HD23  LEU  45          HD23      LEU  45   1.033  -2.016  -6.306
  317    H    ARG  46           HN       ARG  46  -2.192  -1.506  -1.197
  318    HA   ARG  46           HA       ARG  46  -2.728   1.373  -1.630
  319    HB2  ARG  46           HB2      ARG  46  -4.240  -0.339   0.359
  320    HB3  ARG  46           HB1      ARG  46  -4.510   1.362   0.000
  321    HG2  ARG  46           HG2      ARG  46  -5.348   0.886  -2.128
  322    HG3  ARG  46           HG1      ARG  46  -4.791  -0.776  -2.076
  323    HD2  ARG  46           HD2      ARG  46  -6.983   0.443  -0.397
  324    HD3  ARG  46           HD1      ARG  46  -7.199  -0.664  -1.749
  325    HE   ARG  46           HE       ARG  46  -5.520  -1.830   0.206
  326   HH11  ARG  46          HH11      ARG  46  -8.871  -1.070  -0.432
  327   HH12  ARG  46          HH12      ARG  46  -9.492  -2.326   0.590
  328   HH21  ARG  46          HH21      ARG  46  -6.326  -3.494   1.553
  329   HH22  ARG  46          HH22      ARG  46  -8.041  -3.720   1.709
  330    H    LYS  47           HN       LYS  47  -1.997   2.747   0.048
  331    HA   LYS  47           HA       LYS  47  -0.306   1.452   2.101
  332    HB2  LYS  47           HB2      LYS  47   0.884   2.915   0.396
  333    HB3  LYS  47           HB1      LYS  47  -0.014   4.278   1.047
  334    HG2  LYS  47           HG2      LYS  47   0.972   3.523   3.327
  335    HG3  LYS  47           HG1      LYS  47   2.137   2.656   2.335
  336    HD2  LYS  47           HD2      LYS  47   3.093   4.757   2.921
  337    HD3  LYS  47           HD1      LYS  47   2.677   4.814   1.213
  338    HE2  LYS  47           HE2      LYS  47   0.800   6.207   1.621
  339    HE3  LYS  47           HE1      LYS  47   0.841   5.876   3.352
  340    HZ1  LYS  47           HZ1      LYS  47   2.878   7.146   3.548
  341    HZ2  LYS  47           HZ2      LYS  47   1.700   8.101   2.781
  342    HZ3  LYS  47           HZ3      LYS  47   2.933   7.392   1.869
  343    H    LYS  48           HN       LYS  48  -0.813   1.806   4.190
  344    HA   LYS  48           HA       LYS  48  -2.660   4.020   4.821
  345    HB2  LYS  48           HB2      LYS  48  -3.607   1.778   5.272
  346    HB3  LYS  48           HB1      LYS  48  -2.252   1.434   6.338
  347    HG2  LYS  48           HG2      LYS  48  -2.953   3.355   7.753
  348    HG3  LYS  48           HG1      LYS  48  -4.377   3.523   6.728
  349    HD2  LYS  48           HD2      LYS  48  -4.913   2.271   8.747
  350    HD3  LYS  48           HD1      LYS  48  -5.073   1.250   7.318
  351    HE2  LYS  48           HE2      LYS  48  -3.050   0.118   7.783
  352    HE3  LYS  48           HE1      LYS  48  -2.577   1.310   8.995
  353    HZ1  LYS  48           HZ1      LYS  48  -3.361  -0.685  10.062
  354    HZ2  LYS  48           HZ2      LYS  48  -4.823  -0.624   9.208
  355    HZ3  LYS  48           HZ3      LYS  48  -4.460   0.573  10.354
  356    H    THR  49           HN       THR  49  -1.958   5.545   6.169
  357    HA   THR  49           HA       THR  49   0.759   5.417   7.142
  358    HB   THR  49           HB       THR  49   0.118   7.752   8.052
  359    HG1  THR  49           HG1      THR  49  -2.223   7.230   7.710
  360   HG21  THR  49          HG21      THR  49   0.064   7.206   5.078
  361   HG22  THR  49          HG22      THR  49   1.510   7.408   6.074
  362   HG23  THR  49          HG23      THR  49   0.404   8.762   5.834
  363    H    LEU  50           HN       LEU  50   1.078   4.211   8.903
  364    HA   LEU  50           HA       LEU  50  -0.715   4.173  11.160
  365    HB2  LEU  50           HB2      LEU  50   2.204   3.507  11.316
  366    HB3  LEU  50           HB1      LEU  50   0.863   2.771  12.170
  367    HG   LEU  50           HG       LEU  50   1.258   2.431   9.208
  368   HD11  LEU  50          HD11      LEU  50   2.261   0.685  11.445
  369   HD12  LEU  50          HD12      LEU  50   3.249   1.631  10.329
  370   HD13  LEU  50          HD13      LEU  50   2.288   0.277   9.727
  371   HD21  LEU  50          HD21      LEU  50  -0.970   1.963  10.084
  372   HD22  LEU  50          HD22      LEU  50  -0.271   0.863  11.271
  373   HD23  LEU  50          HD23      LEU  50  -0.168   0.485   9.552
  374    H    VAL  51           HN       VAL  51   2.523   5.321  10.560
  375    HA   VAL  51           HA       VAL  51   2.015   7.798  12.076
  376    HB   VAL  51           HB       VAL  51   4.605   6.270  11.767
  377   HG11  VAL  51          HG11      VAL  51   4.043   8.869  13.198
  378   HG12  VAL  51          HG12      VAL  51   5.021   8.655  11.745
  379   HG13  VAL  51          HG13      VAL  51   5.561   7.975  13.279
  380   HG21  VAL  51          HG21      VAL  51   2.898   6.760  14.198
  381   HG22  VAL  51          HG22      VAL  51   4.491   6.001  14.216
  382   HG23  VAL  51          HG23      VAL  51   3.146   5.215  13.384
  383    HA   PRO  52           HA       PRO  52   3.473   9.123   8.031
  384    HB2  PRO  52           HB2      PRO  52   1.757  11.126   7.758
  385    HB3  PRO  52           HB1      PRO  52   1.182   9.453   7.876
  386    HG2  PRO  52           HG2      PRO  52   1.021  11.632   9.888
  387    HG3  PRO  52           HG1      PRO  52  -0.026  10.220   9.675
  388    HD2  PRO  52           HD2      PRO  52   2.275  10.546  11.435
  389    HD3  PRO  52           HD1      PRO  52   1.116   9.199  11.360
  390    H    GLY  53           HN       GLY  53   5.618   9.758   8.896
  391    HA2  GLY  53           HA2      GLY  53   7.318  11.268   9.162
  392    HA3  GLY  53           HA1      GLY  53   6.337  12.299   8.145
  393    HA   PRO  54           HA       PRO  54   5.092  12.913  12.908
  394    HB2  PRO  54           HB2      PRO  54   7.860  12.705  13.977
  395    HB3  PRO  54           HB1      PRO  54   6.326  12.194  14.692
  396    HG2  PRO  54           HG2      PRO  54   7.999  10.413  13.630
  397    HG3  PRO  54           HG1      PRO  54   6.244  10.240  13.450
  398    HD2  PRO  54           HD2      PRO  54   8.277  11.149  11.465
  399    HD3  PRO  54           HD1      PRO  54   6.805  10.188  11.215
  400    HA   PRO  55           HA       PRO  55   7.699  16.728  13.527
  401    HB2  PRO  55           HB2      PRO  55  10.358  16.762  12.731
  402    HB3  PRO  55           HB1      PRO  55   9.761  16.235  14.305
  403    HG2  PRO  55           HG2      PRO  55  10.995  14.642  12.298
  404    HG3  PRO  55           HG1      PRO  55  10.287  14.098  13.826
  405    HD2  PRO  55           HD2      PRO  55   9.125  14.063  11.094
  406    HD3  PRO  55           HD1      PRO  55   8.799  12.999  12.479
  407    H    GLY  56           HN       GLY  56   7.626  15.576  10.364
  408    HA2  GLY  56           HA2      GLY  56   6.962  17.326   8.699
  409    HA3  GLY  56           HA1      GLY  56   8.349  18.240   9.283
  410    H    SER  57           HN       SER  57   7.260  15.625   7.323
  411    HA   SER  57           HA       SER  57   9.950  14.635   6.868
  412    HB2  SER  57           HB2      SER  57   8.444  12.928   5.558
  413    HB3  SER  57           HB1      SER  57   8.545  12.868   7.316
  414    HG   SER  57           HG       SER  57   6.467  13.716   5.645
  415    H    SER  58           HN       SER  58   9.907  13.554   4.518
  416    HA   SER  58           HA       SER  58   8.877  15.299   2.441
  417    HB2  SER  58           HB2      SER  58  11.161  16.186   3.060
  418    HB3  SER  58           HB1      SER  58  11.828  14.614   2.618
  419    HG   SER  58           HG       SER  58  11.820  15.264   0.634
  420    H    ARG  59           HN       ARG  59   8.621  14.087   0.475
  421    HA   ARG  59           HA       ARG  59   8.739  11.216   0.954
  422    HB2  ARG  59           HB2      ARG  59   7.503  12.667  -1.390
  423    HB3  ARG  59           HB1      ARG  59   7.247  10.981  -0.926
  424    HG2  ARG  59           HG2      ARG  59   6.545  12.356   1.345
  425    HG3  ARG  59           HG1      ARG  59   5.966  13.406   0.051
  426    HD2  ARG  59           HD2      ARG  59   5.302  10.496   0.474
  427    HD3  ARG  59           HD1      ARG  59   4.226  11.871   0.706
  428    HE   ARG  59           HE       ARG  59   5.252  10.963  -1.907
  429   HH11  ARG  59          HH11      ARG  59   2.802  12.534   0.070
  430   HH12  ARG  59          HH12      ARG  59   1.671  12.682  -1.241
  431   HH21  ARG  59          HH21      ARG  59   3.753  11.183  -3.631
  432   HH22  ARG  59          HH22      ARG  59   2.215  11.943  -3.347
  433    HA   PRO  60           HA       PRO  60  12.638  10.922  -1.252
  434    HB2  PRO  60           HB2      PRO  60  12.321   8.164  -1.582
  435    HB3  PRO  60           HB1      PRO  60  13.162   8.962  -0.250
  436    HG2  PRO  60           HG2      PRO  60  10.355   7.946  -0.388
  437    HG3  PRO  60           HG1      PRO  60  11.515   7.867   0.955
  438    HD2  PRO  60           HD2      PRO  60   9.557   9.648   1.023
  439    HD3  PRO  60           HD1      PRO  60  11.202  10.123   1.504
  440    H    VAL  61           HN       VAL  61  13.153  10.931  -3.341
  441    HA   VAL  61           HA       VAL  61  11.065  10.434  -5.309
  442    HB   VAL  61           HB       VAL  61  13.859  11.495  -5.783
  443   HG11  VAL  61          HG11      VAL  61  12.924  12.436  -7.827
  444   HG12  VAL  61          HG12      VAL  61  11.351  11.739  -7.441
  445   HG13  VAL  61          HG13      VAL  61  12.722  10.684  -7.789
  446   HG21  VAL  61          HG21      VAL  61  12.899  13.742  -5.699
  447   HG22  VAL  61          HG22      VAL  61  12.700  12.906  -4.158
  448   HG23  VAL  61          HG23      VAL  61  11.332  13.060  -5.261
  449    H    LYS  62           HN       LYS  62  11.534   9.125  -7.217
  450    HA   LYS  62           HA       LYS  62  12.692   6.637  -6.576
  451    HB2  LYS  62           HB2      LYS  62  11.659   7.776  -9.157
  452    HB3  LYS  62           HB1      LYS  62  12.382   6.175  -9.063
  453    HG2  LYS  62           HG2      LYS  62  10.689   5.682  -7.242
  454    HG3  LYS  62           HG1      LYS  62   9.878   7.165  -7.752
  455    HD2  LYS  62           HD2      LYS  62   9.661   6.306 -10.001
  456    HD3  LYS  62           HD1      LYS  62  10.539   4.848  -9.554
  457    HE2  LYS  62           HE2      LYS  62   8.751   4.364  -7.889
  458    HE3  LYS  62           HE1      LYS  62   7.846   5.735  -8.535
  459    HZ1  LYS  62           HZ1      LYS  62   7.065   3.758  -9.575
  460    HZ2  LYS  62           HZ2      LYS  62   8.629   3.265  -9.987
  461    HZ3  LYS  62           HZ3      LYS  62   7.944   4.623 -10.733
  462    H    GLY  63           HN       GLY  63  14.757   6.358  -6.309
  463    HA2  GLY  63           HA2      GLY  63  16.820   6.214  -7.841
  464    HA3  GLY  63           HA1      GLY  63  16.649   7.964  -7.862
  465    H    GLN  64           HN       GLN  64  15.618   7.960  -5.083
  466    HA   GLN  64           HA       GLN  64  18.186   8.147  -3.801
  467    HB2  GLN  64           HB2      GLN  64  15.719   8.107  -2.132
  468    HB3  GLN  64           HB1      GLN  64  17.142   9.146  -2.027
  469    HG2  GLN  64           HG2      GLN  64  14.961   9.395  -4.086
  470    HG3  GLN  64           HG1      GLN  64  15.079  10.337  -2.608
  471   HE21  GLN  64          HE21      GLN  64  17.810   9.517  -4.676
  472   HE22  GLN  64          HE22      GLN  64  18.142  11.153  -5.161
  473    H    VAL  65           HN       VAL  65  19.122   6.767  -2.376
  474    HA   VAL  65           HA       VAL  65  17.995   4.104  -2.155
  475    HB   VAL  65           HB       VAL  65  20.613   5.276  -1.209
  476   HG11  VAL  65          HG11      VAL  65  21.283   3.027  -0.597
  477   HG12  VAL  65          HG12      VAL  65  19.683   2.418  -1.022
  478   HG13  VAL  65          HG13      VAL  65  19.875   3.526   0.340
  479   HG21  VAL  65          HG21      VAL  65  19.964   3.295  -3.380
  480   HG22  VAL  65          HG22      VAL  65  21.586   3.806  -2.909
  481   HG23  VAL  65          HG23      VAL  65  20.459   4.969  -3.614
  482    H    VAL  66           HN       VAL  66  16.877   3.411  -0.430
  483    HA   VAL  66           HA       VAL  66  16.753   5.190   1.892
  484    HB   VAL  66           HB       VAL  66  14.336   4.882   2.009
  485   HG11  VAL  66          HG11      VAL  66  13.727   6.258   0.025
  486   HG12  VAL  66          HG12      VAL  66  15.356   5.994  -0.602
  487   HG13  VAL  66          HG13      VAL  66  15.124   6.866   0.912
  488   HG21  VAL  66          HG21      VAL  66  14.268   2.711   0.805
  489   HG22  VAL  66          HG22      VAL  66  14.576   3.580  -0.701
  490   HG23  VAL  66          HG23      VAL  66  13.093   3.878   0.204
  491    H    THR  67           HN       THR  67  16.363   4.302   3.872
  492    HA   THR  67           HA       THR  67  16.550   1.387   4.051
  493    HB   THR  67           HB       THR  67  16.795   1.752   6.507
  494    HG1  THR  67           HG1      THR  67  17.463   4.159   6.845
  495   HG21  THR  67          HG21      THR  67  18.790   1.532   5.135
  496   HG22  THR  67          HG22      THR  67  19.044   2.656   6.472
  497   HG23  THR  67          HG23      THR  67  18.784   3.272   4.837
  498    H    VAL  68           HN       VAL  68  14.627   0.383   3.987
  499    HA   VAL  68           HA       VAL  68  12.512   1.568   5.639
  500    HB   VAL  68           HB       VAL  68  10.919   0.055   4.481
  501   HG11  VAL  68          HG11      VAL  68  12.475   1.899   2.669
  502   HG12  VAL  68          HG12      VAL  68  11.180   2.375   3.768
  503   HG13  VAL  68          HG13      VAL  68  10.829   1.327   2.393
  504   HG21  VAL  68          HG21      VAL  68  12.409  -1.687   3.740
  505   HG22  VAL  68          HG22      VAL  68  13.302  -0.548   2.732
  506   HG23  VAL  68          HG23      VAL  68  11.633  -0.959   2.332
  507    H    HIS  69           HN       HIS  69  11.658   0.420   7.313
  508    HA   HIS  69           HA       HIS  69  12.865  -2.222   7.813
  509    HB2  HIS  69           HB2      HIS  69  13.013  -0.764   9.782
  510    HB3  HIS  69           HB1      HIS  69  11.294  -0.396   9.679
  511    HD1  HIS  69           HD1      HIS  69  12.681  -1.786  12.238
  512    HD2  HIS  69           HD2      HIS  69  10.549  -3.687   9.227
  513    HE1  HIS  69           HE1      HIS  69  11.816  -3.956  13.218
  514    HE2  HIS  69           HE2      HIS  69  10.412  -4.965  11.456
  515    H    LEU  70           HN       LEU  70  11.682  -3.827   6.966
  516    HA   LEU  70           HA       LEU  70   8.794  -3.412   7.029
  517    HB2  LEU  70           HB2      LEU  70   8.444  -4.099   4.937
  518    HB3  LEU  70           HB1      LEU  70  10.071  -3.490   4.717
  519    HG   LEU  70           HG       LEU  70   9.457  -6.379   5.267
  520   HD11  LEU  70          HD11      LEU  70   9.834  -4.972   2.622
  521   HD12  LEU  70          HD12      LEU  70   8.342  -5.705   3.211
  522   HD13  LEU  70          HD13      LEU  70   9.738  -6.721   2.842
  523   HD21  LEU  70          HD21      LEU  70  11.885  -4.982   4.139
  524   HD22  LEU  70          HD22      LEU  70  11.690  -6.728   4.314
  525   HD23  LEU  70          HD23      LEU  70  11.744  -5.700   5.746
  526    H    GLN  71           HN       GLN  71   7.648  -4.791   7.959
  527    HA   GLN  71           HA       GLN  71   8.557  -7.571   8.162
  528    HB2  GLN  71           HB2      GLN  71   6.637  -6.630  10.189
  529    HB3  GLN  71           HB1      GLN  71   7.922  -7.816  10.350
  530    HG2  GLN  71           HG2      GLN  71   8.778  -6.238  11.690
  531    HG3  GLN  71           HG1      GLN  71   9.432  -5.664  10.160
  532   HE21  GLN  71          HE21      GLN  71   6.692  -4.820   9.347
  533   HE22  GLN  71          HE22      GLN  71   6.470  -3.314  10.159
  534    H    THR  72           HN       THR  72   7.274  -8.711   7.017
  535    HA   THR  72           HA       THR  72   4.863  -7.391   6.036
  536    HB   THR  72           HB       THR  72   6.611  -9.468   4.738
  537    HG1  THR  72           HG1      THR  72   7.540  -7.783   3.691
  538   HG21  THR  72          HG21      THR  72   4.307  -7.859   3.664
  539   HG22  THR  72          HG22      THR  72   4.291  -9.587   4.017
  540   HG23  THR  72          HG23      THR  72   5.316  -8.960   2.725
  541    H    SER  73           HN       SER  73   2.980  -8.264   6.373
  542    HA   SER  73           HA       SER  73   2.866 -10.986   7.469
  543    HB2  SER  73           HB2      SER  73   2.028  -8.936   8.802
  544    HB3  SER  73           HB1      SER  73   0.724  -8.851   7.624
  545    HG   SER  73           HG       SER  73  -0.204 -10.173   8.956
  546    H    LEU  74           HN       LEU  74   1.114 -12.298   6.799
  547    HA   LEU  74           HA       LEU  74   0.432 -11.983   4.011
  548    HB2  LEU  74           HB2      LEU  74  -0.061 -14.148   6.025
  549    HB3  LEU  74           HB1      LEU  74  -0.708 -14.207   4.401
  550    HG   LEU  74           HG       LEU  74   2.092 -14.520   5.343
  551   HD11  LEU  74          HD11      LEU  74   2.088 -16.363   3.774
  552   HD12  LEU  74          HD12      LEU  74   0.476 -15.908   3.229
  553   HD13  LEU  74          HD13      LEU  74   0.718 -16.475   4.880
  554   HD21  LEU  74          HD21      LEU  74   2.945 -14.148   3.076
  555   HD22  LEU  74          HD22      LEU  74   2.274 -12.676   3.781
  556   HD23  LEU  74          HD23      LEU  74   1.350 -13.582   2.580
  557    H    GLU  75           HN       GLU  75  -1.763 -12.391   3.292
  558    HA   GLU  75           HA       GLU  75  -3.740 -10.746   4.237
  559    HB2  GLU  75           HB2      GLU  75  -5.314 -12.222   3.000
  560    HB3  GLU  75           HB1      GLU  75  -3.881 -11.804   2.074
  561    HG2  GLU  75           HG2      GLU  75  -4.161 -14.395   3.578
  562    HG3  GLU  75           HG1      GLU  75  -4.671 -14.196   1.903
  563    H    ASN  76           HN       ASN  76  -2.741 -13.803   5.503
  564    HA   ASN  76           HA       ASN  76  -5.154 -14.165   7.099
  565    HB2  ASN  76           HB2      ASN  76  -2.681 -15.899   7.045
  566    HB3  ASN  76           HB1      ASN  76  -4.263 -16.325   7.687
  567   HD21  ASN  76          HD21      ASN  76  -2.311 -15.988   4.887
  568   HD22  ASN  76          HD22      ASN  76  -3.416 -16.658   3.749
  569    H    GLY  77           HN       GLY  77  -2.200 -12.579   7.401
  570    HA2  GLY  77           HA2      GLY  77  -1.636 -11.334   9.347
  571    HA3  GLY  77           HA1      GLY  77  -2.537 -12.490  10.318
  572    H    THR  78           HN       THR  78  -0.449 -13.809   7.955
  573    HA   THR  78           HA       THR  78   1.391 -14.673  10.049
  574    HB   THR  78           HB       THR  78   1.348 -15.563   7.160
  575    HG1  THR  78           HG1      THR  78  -0.089 -17.128   7.715
  576   HG21  THR  78          HG21      THR  78   3.398 -16.101   8.368
  577   HG22  THR  78          HG22      THR  78   2.473 -17.566   8.043
  578   HG23  THR  78          HG23      THR  78   2.460 -16.853   9.657
  579    H    ARG  79           HN       ARG  79   3.020 -13.303  10.421
  580    HA   ARG  79           HA       ARG  79   4.088 -11.663   8.329
  581    HB2  ARG  79           HB2      ARG  79   4.920 -12.106  11.188
  582    HB3  ARG  79           HB1      ARG  79   5.802 -11.048  10.087
  583    HG2  ARG  79           HG2      ARG  79   3.257 -10.186   9.731
  584    HG3  ARG  79           HG1      ARG  79   3.231 -10.654  11.434
  585    HD2  ARG  79           HD2      ARG  79   5.086  -9.232  11.921
  586    HD3  ARG  79           HD1      ARG  79   5.331  -8.875  10.208
  587    HE   ARG  79           HE       ARG  79   2.765  -8.050  10.768
  588   HH11  ARG  79          HH11      ARG  79   5.904  -7.319  12.136
  589   HH12  ARG  79          HH12      ARG  79   5.519  -5.658  12.450
  590   HH21  ARG  79          HH21      ARG  79   2.249  -5.857  11.208
  591   HH22  ARG  79          HH22      ARG  79   3.449  -4.822  11.923
  592    H    VAL  80           HN       VAL  80   5.308 -12.353   6.841
  593    HA   VAL  80           HA       VAL  80   6.580 -14.953   7.138
  594    HB   VAL  80           HB       VAL  80   6.719 -14.877   4.664
  595   HG11  VAL  80          HG11      VAL  80   3.985 -14.394   5.821
  596   HG12  VAL  80          HG12      VAL  80   4.846 -15.934   5.810
  597   HG13  VAL  80          HG13      VAL  80   4.330 -15.199   4.291
  598   HG21  VAL  80          HG21      VAL  80   5.486 -13.149   3.442
  599   HG22  VAL  80          HG22      VAL  80   6.813 -12.449   4.372
  600   HG23  VAL  80          HG23      VAL  80   5.157 -12.316   4.963
  601    H    GLN  81           HN       GLN  81   7.434 -11.741   7.270
  602    HA   GLN  81           HA       GLN  81  10.232 -12.353   7.154
  603    HB2  GLN  81           HB2      GLN  81  10.752 -10.676   5.394
  604    HB3  GLN  81           HB1      GLN  81   9.851 -12.051   4.778
  605    HG2  GLN  81           HG2      GLN  81   7.792 -10.726   4.837
  606    HG3  GLN  81           HG1      GLN  81   8.714  -9.339   5.420
  607   HE21  GLN  81          HE21      GLN  81   7.905 -11.337   2.749
  608   HE22  GLN  81          HE22      GLN  81   8.643 -10.369   1.521
  609    H    GLU  82           HN       GLU  82  11.494 -10.719   8.114
  610    HA   GLU  82           HA       GLU  82  10.228  -8.254   8.920
  611    HB2  GLU  82           HB2      GLU  82   9.459  -9.699  10.713
  612    HB3  GLU  82           HB1      GLU  82  11.092 -10.289  10.979
  613    HG2  GLU  82           HG2      GLU  82  11.814  -8.190  11.818
  614    HG3  GLU  82           HG1      GLU  82  10.316  -7.417  11.308
  615    H    GLU  83           HN       GLU  83  11.723  -6.933   8.185
  616    HA   GLU  83           HA       GLU  83  14.528  -7.444   8.930
  617    HB2  GLU  83           HB2      GLU  83  13.760  -5.939   6.448
  618    HB3  GLU  83           HB1      GLU  83  15.269  -6.754   6.815
  619    HG2  GLU  83           HG2      GLU  83  12.649  -8.101   6.197
  620    HG3  GLU  83           HG1      GLU  83  13.995  -7.894   5.075
  621    HA   PRO  84           HA       PRO  84  13.869  -3.482  10.913
  622    HB2  PRO  84           HB2      PRO  84  16.450  -3.229  11.806
  623    HB3  PRO  84           HB1      PRO  84  15.206  -4.163  12.643
  624    HG2  PRO  84           HG2      PRO  84  17.368  -5.106  10.800
  625    HG3  PRO  84           HG1      PRO  84  16.792  -5.827  12.314
  626    HD2  PRO  84           HD2      PRO  84  16.050  -6.791   9.915
  627    HD3  PRO  84           HD1      PRO  84  14.943  -6.785  11.303
  628    H    GLU  85           HN       GLU  85  16.017  -4.301   8.366
  629    HA   GLU  85           HA       GLU  85  16.011  -1.609   7.399
  630    HB2  GLU  85           HB2      GLU  85  17.859  -1.491   9.013
  631    HB3  GLU  85           HB1      GLU  85  18.646  -2.845   8.221
  632    HG2  GLU  85           HG2      GLU  85  18.850  -1.490   6.172
  633    HG3  GLU  85           HG1      GLU  85  18.141  -0.125   7.038
  634    H    LEU  86           HN       LEU  86  15.280  -2.082   5.569
  635    HA   LEU  86           HA       LEU  86  16.864  -3.765   3.764
  636    HB2  LEU  86           HB2      LEU  86  14.588  -4.577   3.922
  637    HB3  LEU  86           HB1      LEU  86  13.952  -2.959   3.727
  638    HG   LEU  86           HG       LEU  86  14.893  -2.915   1.443
  639   HD11  LEU  86          HD11      LEU  86  15.404  -5.844   1.945
  640   HD12  LEU  86          HD12      LEU  86  16.629  -4.597   1.725
  641   HD13  LEU  86          HD13      LEU  86  15.556  -5.019   0.393
  642   HD21  LEU  86          HD21      LEU  86  12.931  -5.123   2.049
  643   HD22  LEU  86          HD22      LEU  86  13.168  -4.368   0.472
  644   HD23  LEU  86          HD23      LEU  86  12.551  -3.413   1.821
  645    H    VAL  87           HN       VAL  87  18.179  -2.473   2.616
  646    HA   VAL  87           HA       VAL  87  17.248   0.252   2.025
  647    HB   VAL  87           HB       VAL  87  19.308  -0.036   3.462
  648   HG11  VAL  87          HG11      VAL  87  20.526  -0.966   0.877
  649   HG12  VAL  87          HG12      VAL  87  20.376  -1.890   2.372
  650   HG13  VAL  87          HG13      VAL  87  21.435  -0.482   2.306
  651   HG21  VAL  87          HG21      VAL  87  19.583   1.499   0.894
  652   HG22  VAL  87          HG22      VAL  87  20.565   1.745   2.339
  653   HG23  VAL  87          HG23      VAL  87  18.829   2.057   2.387
  654    H    PHE  88           HN       PHE  88  17.061   0.893  -0.057
  655    HA   PHE  88           HA       PHE  88  18.199  -0.660  -2.233
  656    HB2  PHE  88           HB2      PHE  88  16.100  -1.283  -3.233
  657    HB3  PHE  88           HB1      PHE  88  16.166  -1.934  -1.603
  658    HD1  PHE  88           HD2      PHE  88  14.912  -0.694   0.227
  659    HD2  PHE  88           HD1      PHE  88  14.336   0.081  -3.917
  660    HE1  PHE  88           HE2      PHE  88  12.744   0.344   0.730
  661    HE2  PHE  88           HE1      PHE  88  12.164   1.114  -3.425
  662    HZ   PHE  88           HZ       PHE  88  11.347   1.234  -1.114
  663    H    THR  89           HN       THR  89  17.720   0.279  -4.332
  664    HA   THR  89           HA       THR  89  17.532   3.170  -4.252
  665    HB   THR  89           HB       THR  89  17.648   1.384  -6.694
  666    HG1  THR  89           HG1      THR  89  19.397   0.886  -5.282
  667   HG21  THR  89          HG21      THR  89  18.690   3.328  -7.739
  668   HG22  THR  89          HG22      THR  89  18.590   4.219  -6.220
  669   HG23  THR  89          HG23      THR  89  17.114   3.767  -7.074
  670    H    LEU  90           HN       LEU  90  15.608   4.157  -4.241
  671    HA   LEU  90           HA       LEU  90  13.145   2.897  -4.691
  672    HB2  LEU  90           HB2      LEU  90  13.662   5.083  -3.463
  673    HB3  LEU  90           HB1      LEU  90  13.612   5.840  -5.022
  674    HG   LEU  90           HG       LEU  90  11.321   5.224  -5.349
  675   HD11  LEU  90          HD11      LEU  90  11.468   3.866  -2.663
  676   HD12  LEU  90          HD12      LEU  90  11.483   3.031  -4.215
  677   HD13  LEU  90          HD13      LEU  90  10.067   3.962  -3.730
  678   HD21  LEU  90          HD21      LEU  90  11.904   7.248  -3.983
  679   HD22  LEU  90          HD22      LEU  90  11.606   6.278  -2.540
  680   HD23  LEU  90          HD23      LEU  90  10.300   6.587  -3.682
  681    H    GLY  91           HN       GLY  91  11.877   2.644  -6.458
  682    HA2  GLY  91           HA2      GLY  91  11.063   2.994  -8.605
  683    HA3  GLY  91           HA1      GLY  91  12.321   4.194  -8.861
  684    H    ASP  92           HN       ASP  92  13.938   1.697  -7.641
  685    HA   ASP  92           HA       ASP  92  14.909   0.985 -10.283
  686    HB2  ASP  92           HB2      ASP  92  16.528   1.663  -8.555
  687    HB3  ASP  92           HB1      ASP  92  16.005   0.321  -7.541
  688    H    CYS  93           HN       CYS  93  12.699  -0.119  -8.105
  689    HA   CYS  93           HA       CYS  93  11.510  -2.038  -7.879
  690    HB2  CYS  93           HB2      CYS  93  12.723  -3.011 -10.457
  691    HB3  CYS  93           HB1      CYS  93  11.125  -3.345  -9.797
  692    HG   CYS  93           HG       CYS  93  11.784  -0.117 -10.525
  693    H    ASP  94           HN       ASP  94  14.234  -1.808  -6.865
  694    HA   ASP  94           HA       ASP  94  15.570  -4.287  -7.199
  695    HB2  ASP  94           HB2      ASP  94  16.715  -2.234  -6.388
  696    HB3  ASP  94           HB1      ASP  94  15.763  -2.321  -4.908
  697    H    VAL  95           HN       VAL  95  12.925  -3.175  -5.521
  698    HA   VAL  95           HA       VAL  95  12.771  -5.495  -3.709
  699    HB   VAL  95           HB       VAL  95  11.097  -4.029  -2.491
  700   HG11  VAL  95          HG11      VAL  95  12.853  -2.629  -1.454
  701   HG12  VAL  95          HG12      VAL  95  13.938  -3.079  -2.769
  702   HG13  VAL  95          HG13      VAL  95  13.343  -4.310  -1.657
  703   HG21  VAL  95          HG21      VAL  95  11.271  -1.597  -2.950
  704   HG22  VAL  95          HG22      VAL  95  10.576  -2.501  -4.296
  705   HG23  VAL  95          HG23      VAL  95  12.260  -1.967  -4.370
  706    H    ILE  96           HN       ILE  96  10.006  -5.137  -3.143
  707    HA   ILE  96           HA       ILE  96   8.808  -6.238  -5.507
  708    HB   ILE  96           HB       ILE  96   6.766  -6.414  -4.154
  709   HG12  ILE  96          HG12      ILE  96   8.389  -5.136  -1.934
  710   HG13  ILE  96          HG11      ILE  96   7.067  -4.355  -2.797
  711   HG21  ILE  96          HG21      ILE  96   7.614  -8.007  -2.490
  712   HG22  ILE  96          HG22      ILE  96   9.245  -7.390  -2.745
  713   HG23  ILE  96          HG23      ILE  96   8.395  -8.203  -4.057
  714   HD11  ILE  96          HD11      ILE  96   6.377  -5.200  -0.612
  715   HD12  ILE  96          HD12      ILE  96   6.820  -6.835  -1.107
  716   HD13  ILE  96          HD13      ILE  96   5.507  -5.990  -1.927
  717    H    GLN  97           HN       GLN  97   7.298  -5.197  -6.755
  718    HA   GLN  97           HA       GLN  97   7.819  -2.474  -7.149
  719    HB2  GLN  97           HB2      GLN  97   6.856  -4.234  -8.804
  720    HB3  GLN  97           HB1      GLN  97   5.292  -3.698  -8.195
  721    HG2  GLN  97           HG2      GLN  97   5.678  -2.399 -10.100
  722    HG3  GLN  97           HG1      GLN  97   6.060  -1.340  -8.743
  723   HE21  GLN  97          HE21      GLN  97   8.327  -0.928  -8.262
  724   HE22  GLN  97          HE22      GLN  97   9.506  -1.111  -9.513
  725    H    ALA  98           HN       ALA  98   5.290  -4.087  -5.347
  726    HA   ALA  98           HA       ALA  98   3.551  -1.988  -4.796
  727    HB1  ALA  98           HB1      ALA  98   3.195  -4.290  -4.042
  728    HB2  ALA  98           HB2      ALA  98   3.058  -3.151  -2.709
  729    HB3  ALA  98           HB3      ALA  98   4.518  -4.122  -2.891
  730    H    LEU  99           HN       LEU  99   6.512  -2.920  -3.163
  731    HA   LEU  99           HA       LEU  99   6.408  -0.837  -1.215
  732    HB2  LEU  99           HB2      LEU  99   7.657  -2.916  -0.819
  733    HB3  LEU  99           HB1      LEU  99   8.763  -2.479  -2.115
  734    HG   LEU  99           HG       LEU  99   9.470  -0.486  -0.831
  735   HD11  LEU  99          HD11      LEU  99   7.412  -0.123   0.431
  736   HD12  LEU  99          HD12      LEU  99   8.813  -0.228   1.497
  737   HD13  LEU  99          HD13      LEU  99   7.713  -1.597   1.351
  738   HD21  LEU  99          HD21      LEU  99  10.750  -1.631   0.863
  739   HD22  LEU  99          HD22      LEU  99  10.709  -2.590  -0.619
  740   HD23  LEU  99          HD23      LEU  99   9.693  -3.039   0.753
  741    H    ASP 100           HN       ASP 100   7.998  -1.300  -4.272
  742    HA   ASP 100           HA       ASP 100   9.797   0.844  -4.171
  743    HB2  ASP 100           HB2      ASP 100   9.918  -1.075  -5.738
  744    HB3  ASP 100           HB1      ASP 100   8.503  -0.464  -6.573
  745    H    LEU 101           HN       LEU 101   6.429   0.606  -4.987
  746    HA   LEU 101           HA       LEU 101   6.278   3.354  -5.883
  747    HB2  LEU 101           HB2      LEU 101   4.124   1.293  -5.454
  748    HB3  LEU 101           HB1      LEU 101   3.922   2.836  -6.235
  749    HG   LEU 101           HG       LEU 101   5.605   0.557  -7.260
  750   HD11  LEU 101          HD11      LEU 101   2.989   1.674  -8.248
  751   HD12  LEU 101          HD12      LEU 101   3.217   0.129  -7.431
  752   HD13  LEU 101          HD13      LEU 101   3.928   0.396  -9.023
  753   HD21  LEU 101          HD21      LEU 101   5.010   3.242  -8.500
  754   HD22  LEU 101          HD22      LEU 101   5.884   1.920  -9.273
  755   HD23  LEU 101          HD23      LEU 101   6.567   2.719  -7.857
  756    H    SER 102           HN       SER 102   5.522   1.460  -3.025
  757    HA   SER 102           HA       SER 102   3.701   3.338  -1.924
  758    HB2  SER 102           HB2      SER 102   3.879   1.987   0.139
  759    HB3  SER 102           HB1      SER 102   3.591   0.989  -1.285
  760    HG   SER 102           HG       SER 102   6.214   1.228  -0.995
  761    H    VAL 103           HN       VAL 103   7.117   3.034  -1.929
  762    HA   VAL 103           HA       VAL 103   7.660   4.484   0.445
  763    HB   VAL 103           HB       VAL 103   9.350   3.746  -1.904
  764   HG11  VAL 103          HG11      VAL 103  10.233   5.063   0.677
  765   HG12  VAL 103          HG12      VAL 103  10.246   5.812  -0.919
  766   HG13  VAL 103          HG13      VAL 103  11.306   4.446  -0.578
  767   HG21  VAL 103          HG21      VAL 103   8.930   2.678   0.854
  768   HG22  VAL 103          HG22      VAL 103  10.423   2.348  -0.015
  769   HG23  VAL 103          HG23      VAL 103   8.876   1.827  -0.690
  770    HA   PRO 104           HA       PRO 104   8.427   8.258  -2.491
  771    HB2  PRO 104           HB2      PRO 104   7.147   8.119  -4.907
  772    HB3  PRO 104           HB1      PRO 104   8.850   7.716  -4.667
  773    HG2  PRO 104           HG2      PRO 104   6.482   5.888  -4.828
  774    HG3  PRO 104           HG1      PRO 104   8.089   5.710  -5.551
  775    HD2  PRO 104           HD2      PRO 104   7.417   4.391  -3.328
  776    HD3  PRO 104           HD1      PRO 104   9.054   5.022  -3.578
  777    H    LEU 105           HN       LEU 105   5.511   6.341  -2.466
  778    HA   LEU 105           HA       LEU 105   3.753   8.614  -2.180
  779    HB2  LEU 105           HB2      LEU 105   3.468   5.651  -1.804
  780    HB3  LEU 105           HB1      LEU 105   2.179   6.754  -1.330
  781    HG   LEU 105           HG       LEU 105   3.246   6.231  -4.090
  782   HD11  LEU 105          HD11      LEU 105   0.502   6.009  -2.872
  783   HD12  LEU 105          HD12      LEU 105   1.584   4.674  -3.272
  784   HD13  LEU 105          HD13      LEU 105   0.913   5.678  -4.556
  785   HD21  LEU 105          HD21      LEU 105   1.342   8.413  -3.243
  786   HD22  LEU 105          HD22      LEU 105   1.739   7.975  -4.906
  787   HD23  LEU 105          HD23      LEU 105   2.982   8.644  -3.849
  788    H    MET 106           HN       MET 106   5.825   6.827  -0.205
  789    HA   MET 106           HA       MET 106   4.576   7.518   2.315
  790    HB2  MET 106           HB2      MET 106   5.491   5.337   2.198
  791    HB3  MET 106           HB1      MET 106   6.981   5.915   1.478
  792    HG2  MET 106           HG2      MET 106   7.590   6.962   3.597
  793    HG3  MET 106           HG1      MET 106   6.091   6.353   4.312
  794    HE1  MET 106           HE1      MET 106   5.544   3.698   4.485
  795    HE2  MET 106           HE2      MET 106   6.667   2.455   3.932
  796    HE3  MET 106           HE3      MET 106   5.918   3.539   2.765
  797    H    ASP 107           HN       ASP 107   5.518   8.833   3.882
  798    HA   ASP 107           HA       ASP 107   7.379  10.849   2.863
  799    HB2  ASP 107           HB2      ASP 107   5.337  10.723   4.991
  800    HB3  ASP 107           HB1      ASP 107   6.797  11.607   5.425
  801    H    VAL 108           HN       VAL 108   9.386  11.292   3.861
  802    HA   VAL 108           HA       VAL 108  10.767   9.142   5.000
  803    HB   VAL 108           HB       VAL 108  11.353  12.056   4.743
  804   HG11  VAL 108          HG11      VAL 108  13.513  11.768   5.876
  805   HG12  VAL 108          HG12      VAL 108  13.031  10.146   6.373
  806   HG13  VAL 108          HG13      VAL 108  12.159  11.553   6.988
  807   HG21  VAL 108          HG21      VAL 108  13.281  11.200   3.506
  808   HG22  VAL 108          HG22      VAL 108  11.771  10.532   2.888
  809   HG23  VAL 108          HG23      VAL 108  12.813   9.549   3.918
  810    H    GLY 109           HN       GLY 109  10.634   8.281   6.927
  811    HA2  GLY 109           HA2      GLY 109  10.991   8.439   9.283
  812    HA3  GLY 109           HA1      GLY 109  10.297  10.052   9.247
  813    H    GLU 110           HN       GLU 110   8.389   8.034   7.385
  814    HA   GLU 110           HA       GLU 110   6.522   7.772   9.615
  815    HB2  GLU 110           HB2      GLU 110   4.743   7.748   8.108
  816    HB3  GLU 110           HB1      GLU 110   5.841   8.943   7.432
  817    HG2  GLU 110           HG2      GLU 110   6.443   7.569   5.683
  818    HG3  GLU 110           HG1      GLU 110   5.912   6.113   6.514
  819    H    THR 111           HN       THR 111   5.075   5.836   9.516
  820    HA   THR 111           HA       THR 111   6.448   3.470   8.478
  821    HB   THR 111           HB       THR 111   4.862   3.469  11.054
  822    HG1  THR 111           HG1      THR 111   7.267   4.496  10.692
  823   HG21  THR 111          HG21      THR 111   5.974   1.302  11.391
  824   HG22  THR 111          HG22      THR 111   6.784   1.480   9.836
  825   HG23  THR 111          HG23      THR 111   5.028   1.315   9.902
  826    H    ALA 112           HN       ALA 112   5.191   2.584   7.008
  827    HA   ALA 112           HA       ALA 112   2.312   3.178   7.129
  828    HB1  ALA 112           HB1      ALA 112   3.992   2.780   4.674
  829    HB2  ALA 112           HB2      ALA 112   3.495   4.344   5.323
  830    HB3  ALA 112           HB3      ALA 112   2.281   3.205   4.728
  831    H    MET 113           HN       MET 113   0.920   1.532   6.902
  832    HA   MET 113           HA       MET 113   2.044  -1.148   6.466
  833    HB2  MET 113           HB2      MET 113   0.613  -1.106   8.376
  834    HB3  MET 113           HB1      MET 113  -0.607  -0.161   7.533
  835    HG2  MET 113           HG2      MET 113  -1.133  -2.047   6.113
  836    HG3  MET 113           HG1      MET 113   0.145  -2.996   6.872
  837    HE1  MET 113           HE1      MET 113  -0.011  -4.172   9.120
  838    HE2  MET 113           HE2      MET 113  -1.155  -3.730  10.390
  839    HE3  MET 113           HE3      MET 113   0.045  -2.561   9.837
  840    H    VAL 114           HN       VAL 114   1.999  -1.832   4.425
  841    HA   VAL 114           HA       VAL 114   0.006  -0.618   2.621
  842    HB   VAL 114           HB       VAL 114   2.578  -1.928   1.779
  843   HG11  VAL 114          HG11      VAL 114   2.282  -0.694  -0.290
  844   HG12  VAL 114          HG12      VAL 114   0.814   0.046   0.354
  845   HG13  VAL 114          HG13      VAL 114   0.866  -1.693   0.052
  846   HG21  VAL 114          HG21      VAL 114   2.138   0.996   2.276
  847   HG22  VAL 114          HG22      VAL 114   3.603   0.257   1.633
  848   HG23  VAL 114          HG23      VAL 114   3.096  -0.082   3.287
  849    H    THR 115           HN       THR 115  -1.408  -1.972   1.677
  850    HA   THR 115           HA       THR 115  -0.669  -4.809   1.784
  851    HB   THR 115           HB       THR 115  -3.484  -3.731   1.808
  852    HG1  THR 115           HG1      THR 115  -1.669  -4.070   3.778
  853   HG21  THR 115          HG21      THR 115  -3.124  -5.938   0.738
  854   HG22  THR 115          HG22      THR 115  -4.116  -6.015   2.195
  855   HG23  THR 115          HG23      THR 115  -2.419  -6.504   2.257
  856    H    ALA 116           HN       ALA 116  -0.132  -5.510   0.041
  857    HA   ALA 116           HA       ALA 116  -1.280  -4.527  -2.506
  858    HB1  ALA 116           HB1      ALA 116   1.585  -5.276  -1.977
  859    HB2  ALA 116           HB2      ALA 116   0.970  -3.629  -2.128
  860    HB3  ALA 116           HB3      ALA 116   0.900  -4.726  -3.507
  861    H    ASP 117           HN       ASP 117  -1.878  -6.091  -3.913
  862    HA   ASP 117           HA       ASP 117  -2.118  -8.764  -3.237
  863    HB2  ASP 117           HB2      ASP 117  -3.113  -7.507  -5.265
  864    HB3  ASP 117           HB1      ASP 117  -1.590  -7.887  -6.040
  865    H    SER 118           HN       SER 118  -0.895 -10.609  -3.770
  866    HA   SER 118           HA       SER 118   1.842 -10.486  -3.390
  867    HB2  SER 118           HB2      SER 118   0.151 -12.495  -3.313
  868    HB3  SER 118           HB1      SER 118   0.634 -12.717  -4.996
  869    HG   SER 118           HG       SER 118   1.860 -13.844  -3.217
  870    H    LYS 119           HN       LYS 119  -0.018 -10.281  -6.347
  871    HA   LYS 119           HA       LYS 119   1.985 -10.637  -8.232
  872    HB2  LYS 119           HB2      LYS 119   0.620  -9.031  -9.635
  873    HB3  LYS 119           HB1      LYS 119  -0.225 -10.449  -9.020
  874    HG2  LYS 119           HG2      LYS 119  -1.255  -9.102  -7.299
  875    HG3  LYS 119           HG1      LYS 119  -0.304  -7.701  -7.802
  876    HD2  LYS 119           HD2      LYS 119  -2.570  -7.564  -8.689
  877    HD3  LYS 119           HD1      LYS 119  -1.398  -7.739  -9.998
  878    HE2  LYS 119           HE2      LYS 119  -1.885 -10.217  -9.936
  879    HE3  LYS 119           HE1      LYS 119  -3.225  -9.843  -8.855
  880    HZ1  LYS 119           HZ1      LYS 119  -3.869 -10.042 -11.226
  881    HZ2  LYS 119           HZ2      LYS 119  -2.924  -8.673 -11.570
  882    HZ3  LYS 119           HZ3      LYS 119  -4.269  -8.535 -10.548
  883    H    TYR 120           HN       TYR 120   1.372  -7.857  -6.139
  884    HA   TYR 120           HA       TYR 120   3.523  -6.362  -7.451
  885    HB2  TYR 120           HB2      TYR 120   1.761  -5.579  -5.120
  886    HB3  TYR 120           HB1      TYR 120   2.889  -4.524  -5.964
  887    HD1  TYR 120           HD1      TYR 120   2.381  -3.664  -8.142
  888    HD2  TYR 120           HD2      TYR 120  -0.344  -6.186  -6.090
  889    HE1  TYR 120           HE1      TYR 120   0.598  -3.033  -9.736
  890    HE2  TYR 120           HE2      TYR 120  -2.138  -5.581  -7.651
  891    HH   TYR 120           HH       TYR 120  -2.713  -3.807  -9.200
  892    H    CYS 121           HN       CYS 121   3.376  -8.783  -5.409
  893    HA   CYS 121           HA       CYS 121   5.550  -7.804  -3.696
  894    HB2  CYS 121           HB2      CYS 121   3.350  -9.727  -2.920
  895    HB3  CYS 121           HB1      CYS 121   4.663  -9.179  -1.879
  896    HG   CYS 121           HG       CYS 121   1.782  -7.670  -2.654
  897    H    TYR 122           HN       TYR 122   4.286 -11.107  -3.639
  898    HA   TYR 122           HA       TYR 122   6.521 -11.956  -5.336
  899    HB2  TYR 122           HB2      TYR 122   5.966 -13.443  -2.780
  900    HB3  TYR 122           HB1      TYR 122   7.357 -13.532  -3.829
  901    HD1  TYR 122           HD2      TYR 122   9.139 -11.892  -3.729
  902    HD2  TYR 122           HD1      TYR 122   5.798 -11.632  -1.096
  903    HE1  TYR 122           HE2      TYR 122  10.384 -10.323  -2.306
  904    HE2  TYR 122           HE1      TYR 122   7.033 -10.062   0.317
  905    HH   TYR 122           HH       TYR 122   9.907  -8.568  -0.649
  906    H    GLY 123           HN       GLY 123   3.671 -11.927  -5.991
  907    HA2  GLY 123           HA2      GLY 123   2.274 -14.258  -5.652
  908    HA3  GLY 123           HA1      GLY 123   2.261 -13.339  -7.147
  909    HA   PRO 124           HA       PRO 124   4.524 -16.800  -8.874
  910    HB2  PRO 124           HB2      PRO 124   5.365 -15.749 -11.185
  911    HB3  PRO 124           HB1      PRO 124   3.641 -16.000 -10.878
  912    HG2  PRO 124           HG2      PRO 124   5.234 -13.484 -10.813
  913    HG3  PRO 124           HG1      PRO 124   3.555 -13.740 -11.320
  914    HD2  PRO 124           HD2      PRO 124   4.423 -12.768  -8.827
  915    HD3  PRO 124           HD1      PRO 124   2.789 -13.323  -9.225
  916    H    GLN 125           HN       GLN 125   5.843 -14.524  -7.200
  917    HA   GLN 125           HA       GLN 125   8.580 -14.676  -8.287
  918    HB2  GLN 125           HB2      GLN 125   7.390 -12.718  -6.309
  919    HB3  GLN 125           HB1      GLN 125   9.030 -12.667  -6.942
  920    HG2  GLN 125           HG2      GLN 125   8.267 -12.155  -9.127
  921    HG3  GLN 125           HG1      GLN 125   6.593 -12.496  -8.693
  922   HE21  GLN 125          HE21      GLN 125   5.430 -11.001  -7.561
  923   HE22  GLN 125          HE22      GLN 125   5.964  -9.384  -7.291
  924    H    GLY 126           HN       GLY 126   6.731 -14.804  -5.291
  925    HA2  GLY 126           HA2      GLY 126   7.038 -16.009  -3.390
  926    HA3  GLY 126           HA1      GLY 126   8.380 -16.819  -4.147
  927    H    SER 127           HN       SER 127   7.953 -15.631  -1.494
  928    HA   SER 127           HA       SER 127   9.782 -13.426  -1.424
  929    HB2  SER 127           HB2      SER 127   7.905 -13.048  -0.077
  930    HB3  SER 127           HB1      SER 127   7.926 -14.676   0.569
  931    HG   SER 127           HG       SER 127   8.988 -13.826   2.175
  932    H    ARG 128           HN       ARG 128  11.470 -13.283   0.228
  933    HA   ARG 128           HA       ARG 128  13.470 -15.074  -0.378
  934    HB2  ARG 128           HB2      ARG 128  14.754 -14.011   1.477
  935    HB3  ARG 128           HB1      ARG 128  14.028 -12.874   0.353
  936    HG2  ARG 128           HG2      ARG 128  12.257 -12.396   1.939
  937    HG3  ARG 128           HG1      ARG 128  12.917 -13.584   3.063
  938    HD2  ARG 128           HD2      ARG 128  14.312 -11.087   2.102
  939    HD3  ARG 128           HD1      ARG 128  13.563 -11.303   3.682
  940    HE   ARG 128           HE       ARG 128  15.287 -13.281   3.760
  941   HH11  ARG 128          HH11      ARG 128  15.744 -10.047   2.528
  942   HH12  ARG 128          HH12      ARG 128  17.443  -9.997   2.874
  943   HH21  ARG 128          HH21      ARG 128  17.536 -13.232   4.242
  944   HH22  ARG 128          HH22      ARG 128  18.467 -11.818   3.853
  945    H    SER 129           HN       SER 129  11.610 -14.940   2.675
  946    HA   SER 129           HA       SER 129  12.787 -17.422   3.496
  947    HB2  SER 129           HB2      SER 129  10.497 -15.897   4.754
  948    HB3  SER 129           HB1      SER 129  11.353 -17.261   5.473
  949    HG   SER 129           HG       SER 129  12.790 -15.898   6.152
  950    HA   PRO 130           HA       PRO 130   8.810 -19.342   2.031
  951    HB2  PRO 130           HB2      PRO 130   6.443 -17.940   2.338
  952    HB3  PRO 130           HB1      PRO 130   7.181 -18.917   3.601
  953    HG2  PRO 130           HG2      PRO 130   6.827 -16.110   3.614
  954    HG3  PRO 130           HG1      PRO 130   7.760 -17.063   4.775
  955    HD2  PRO 130           HD2      PRO 130   8.680 -15.586   2.341
  956    HD3  PRO 130           HD1      PRO 130   9.483 -15.770   3.909
  957    H    TYR 131           HN       TYR 131   8.778 -19.488  -0.232
  958    HA   TYR 131           HA       TYR 131   8.070 -17.513  -2.025
  959    HB2  TYR 131           HB2      TYR 131   8.805 -19.721  -2.773
  960    HB3  TYR 131           HB1      TYR 131   7.344 -20.454  -2.124
  961    HD1  TYR 131           HD1      TYR 131   5.141 -19.968  -3.210
  962    HD2  TYR 131           HD2      TYR 131   8.819 -18.696  -4.930
  963    HE1  TYR 131           HE1      TYR 131   4.019 -19.654  -5.377
  964    HE2  TYR 131           HE2      TYR 131   7.711 -18.379  -7.097
  965    HH   TYR 131           HH       TYR 131   5.670 -19.348  -8.258
  966    H    ILE 132           HN       ILE 132   6.518 -16.144  -1.442
  967    HA   ILE 132           HA       ILE 132   4.159 -16.813  -0.074
  968    HB   ILE 132           HB       ILE 132   4.634 -14.385  -1.814
  969   HG12  ILE 132          HG12      ILE 132   6.432 -14.476  -0.252
  970   HG13  ILE 132          HG11      ILE 132   5.298 -13.241   0.287
  971   HG21  ILE 132          HG21      ILE 132   2.989 -13.315  -0.383
  972   HG22  ILE 132          HG22      ILE 132   2.806 -14.812   0.537
  973   HG23  ILE 132          HG23      ILE 132   2.312 -14.747  -1.158
  974   HD11  ILE 132          HD11      ILE 132   6.201 -14.588   2.101
  975   HD12  ILE 132          HD12      ILE 132   5.476 -16.029   1.386
  976   HD13  ILE 132          HD13      ILE 132   4.445 -14.722   1.975
  977    HA   PRO 133           HA       PRO 133   1.828 -18.727  -3.337
  978    HB2  PRO 133           HB2      PRO 133  -0.674 -17.999  -2.315
  979    HB3  PRO 133           HB1      PRO 133   0.216 -19.473  -1.927
  980    HG2  PRO 133           HG2      PRO 133   0.017 -16.923  -0.404
  981    HG3  PRO 133           HG1      PRO 133   0.130 -18.587   0.195
  982    HD2  PRO 133           HD2      PRO 133   2.232 -16.924   0.265
  983    HD3  PRO 133           HD1      PRO 133   2.429 -18.658  -0.065
  984    HA   PRO 134           HA       PRO 134   1.089 -15.402  -6.167
  985    HB2  PRO 134           HB2      PRO 134  -0.834 -17.276  -7.416
  986    HB3  PRO 134           HB1      PRO 134   0.546 -16.429  -8.130
  987    HG2  PRO 134           HG2      PRO 134   0.660 -19.048  -7.598
  988    HG3  PRO 134           HG1      PRO 134   2.070 -17.999  -7.359
  989    HD2  PRO 134           HD2      PRO 134   0.178 -19.128  -5.337
  990    HD3  PRO 134           HD1      PRO 134   1.936 -18.892  -5.230
  991    H    HIS 135           HN       HIS 135  -0.157 -13.742  -5.977
  992    HA   HIS 135           HA       HIS 135  -1.979 -12.392  -5.900
  993    HB2  HIS 135           HB2      HIS 135  -3.649 -14.912  -6.017
  994    HB3  HIS 135           HB1      HIS 135  -4.251 -13.272  -6.210
  995    HD1  HIS 135           HD1      HIS 135  -4.538 -15.507  -8.387
  996    HD2  HIS 135           HD2      HIS 135  -1.600 -12.561  -8.330
  997    HE1  HIS 135           HE1      HIS 135  -3.736 -15.302 -10.759
  998    HE2  HIS 135           HE2      HIS 135  -1.944 -13.528 -10.707
  999    H    ALA 136           HN       ALA 136  -0.920 -14.210  -3.501
 1000    HA   ALA 136           HA       ALA 136  -2.993 -13.870  -1.554
 1001    HB1  ALA 136           HB1      ALA 136  -0.029 -14.315  -1.197
 1002    HB2  ALA 136           HB2      ALA 136  -1.269 -15.568  -1.253
 1003    HB3  ALA 136           HB3      ALA 136  -1.239 -14.414   0.082
 1004    H    ALA 137           HN       ALA 137  -3.450 -12.063  -0.367
 1005    HA   ALA 137           HA       ALA 137  -2.259  -9.613  -1.270
 1006    HB1  ALA 137           HB1      ALA 137  -4.655  -9.748  -0.791
 1007    HB2  ALA 137           HB2      ALA 137  -3.873  -8.518   0.205
 1008    HB3  ALA 137           HB3      ALA 137  -4.303 -10.080   0.905
 1009    H    LEU 138           HN       LEU 138  -0.388  -8.940  -0.522
 1010    HA   LEU 138           HA       LEU 138   0.616  -9.841   2.042
 1011    HB2  LEU 138           HB2      LEU 138   1.784  -9.258  -0.432
 1012    HB3  LEU 138           HB1      LEU 138   2.306  -7.963   0.618
 1013    HG   LEU 138           HG       LEU 138   3.179  -9.639   2.207
 1014   HD11  LEU 138          HD11      LEU 138   3.419 -11.943   1.484
 1015   HD12  LEU 138          HD12      LEU 138   2.477 -11.584   0.036
 1016   HD13  LEU 138          HD13      LEU 138   1.725 -11.480   1.630
 1017   HD21  LEU 138          HD21      LEU 138   4.254  -9.888  -0.587
 1018   HD22  LEU 138          HD22      LEU 138   5.124 -10.247   0.904
 1019   HD23  LEU 138          HD23      LEU 138   4.631  -8.593   0.544
 1020    H    CYS 139           HN       CYS 139   0.678  -8.627   3.823
 1021    HA   CYS 139           HA       CYS 139   0.194  -5.741   3.520
 1022    HB2  CYS 139           HB2      CYS 139  -1.754  -6.628   4.489
 1023    HB3  CYS 139           HB1      CYS 139  -0.857  -7.677   5.569
 1024    HG   CYS 139           HG       CYS 139  -2.060  -4.712   6.139
 1025    H    LEU 140           HN       LEU 140   2.100  -4.879   3.708
 1026    HA   LEU 140           HA       LEU 140   3.964  -5.898   5.739
 1027    HB2  LEU 140           HB2      LEU 140   5.710  -4.838   4.317
 1028    HB3  LEU 140           HB1      LEU 140   4.868  -6.183   3.571
 1029    HG   LEU 140           HG       LEU 140   3.438  -3.908   2.802
 1030   HD11  LEU 140          HD11      LEU 140   6.418  -3.469   2.667
 1031   HD12  LEU 140          HD12      LEU 140   5.237  -2.480   3.524
 1032   HD13  LEU 140          HD13      LEU 140   5.227  -2.534   1.760
 1033   HD21  LEU 140          HD21      LEU 140   4.310  -4.459   0.577
 1034   HD22  LEU 140          HD22      LEU 140   3.803  -5.900   1.458
 1035   HD23  LEU 140          HD23      LEU 140   5.519  -5.515   1.312
 1036    H    GLU 141           HN       GLU 141   4.824  -4.605   7.227
 1037    HA   GLU 141           HA       GLU 141   3.906  -1.819   7.334
 1038    HB2  GLU 141           HB2      GLU 141   3.348  -3.231   9.249
 1039    HB3  GLU 141           HB1      GLU 141   5.033  -3.683   9.433
 1040    HG2  GLU 141           HG2      GLU 141   5.581  -1.360  10.000
 1041    HG3  GLU 141           HG1      GLU 141   3.863  -0.950   9.871
 1042    H    VAL 142           HN       VAL 142   5.352  -0.295   6.739
 1043    HA   VAL 142           HA       VAL 142   8.203  -1.031   6.786
 1044    HB   VAL 142           HB       VAL 142   8.218   0.718   4.771
 1045   HG11  VAL 142          HG11      VAL 142   8.173  -1.211   3.251
 1046   HG12  VAL 142          HG12      VAL 142   7.510  -2.204   4.551
 1047   HG13  VAL 142          HG13      VAL 142   9.133  -1.525   4.695
 1048   HG21  VAL 142          HG21      VAL 142   6.285   0.288   3.302
 1049   HG22  VAL 142          HG22      VAL 142   5.823   1.120   4.788
 1050   HG23  VAL 142          HG23      VAL 142   5.509  -0.606   4.609
 1051    H    THR 143           HN       THR 143   9.302   0.136   8.165
 1052    HA   THR 143           HA       THR 143   8.624   2.919   8.731
 1053    HB   THR 143           HB       THR 143  11.107   1.504   9.741
 1054    HG1  THR 143           HG1      THR 143   8.446   1.309  10.804
 1055   HG21  THR 143          HG21      THR 143  10.762   2.955  11.682
 1056   HG22  THR 143          HG22      THR 143   9.270   3.580  10.976
 1057   HG23  THR 143          HG23      THR 143  10.819   3.913  10.200
 1058    H    LEU 144           HN       LEU 144   9.231   4.318   7.142
 1059    HA   LEU 144           HA       LEU 144  11.791   4.029   5.795
 1060    HB2  LEU 144           HB2      LEU 144   9.805   4.953   4.630
 1061    HB3  LEU 144           HB1      LEU 144   9.799   6.304   5.748
 1062    HG   LEU 144           HG       LEU 144  11.943   7.077   4.874
 1063   HD11  LEU 144          HD11      LEU 144  13.021   5.989   3.002
 1064   HD12  LEU 144          HD12      LEU 144  11.764   4.754   2.956
 1065   HD13  LEU 144          HD13      LEU 144  12.860   4.846   4.335
 1066   HD21  LEU 144          HD21      LEU 144  11.209   7.729   2.658
 1067   HD22  LEU 144          HD22      LEU 144   9.856   7.797   3.787
 1068   HD23  LEU 144          HD23      LEU 144   9.994   6.450   2.658
 1069    H    LYS 145           HN       LYS 145  13.490   4.361   6.993
 1070    HA   LYS 145           HA       LYS 145  13.298   6.305   9.179
 1071    HB2  LYS 145           HB2      LYS 145  15.349   4.119   8.847
 1072    HB3  LYS 145           HB1      LYS 145  14.923   4.993  10.316
 1073    HG2  LYS 145           HG2      LYS 145  12.810   3.959  10.438
 1074    HG3  LYS 145           HG1      LYS 145  12.989   3.276   8.823
 1075    HD2  LYS 145           HD2      LYS 145  14.650   2.541  11.227
 1076    HD3  LYS 145           HD1      LYS 145  13.301   1.592  10.587
 1077    HE2  LYS 145           HE2      LYS 145  15.987   2.128   9.329
 1078    HE3  LYS 145           HE1      LYS 145  15.218   0.589   9.732
 1079    HZ1  LYS 145           HZ1      LYS 145  15.089   0.899   7.406
 1080    HZ2  LYS 145           HZ2      LYS 145  14.440   2.449   7.571
 1081    HZ3  LYS 145           HZ3      LYS 145  13.529   1.098   8.028
 1082    H    THR 146           HN       THR 146  14.843   5.696   6.192
 1083    HA   THR 146           HA       THR 146  16.352   8.135   6.418
 1084    HB   THR 146           HB       THR 146  17.820   5.571   5.826
 1085    HG1  THR 146           HG1      THR 146  17.264   6.818   8.236
 1086   HG21  THR 146          HG21      THR 146  19.834   6.968   6.133
 1087   HG22  THR 146          HG22      THR 146  18.793   8.379   6.331
 1088   HG23  THR 146          HG23      THR 146  18.826   7.518   4.791
 1089    H    ALA 147           HN       ALA 147  16.821   9.041   4.437
 1090    HA   ALA 147           HA       ALA 147  16.567   7.410   2.023
 1091    HB1  ALA 147           HB1      ALA 147  15.223   9.142   0.923
 1092    HB2  ALA 147           HB2      ALA 147  15.180  10.066   2.424
 1093    HB3  ALA 147           HB3      ALA 147  14.387   8.494   2.333
 1094    H    VAL 148           HN       VAL 148  18.264   7.816   0.645
 1095    HA   VAL 148           HA       VAL 148  19.717  10.346   1.115
 1096    HB   VAL 148           HB       VAL 148  21.847   9.245   0.763
 1097   HG11  VAL 148          HG11      VAL 148  21.922   7.823   2.778
 1098   HG12  VAL 148          HG12      VAL 148  20.156   7.800   2.807
 1099   HG13  VAL 148          HG13      VAL 148  21.023   9.320   3.045
 1100   HG21  VAL 148          HG21      VAL 148  22.019   6.785   0.629
 1101   HG22  VAL 148          HG22      VAL 148  21.238   7.494  -0.785
 1102   HG23  VAL 148          HG23      VAL 148  20.267   6.696   0.453
 1103    H    ASP 149           HN       ASP 149  20.043  11.567  -0.625
 1104    HA   ASP 149           HA       ASP 149  19.148  10.536  -3.187
 1105    HB2  ASP 149           HB2      ASP 149  18.317  12.711  -2.760
 1106    HB3  ASP 149           HB1      ASP 149  19.896  13.299  -2.236
 1107    H    LEU 150           HN       LEU 150  20.530   9.677  -4.598
 1108    HA   LEU 150           HA       LEU 150  23.127  10.901  -4.935
 1109    HB2  LEU 150           HB2      LEU 150  24.382   8.936  -4.699
 1110    HB3  LEU 150           HB1      LEU 150  23.303   8.993  -3.331
 1111    HG   LEU 150           HG       LEU 150  23.370   6.748  -3.913
 1112   HD11  LEU 150          HD11      LEU 150  21.075   7.513  -3.601
 1113   HD12  LEU 150          HD12      LEU 150  21.185   6.132  -4.694
 1114   HD13  LEU 150          HD13      LEU 150  20.929   7.752  -5.342
 1115   HD21  LEU 150          HD21      LEU 150  23.063   7.532  -6.796
 1116   HD22  LEU 150          HD22      LEU 150  23.117   5.877  -6.187
 1117   HD23  LEU 150          HD23      LEU 150  24.524   6.929  -6.013
 1118    H    GLU 151           HN       GLU 151  20.367  10.031  -6.309
 1119    HA   GLU 151           HA       GLU 151  21.515   8.857  -8.734
 1120    HB2  GLU 151           HB2      GLU 151  19.795   7.481  -7.892
 1121    HB3  GLU 151           HB1      GLU 151  18.743   8.849  -7.570
 1122    HG2  GLU 151           HG2      GLU 151  17.984   7.480  -9.458
 1123    HG3  GLU 151           HG1      GLU 151  18.331   9.149  -9.922
 1124    H    HIS 152           HN       HIS 152  18.755  11.050  -8.103
 1125    HA   HIS 152           HA       HIS 152  19.699  12.777 -10.249
 1126    HB2  HIS 152           HB2      HIS 152  17.527  10.860 -10.520
 1127    HB3  HIS 152           HB1      HIS 152  16.998  12.509 -10.843
 1128    HD1  HIS 152           HD1      HIS 152  19.698  10.068 -11.990
 1129    HD2  HIS 152           HD2      HIS 152  17.580  13.400 -13.334
 1130    HE1  HIS 152           HE1      HIS 152  20.357  10.378 -14.401
 1131    HE2  HIS 152           HE2      HIS 152  19.076  12.402 -15.195
 1132    H    HIS 153           HN       HIS 153  19.531  14.789  -9.620
 1133    HA   HIS 153           HA       HIS 153  17.956  15.561  -7.362
 1134    HB2  HIS 153           HB2      HIS 153  19.487  17.214  -9.384
 1135    HB3  HIS 153           HB1      HIS 153  18.694  17.881  -7.963
 1136    HD1  HIS 153           HD1      HIS 153  21.892  16.710  -9.068
 1137    HD2  HIS 153           HD2      HIS 153  19.787  16.569  -5.480
 1138    HE1  HIS 153           HE1      HIS 153  23.606  16.226  -7.292
 1139    HE2  HIS 153           HE2      HIS 153  22.272  15.932  -5.174
 1140    H    HIS 154           HN       HIS 154  15.841  15.611  -7.496
 1141    HA   HIS 154           HA       HIS 154  14.315  15.553  -9.782
 1142    HB2  HIS 154           HB2      HIS 154  12.385  16.206  -8.337
 1143    HB3  HIS 154           HB1      HIS 154  13.341  14.874  -7.705
 1144    HD1  HIS 154           HD1      HIS 154  14.366  15.176  -5.403
 1145    HD2  HIS 154           HD2      HIS 154  12.668  18.670  -6.891
 1146    HE1  HIS 154           HE1      HIS 154  14.377  16.807  -3.489
 1147    HE2  HIS 154           HE2      HIS 154  13.249  18.872  -4.376
 1148    H    HIS 155           HN       HIS 155  13.650  16.938 -11.245
 1149    HA   HIS 155           HA       HIS 155  13.401  19.770 -10.644
 1150    HB2  HIS 155           HB2      HIS 155  14.858  20.472 -12.517
 1151    HB3  HIS 155           HB1      HIS 155  15.758  19.651 -11.249
 1152    HD1  HIS 155           HD1      HIS 155  16.628  17.220 -11.813
 1153    HD2  HIS 155           HD2      HIS 155  14.940  19.278 -15.006
 1154    HE1  HIS 155           HE1      HIS 155  17.358  15.988 -13.878
 1155    HE2  HIS 155           HE2      HIS 155  16.167  17.141 -15.779
 1156    H    HIS 156           HN       HIS 156  12.792  20.913 -12.902
 1157    HA   HIS 156           HA       HIS 156  10.693  19.177 -14.022
 1158    HB2  HIS 156           HB2      HIS 156  10.746  22.119 -13.441
 1159    HB3  HIS 156           HB1      HIS 156   9.635  21.459 -14.636
 1160    HD1  HIS 156           HD1      HIS 156   8.269  19.236 -13.543
 1161    HD2  HIS 156           HD2      HIS 156   9.556  22.285 -11.026
 1162    HE1  HIS 156           HE1      HIS 156   6.864  19.038 -11.469
 1163    HE2  HIS 156           HE2      HIS 156   7.495  21.039 -10.075
 1164    H    HIS 157           HN       HIS 157  11.087  18.496 -15.987
 1165    HA   HIS 157           HA       HIS 157  11.092  20.238 -18.153
 1166    HB2  HIS 157           HB2      HIS 157  13.538  20.517 -17.380
 1167    HB3  HIS 157           HB1      HIS 157  13.776  18.872 -17.963
 1168    HD1  HIS 157           HD1      HIS 157  12.731  22.284 -19.243
 1169    HD2  HIS 157           HD2      HIS 157  14.186  18.653 -20.669
 1170    HE1  HIS 157           HE1      HIS 157  13.243  22.658 -21.677
 1171    HE2  HIS 157           HE2      HIS 157  14.278  20.511 -22.466
  Start of MODEL   16
    1    H1   MET   1           HT1      MET   1   1.663 -10.432  38.805
    2    H2   MET   1           HT2      MET   1   2.035  -9.284  37.618
    3    H3   MET   1           HT3      MET   1   3.229  -9.785  38.718
    4    HA   MET   1           HA       MET   1   1.936 -11.449  36.636
    5    HB2  MET   1           HB2      MET   1   4.701 -10.264  36.887
    6    HB3  MET   1           HB1      MET   1   4.364 -11.633  35.840
    7    HG2  MET   1           HG2      MET   1   4.349  -9.644  34.527
    8    HG3  MET   1           HG1      MET   1   2.698 -10.255  34.640
    9    HE1  MET   1           HE1      MET   1   1.782  -7.895  33.762
   10    HE2  MET   1           HE2      MET   1   3.455  -7.355  33.637
   11    HE3  MET   1           HE3      MET   1   2.265  -6.357  34.473
   12    H    GLY   2           HN       GLY   2   3.035 -13.560  36.390
   13    HA2  GLY   2           HA2      GLY   2   4.746 -14.671  38.300
   14    HA3  GLY   2           HA1      GLY   2   3.100 -14.956  38.850
   15    H    GLN   3           HN       GLN   3   5.489 -16.503  37.468
   16    HA   GLN   3           HA       GLN   3   4.159 -17.626  35.162
   17    HB2  GLN   3           HB2      GLN   3   6.698 -18.574  36.497
   18    HB3  GLN   3           HB1      GLN   3   6.144 -18.979  34.880
   19    HG2  GLN   3           HG2      GLN   3   6.397 -16.594  34.254
   20    HG3  GLN   3           HG1      GLN   3   7.088 -16.287  35.848
   21   HE21  GLN   3          HE21      GLN   3   9.096 -17.276  36.380
   22   HE22  GLN   3          HE22      GLN   3  10.198 -17.773  35.136
   23    HA   PRO   4           HA       PRO   4   2.343 -20.956  37.558
   24    HB2  PRO   4           HB2      PRO   4   1.375 -22.017  35.040
   25    HB3  PRO   4           HB1      PRO   4   0.455 -21.259  36.340
   26    HG2  PRO   4           HG2      PRO   4   0.805 -20.121  33.884
   27    HG3  PRO   4           HG1      PRO   4   0.541 -19.189  35.369
   28    HD2  PRO   4           HD2      PRO   4   3.103 -19.777  33.928
   29    HD3  PRO   4           HD1      PRO   4   2.559 -18.262  34.681
   30    HA   PRO   5           HA       PRO   5   5.622 -24.000  37.021
   31    HB2  PRO   5           HB2      PRO   5   3.550 -25.630  38.425
   32    HB3  PRO   5           HB1      PRO   5   5.275 -25.461  38.778
   33    HG2  PRO   5           HG2      PRO   5   3.483 -24.207  40.277
   34    HG3  PRO   5           HG1      PRO   5   4.992 -23.399  39.815
   35    HD2  PRO   5           HD2      PRO   5   2.231 -23.013  38.744
   36    HD3  PRO   5           HD1      PRO   5   3.515 -21.816  39.015
   37    H    ALA   6           HN       ALA   6   5.976 -25.637  35.608
   38    HA   ALA   6           HA       ALA   6   5.727 -26.956  33.793
   39    HB1  ALA   6           HB1      ALA   6   3.674 -28.224  33.454
   40    HB2  ALA   6           HB2      ALA   6   2.834 -27.209  34.627
   41    HB3  ALA   6           HB3      ALA   6   4.149 -28.261  35.154
   42    H    GLU   7           HN       GLU   7   2.448 -25.627  33.664
   43    HA   GLU   7           HA       GLU   7   3.184 -23.558  31.831
   44    HB2  GLU   7           HB2      GLU   7   1.888 -24.353  29.914
   45    HB3  GLU   7           HB1      GLU   7   3.214 -25.447  30.275
   46    HG2  GLU   7           HG2      GLU   7   1.675 -26.995  31.343
   47    HG3  GLU   7           HG1      GLU   7   0.339 -25.880  31.060
   48    H    GLU   8           HN       GLU   8   1.339 -22.274  31.174
   49    HA   GLU   8           HA       GLU   8  -0.751 -22.190  33.164
   50    HB2  GLU   8           HB2      GLU   8   0.357 -20.155  32.141
   51    HB3  GLU   8           HB1      GLU   8  -0.475 -20.540  30.643
   52    HG2  GLU   8           HG2      GLU   8  -2.611 -20.189  31.666
   53    HG3  GLU   8           HG1      GLU   8  -1.860 -19.981  33.251
   54    H    ALA   9           HN       ALA   9  -2.120 -23.872  32.962
   55    HA   ALA   9           HA       ALA   9  -2.957 -24.657  30.261
   56    HB1  ALA   9           HB1      ALA   9  -3.465 -26.838  31.195
   57    HB2  ALA   9           HB2      ALA   9  -3.085 -26.255  32.815
   58    HB3  ALA   9           HB3      ALA   9  -1.812 -26.372  31.601
   59    H    GLU  10           HN       GLU  10  -5.183 -26.175  30.971
   60    HA   GLU  10           HA       GLU  10  -7.093 -24.076  31.730
   61    HB2  GLU  10           HB2      GLU  10  -8.516 -25.022  29.798
   62    HB3  GLU  10           HB1      GLU  10  -7.164 -23.969  29.398
   63    HG2  GLU  10           HG2      GLU  10  -5.791 -25.924  28.882
   64    HG3  GLU  10           HG1      GLU  10  -7.143 -26.979  29.285
   65    H    GLN  11           HN       GLN  11  -6.937 -27.537  30.868
   66    HA   GLN  11           HA       GLN  11  -8.062 -29.365  31.573
   67    HB2  GLN  11           HB2      GLN  11  -8.577 -27.736  34.066
   68    HB3  GLN  11           HB1      GLN  11  -9.004 -29.427  33.881
   69    HG2  GLN  11           HG2      GLN  11  -6.246 -28.240  33.913
   70    HG3  GLN  11           HG1      GLN  11  -6.988 -29.273  35.134
   71   HE21  GLN  11          HE21      GLN  11  -5.390 -29.138  32.089
   72   HE22  GLN  11          HE22      GLN  11  -5.193 -30.845  31.862
   73    HA   PRO  12           HA       PRO  12 -11.904 -27.261  30.040
   74    HB2  PRO  12           HB2      PRO  12 -11.823 -29.449  28.076
   75    HB3  PRO  12           HB1      PRO  12 -11.918 -27.708  27.807
   76    HG2  PRO  12           HG2      PRO  12  -9.690 -29.092  27.256
   77    HG3  PRO  12           HG1      PRO  12  -9.625 -27.437  27.889
   78    HD2  PRO  12           HD2      PRO  12  -9.242 -30.035  29.337
   79    HD3  PRO  12           HD1      PRO  12  -8.309 -28.528  29.467
   80    H    GLY  13           HN       GLY  13 -13.787 -27.760  30.941
   81    HA2  GLY  13           HA2      GLY  13 -15.302 -29.985  30.730
   82    HA3  GLY  13           HA1      GLY  13 -14.229 -30.379  32.066
   83    H    ALA  14           HN       ALA  14 -16.463 -30.486  33.082
   84    HA   ALA  14           HA       ALA  14 -17.686 -27.964  33.748
   85    HB1  ALA  14           HB1      ALA  14 -19.011 -30.039  33.581
   86    HB2  ALA  14           HB2      ALA  14 -19.171 -29.272  35.162
   87    HB3  ALA  14           HB3      ALA  14 -18.138 -30.689  34.969
   88    H    LEU  15           HN       LEU  15 -16.232 -26.702  34.792
   89    HA   LEU  15           HA       LEU  15 -15.203 -27.700  37.371
   90    HB2  LEU  15           HB2      LEU  15 -13.442 -27.238  35.703
   91    HB3  LEU  15           HB1      LEU  15 -14.018 -25.590  35.558
   92    HG   LEU  15           HG       LEU  15 -13.438 -25.225  37.953
   93   HD11  LEU  15          HD11      LEU  15 -11.965 -26.820  39.061
   94   HD12  LEU  15          HD12      LEU  15 -12.147 -27.938  37.708
   95   HD13  LEU  15          HD13      LEU  15 -13.539 -27.532  38.712
   96   HD21  LEU  15          HD21      LEU  15 -11.179 -26.134  36.175
   97   HD22  LEU  15          HD22      LEU  15 -11.032 -25.079  37.582
   98   HD23  LEU  15          HD23      LEU  15 -11.934 -24.539  36.165
   99    H    ALA  16           HN       ALA  16 -17.333 -25.622  35.871
  100    HA   ALA  16           HA       ALA  16 -18.730 -23.989  36.593
  101    HB1  ALA  16           HB1      ALA  16 -17.463 -24.339  39.321
  102    HB2  ALA  16           HB2      ALA  16 -18.892 -25.194  38.735
  103    HB3  ALA  16           HB3      ALA  16 -18.941 -23.444  38.965
  104    H    ARG  17           HN       ARG  17 -15.411 -23.680  37.769
  105    HA   ARG  17           HA       ARG  17 -15.448 -20.804  37.462
  106    HB2  ARG  17           HB2      ARG  17 -14.130 -21.775  39.273
  107    HB3  ARG  17           HB1      ARG  17 -13.209 -22.727  38.117
  108    HG2  ARG  17           HG2      ARG  17 -12.514 -20.504  37.094
  109    HG3  ARG  17           HG1      ARG  17 -13.155 -19.767  38.563
  110    HD2  ARG  17           HD2      ARG  17 -11.091 -21.954  38.558
  111    HD3  ARG  17           HD1      ARG  17 -10.685 -20.239  38.555
  112    HE   ARG  17           HE       ARG  17 -12.452 -20.790  40.687
  113   HH11  ARG  17          HH11      ARG  17  -9.164 -21.444  39.660
  114   HH12  ARG  17          HH12      ARG  17  -8.522 -21.444  41.283
  115   HH21  ARG  17          HH21      ARG  17 -11.602 -20.798  42.829
  116   HH22  ARG  17          HH22      ARG  17  -9.906 -21.104  43.070
  117    H    GLU  18           HN       GLU  18 -15.779 -20.421  35.272
  118    HA   GLU  18           HA       GLU  18 -14.047 -21.551  33.277
  119    HB2  GLU  18           HB2      GLU  18 -16.275 -20.788  32.657
  120    HB3  GLU  18           HB1      GLU  18 -15.897 -19.155  33.192
  121    HG2  GLU  18           HG2      GLU  18 -14.234 -18.953  31.428
  122    HG3  GLU  18           HG1      GLU  18 -14.576 -20.602  30.905
  123    H    PHE  19           HN       PHE  19 -14.055 -18.834  35.389
  124    HA   PHE  19           HA       PHE  19 -12.457 -17.413  36.080
  125    HB2  PHE  19           HB2      PHE  19 -10.833 -19.174  36.047
  126    HB3  PHE  19           HB1      PHE  19 -10.663 -19.061  34.297
  127    HD1  PHE  19           HD1      PHE  19 -10.201 -17.058  37.407
  128    HD2  PHE  19           HD2      PHE  19  -8.993 -17.762  33.388
  129    HE1  PHE  19           HE1      PHE  19  -8.377 -15.427  37.674
  130    HE2  PHE  19           HE2      PHE  19  -7.167 -16.132  33.643
  131    HZ   PHE  19           HZ       PHE  19  -6.862 -14.957  35.788
  132    H    LEU  20           HN       LEU  20 -12.630 -15.402  35.581
  133    HA   LEU  20           HA       LEU  20 -12.457 -13.412  34.534
  134    HB2  LEU  20           HB2      LEU  20 -10.113 -14.405  34.219
  135    HB3  LEU  20           HB1      LEU  20 -10.604 -14.731  32.569
  136    HG   LEU  20           HG       LEU  20 -11.031 -12.305  32.266
  137   HD11  LEU  20          HD11      LEU  20  -9.770 -12.092  34.991
  138   HD12  LEU  20          HD12      LEU  20 -11.439 -11.696  34.573
  139   HD13  LEU  20          HD13      LEU  20 -10.113 -10.740  33.908
  140   HD21  LEU  20          HD21      LEU  20  -8.938 -13.313  31.541
  141   HD22  LEU  20          HD22      LEU  20  -8.244 -13.044  33.140
  142   HD23  LEU  20          HD23      LEU  20  -8.679 -11.670  32.124
  143    H    ALA  21           HN       ALA  21 -14.712 -14.018  33.942
  144    HA   ALA  21           HA       ALA  21 -15.419 -14.996  31.412
  145    HB1  ALA  21           HB1      ALA  21 -17.640 -14.139  31.872
  146    HB2  ALA  21           HB2      ALA  21 -17.002 -13.089  33.135
  147    HB3  ALA  21           HB3      ALA  21 -16.957 -14.838  33.342
  148    H    ALA  22           HN       ALA  22 -14.945 -11.651  32.532
  149    HA   ALA  22           HA       ALA  22 -14.455 -10.867  29.783
  150    HB1  ALA  22           HB1      ALA  22 -16.875 -10.571  29.977
  151    HB2  ALA  22           HB2      ALA  22 -16.056  -9.018  29.809
  152    HB3  ALA  22           HB3      ALA  22 -16.642  -9.539  31.389
  153    H    MET  23           HN       MET  23 -12.861  -9.469  29.686
  154    HA   MET  23           HA       MET  23 -12.485  -7.261  31.390
  155    HB2  MET  23           HB2      MET  23 -11.702  -9.404  32.771
  156    HB3  MET  23           HB1      MET  23 -10.249  -9.207  31.797
  157    HG2  MET  23           HG2      MET  23  -9.994  -8.089  33.918
  158    HG3  MET  23           HG1      MET  23 -10.021  -6.910  32.608
  159    HE1  MET  23           HE1      MET  23 -11.773  -5.009  35.585
  160    HE2  MET  23           HE2      MET  23 -10.444  -4.976  34.426
  161    HE3  MET  23           HE3      MET  23 -10.453  -6.171  35.723
  162    H    GLU  24           HN       GLU  24 -10.888  -9.703  29.442
  163    HA   GLU  24           HA       GLU  24  -9.513  -7.628  27.890
  164    HB2  GLU  24           HB2      GLU  24  -8.166  -9.519  28.817
  165    HB3  GLU  24           HB1      GLU  24  -9.138 -10.637  27.874
  166    HG2  GLU  24           HG2      GLU  24  -8.352  -9.571  25.818
  167    HG3  GLU  24           HG1      GLU  24  -7.347  -8.485  26.777
  168    HA   PRO  25           HA       PRO  25 -12.909  -8.102  25.044
  169    HB2  PRO  25           HB2      PRO  25 -11.240  -6.514  23.216
  170    HB3  PRO  25           HB1      PRO  25 -12.821  -6.138  23.904
  171    HG2  PRO  25           HG2      PRO  25 -10.601  -4.858  24.705
  172    HG3  PRO  25           HG1      PRO  25 -11.920  -5.236  25.830
  173    HD2  PRO  25           HD2      PRO  25  -9.299  -6.639  25.443
  174    HD3  PRO  25           HD1      PRO  25 -10.152  -6.241  26.951
  175    H    GLU  26           HN       GLU  26 -13.383  -9.569  23.506
  176    HA   GLU  26           HA       GLU  26 -11.183 -10.969  22.205
  177    HB2  GLU  26           HB2      GLU  26 -12.893 -12.599  21.508
  178    HB3  GLU  26           HB1      GLU  26 -12.919 -12.344  23.246
  179    HG2  GLU  26           HG2      GLU  26 -14.867 -10.915  23.031
  180    HG3  GLU  26           HG1      GLU  26 -14.816 -11.082  21.277
  181    HA   PRO  27           HA       PRO  27 -11.816  -8.724  18.419
  182    HB2  PRO  27           HB2      PRO  27 -10.348 -10.856  17.070
  183    HB3  PRO  27           HB1      PRO  27  -9.866  -9.182  17.352
  184    HG2  PRO  27           HG2      PRO  27  -8.684 -11.269  18.609
  185    HG3  PRO  27           HG1      PRO  27  -8.855  -9.672  19.361
  186    HD2  PRO  27           HD2      PRO  27 -10.505 -12.146  19.763
  187    HD3  PRO  27           HD1      PRO  27  -9.906 -10.982  20.967
  188    H    ALA  28           HN       ALA  28 -13.454  -8.752  17.012
  189    HA   ALA  28           HA       ALA  28 -15.069 -11.122  16.729
  190    HB1  ALA  28           HB1      ALA  28 -16.585  -9.710  15.471
  191    HB2  ALA  28           HB2      ALA  28 -15.367  -8.436  15.388
  192    HB3  ALA  28           HB3      ALA  28 -16.074  -8.879  16.941
  193    HA   PRO  29           HA       PRO  29 -13.246 -12.580  12.960
  194    HB2  PRO  29           HB2      PRO  29 -15.781 -13.680  12.104
  195    HB3  PRO  29           HB1      PRO  29 -14.342 -14.531  12.668
  196    HG2  PRO  29           HG2      PRO  29 -16.673 -14.409  14.091
  197    HG3  PRO  29           HG1      PRO  29 -15.076 -14.616  14.832
  198    HD2  PRO  29           HD2      PRO  29 -16.776 -12.171  14.631
  199    HD3  PRO  29           HD1      PRO  29 -15.712 -12.704  15.951
  200    H    ALA  30           HN       ALA  30 -13.462 -12.482  10.650
  201    HA   ALA  30           HA       ALA  30 -13.640 -11.307   8.744
  202    HB1  ALA  30           HB1      ALA  30 -15.845 -10.547   8.056
  203    HB2  ALA  30           HB2      ALA  30 -16.436 -10.725   9.707
  204    HB3  ALA  30           HB3      ALA  30 -15.935 -12.146   8.792
  205    HA   PRO  31           HA       PRO  31 -12.905  -7.314  10.996
  206    HB2  PRO  31           HB2      PRO  31 -10.258  -7.112  10.571
  207    HB3  PRO  31           HB1      PRO  31 -10.924  -8.073  11.896
  208    HG2  PRO  31           HG2      PRO  31  -9.884  -8.965   9.240
  209    HG3  PRO  31           HG1      PRO  31  -9.665  -9.709  10.832
  210    HD2  PRO  31           HD2      PRO  31 -11.488 -10.562   8.963
  211    HD3  PRO  31           HD1      PRO  31 -11.653 -10.826  10.709
  212    H    ALA  32           HN       ALA  32 -13.407  -5.541   9.907
  213    HA   ALA  32           HA       ALA  32 -13.259  -5.341   7.088
  214    HB1  ALA  32           HB1      ALA  32 -14.048  -3.069   7.377
  215    HB2  ALA  32           HB2      ALA  32 -13.665  -3.128   9.096
  216    HB3  ALA  32           HB3      ALA  32 -14.941  -4.155   8.442
  217    HA   PRO  33           HA       PRO  33  -9.036  -4.063   6.669
  218    HB2  PRO  33           HB2      PRO  33  -9.130  -3.198   4.103
  219    HB3  PRO  33           HB1      PRO  33  -9.166  -4.912   4.539
  220    HG2  PRO  33           HG2      PRO  33 -11.429  -3.088   3.817
  221    HG3  PRO  33           HG1      PRO  33 -11.131  -4.759   3.299
  222    HD2  PRO  33           HD2      PRO  33 -12.890  -4.120   5.264
  223    HD3  PRO  33           HD1      PRO  33 -11.978  -5.644   5.253
  224    H    GLU  34           HN       GLU  34 -11.708  -1.937   6.417
  225    HA   GLU  34           HA       GLU  34 -11.970   0.229   7.028
  226    HB2  GLU  34           HB2      GLU  34  -8.989   0.144   7.472
  227    HB3  GLU  34           HB1      GLU  34  -9.960   1.585   7.742
  228    HG2  GLU  34           HG2      GLU  34 -10.403  -1.055   9.115
  229    HG3  GLU  34           HG1      GLU  34  -9.497   0.297   9.795
  230    H    GLU  35           HN       GLU  35 -10.248  -0.866   4.440
  231    HA   GLU  35           HA       GLU  35  -9.826  -0.124   2.341
  232    HB2  GLU  35           HB2      GLU  35 -12.364   0.352   2.731
  233    HB3  GLU  35           HB1      GLU  35 -11.855   2.035   2.722
  234    HG2  GLU  35           HG2      GLU  35 -12.610   1.403   0.528
  235    HG3  GLU  35           HG1      GLU  35 -10.873   1.706   0.494
  236    H    TRP  36           HN       TRP  36  -7.758   0.685   2.676
  237    HA   TRP  36           HA       TRP  36  -7.412   3.449   3.451
  238    HB2  TRP  36           HB2      TRP  36  -5.213   1.790   2.323
  239    HB3  TRP  36           HB1      TRP  36  -5.138   3.012   3.579
  240    HD1  TRP  36           HD1      TRP  36  -7.432   1.564   5.458
  241    HE1  TRP  36           HE1      TRP  36  -6.711  -0.533   6.769
  242    HE3  TRP  36           HE3      TRP  36  -3.295   0.281   2.729
  243    HZ2  TRP  36           HZ2      TRP  36  -4.626  -2.453   6.666
  244    HZ3  TRP  36           HZ3      TRP  36  -2.022  -1.679   3.390
  245    HH2  TRP  36           HH2      TRP  36  -2.663  -3.037   5.294
  246    H    LEU  37           HN       LEU  37  -5.269   4.190   1.890
  247    HA   LEU  37           HA       LEU  37  -6.563   4.941  -0.574
  248    HB2  LEU  37           HB2      LEU  37  -5.180   6.525   0.697
  249    HB3  LEU  37           HB1      LEU  37  -3.788   5.493   0.477
  250    HG   LEU  37           HG       LEU  37  -3.916   5.868  -1.965
  251   HD11  LEU  37          HD11      LEU  37  -6.059   7.859  -1.234
  252   HD12  LEU  37          HD12      LEU  37  -6.290   6.359  -2.135
  253   HD13  LEU  37          HD13      LEU  37  -5.324   7.661  -2.825
  254   HD21  LEU  37          HD21      LEU  37  -2.445   7.217  -0.554
  255   HD22  LEU  37          HD22      LEU  37  -3.743   8.383  -0.305
  256   HD23  LEU  37          HD23      LEU  37  -3.063   8.149  -1.915
  257    H    ASP  38           HN       ASP  38  -6.625   3.406  -2.148
  258    HA   ASP  38           HA       ASP  38  -4.492   1.557  -2.536
  259    HB2  ASP  38           HB2      ASP  38  -6.921   1.220  -3.278
  260    HB3  ASP  38           HB1      ASP  38  -6.508   2.237  -4.657
  261    H    ILE  39           HN       ILE  39  -2.666   1.846  -3.461
  262    HA   ILE  39           HA       ILE  39  -1.661   4.238  -4.397
  263    HB   ILE  39           HB       ILE  39  -0.754   1.437  -5.062
  264   HG12  ILE  39          HG12      ILE  39  -0.242   3.278  -2.748
  265   HG13  ILE  39          HG11      ILE  39  -0.806   1.616  -2.722
  266   HG21  ILE  39          HG21      ILE  39   1.449   2.402  -5.441
  267   HG22  ILE  39          HG22      ILE  39   0.796   4.018  -5.175
  268   HG23  ILE  39          HG23      ILE  39   0.261   3.068  -6.562
  269   HD11  ILE  39          HD11      ILE  39   1.407   0.862  -3.462
  270   HD12  ILE  39          HD12      ILE  39   1.473   1.744  -1.936
  271   HD13  ILE  39          HD13      ILE  39   1.971   2.533  -3.435
  272    H    LEU  40           HN       LEU  40  -3.209   1.612  -6.163
  273    HA   LEU  40           HA       LEU  40  -2.941   3.199  -8.634
  274    HB2  LEU  40           HB2      LEU  40  -3.432   0.235  -8.356
  275    HB3  LEU  40           HB1      LEU  40  -3.250   1.104  -9.865
  276    HG   LEU  40           HG       LEU  40  -1.108   0.662  -7.785
  277   HD11  LEU  40          HD11      LEU  40  -1.648  -1.286  -9.158
  278   HD12  LEU  40          HD12      LEU  40  -0.049  -0.647  -9.534
  279   HD13  LEU  40          HD13      LEU  40  -1.403  -0.323 -10.615
  280   HD21  LEU  40          HD21      LEU  40  -0.985   2.159 -10.399
  281   HD22  LEU  40          HD22      LEU  40   0.393   1.764  -9.370
  282   HD23  LEU  40          HD23      LEU  40  -0.858   2.865  -8.786
  283    H    GLY  41           HN       GLY  41  -5.014   2.721  -6.257
  284    HA2  GLY  41           HA2      GLY  41  -7.280   2.878  -5.985
  285    HA3  GLY  41           HA1      GLY  41  -7.323   3.543  -7.607
  286    H    ASN  42           HN       ASN  42  -5.971   0.406  -7.116
  287    HA   ASN  42           HA       ASN  42  -8.134  -0.676  -8.742
  288    HB2  ASN  42           HB2      ASN  42  -6.734  -2.446  -9.381
  289    HB3  ASN  42           HB1      ASN  42  -5.717  -1.025  -9.384
  290   HD21  ASN  42          HD21      ASN  42  -5.140  -0.937  -6.580
  291   HD22  ASN  42          HD22      ASN  42  -4.153  -2.308  -6.227
  292    H    GLY  43           HN       GLY  43  -6.858  -1.018  -5.509
  293    HA2  GLY  43           HA2      GLY  43  -8.462  -1.591  -3.797
  294    HA3  GLY  43           HA1      GLY  43  -9.204  -2.715  -4.929
  295    H    LEU  44           HN       LEU  44  -5.938  -2.928  -5.280
  296    HA   LEU  44           HA       LEU  44  -5.828  -5.282  -3.515
  297    HB2  LEU  44           HB2      LEU  44  -4.535  -4.745  -6.185
  298    HB3  LEU  44           HB1      LEU  44  -3.988  -6.028  -5.129
  299    HG   LEU  44           HG       LEU  44  -5.388  -6.958  -6.823
  300   HD11  LEU  44          HD11      LEU  44  -7.067  -8.074  -5.488
  301   HD12  LEU  44          HD12      LEU  44  -6.901  -6.851  -4.231
  302   HD13  LEU  44          HD13      LEU  44  -5.552  -7.924  -4.597
  303   HD21  LEU  44          HD21      LEU  44  -6.648  -5.003  -7.479
  304   HD22  LEU  44          HD22      LEU  44  -7.516  -5.021  -5.942
  305   HD23  LEU  44          HD23      LEU  44  -7.740  -6.336  -7.098
  306    H    LEU  45           HN       LEU  45  -4.331  -2.300  -4.381
  307    HA   LEU  45           HA       LEU  45  -1.988  -2.920  -2.713
  308    HB2  LEU  45           HB2      LEU  45  -1.215  -2.966  -4.921
  309    HB3  LEU  45           HB1      LEU  45  -2.180  -1.589  -5.384
  310    HG   LEU  45           HG       LEU  45  -0.697  -0.114  -4.100
  311   HD11  LEU  45          HD11      LEU  45   0.006  -1.682  -2.383
  312   HD12  LEU  45          HD12      LEU  45   1.401  -0.988  -3.213
  313   HD13  LEU  45          HD13      LEU  45   0.876  -2.630  -3.592
  314   HD21  LEU  45          HD21      LEU  45   0.740  -1.931  -6.019
  315   HD22  LEU  45          HD22      LEU  45   1.219  -0.289  -5.585
  316   HD23  LEU  45          HD23      LEU  45  -0.285  -0.569  -6.465
  317    H    ARG  46           HN       ARG  46  -2.409  -1.810  -0.865
  318    HA   ARG  46           HA       ARG  46  -3.262   1.012  -1.122
  319    HB2  ARG  46           HB2      ARG  46  -4.438  -1.173   0.581
  320    HB3  ARG  46           HB1      ARG  46  -4.696   0.529   0.925
  321    HG2  ARG  46           HG2      ARG  46  -5.883   0.864  -1.061
  322    HG3  ARG  46           HG1      ARG  46  -5.342  -0.672  -1.739
  323    HD2  ARG  46           HD2      ARG  46  -7.146  -0.359   0.660
  324    HD3  ARG  46           HD1      ARG  46  -7.681  -0.736  -0.981
  325    HE   ARG  46           HE       ARG  46  -5.693  -2.567  -0.114
  326   HH11  ARG  46          HH11      ARG  46  -9.112  -1.841   0.240
  327   HH12  ARG  46          HH12      ARG  46  -9.515  -3.482   0.669
  328   HH21  ARG  46          HH21      ARG  46  -6.271  -4.714   0.437
  329   HH22  ARG  46          HH22      ARG  46  -7.938  -5.089   0.763
  330    H    LYS  47           HN       LYS  47  -2.323   2.417   0.272
  331    HA   LYS  47           HA       LYS  47  -0.381   1.339   2.219
  332    HB2  LYS  47           HB2      LYS  47   0.266   2.880   0.193
  333    HB3  LYS  47           HB1      LYS  47  -0.415   4.159   1.178
  334    HG2  LYS  47           HG2      LYS  47   1.202   3.290   3.003
  335    HG3  LYS  47           HG1      LYS  47   2.027   2.514   1.651
  336    HD2  LYS  47           HD2      LYS  47   3.124   4.540   1.882
  337    HD3  LYS  47           HD1      LYS  47   2.001   4.823   0.560
  338    HE2  LYS  47           HE2      LYS  47   0.667   6.222   1.781
  339    HE3  LYS  47           HE1      LYS  47   1.059   5.440   3.309
  340    HZ1  LYS  47           HZ1      LYS  47   3.153   6.560   3.391
  341    HZ2  LYS  47           HZ2      LYS  47   1.974   7.728   3.051
  342    HZ3  LYS  47           HZ3      LYS  47   2.969   7.155   1.811
  343    H    LYS  48           HN       LYS  48  -0.955   1.570   4.327
  344    HA   LYS  48           HA       LYS  48  -2.879   3.692   5.005
  345    HB2  LYS  48           HB2      LYS  48  -3.578   1.431   5.674
  346    HB3  LYS  48           HB1      LYS  48  -2.099   1.250   6.611
  347    HG2  LYS  48           HG2      LYS  48  -2.793   2.693   8.258
  348    HG3  LYS  48           HG1      LYS  48  -3.913   3.545   7.195
  349    HD2  LYS  48           HD2      LYS  48  -5.286   2.322   8.631
  350    HD3  LYS  48           HD1      LYS  48  -5.241   1.362   7.153
  351    HE2  LYS  48           HE2      LYS  48  -4.976  -0.198   8.874
  352    HE3  LYS  48           HE1      LYS  48  -3.343   0.057   8.261
  353    HZ1  LYS  48           HZ1      LYS  48  -4.546   1.236  10.717
  354    HZ2  LYS  48           HZ2      LYS  48  -3.021   1.661  10.122
  355    HZ3  LYS  48           HZ3      LYS  48  -3.309   0.079  10.653
  356    H    THR  49           HN       THR  49  -1.922   5.492   5.634
  357    HA   THR  49           HA       THR  49   0.681   5.606   6.774
  358    HB   THR  49           HB       THR  49  -0.125   8.018   7.331
  359    HG1  THR  49           HG1      THR  49  -2.419   7.243   6.920
  360   HG21  THR  49          HG21      THR  49  -0.020   7.092   4.457
  361   HG22  THR  49          HG22      THR  49   1.386   7.422   5.472
  362   HG23  THR  49          HG23      THR  49   0.281   8.728   5.038
  363    H    LEU  50           HN       LEU  50   0.813   4.428   8.644
  364    HA   LEU  50           HA       LEU  50  -0.933   4.724  10.874
  365    HB2  LEU  50           HB2      LEU  50   2.022   4.206  11.081
  366    HB3  LEU  50           HB1      LEU  50   0.734   3.576  12.092
  367    HG   LEU  50           HG       LEU  50   1.101   2.770   9.203
  368   HD11  LEU  50          HD11      LEU  50   2.138   0.736  10.079
  369   HD12  LEU  50          HD12      LEU  50   2.104   1.424  11.702
  370   HD13  LEU  50          HD13      LEU  50   3.087   2.177  10.445
  371   HD21  LEU  50          HD21      LEU  50  -0.313   0.897   9.830
  372   HD22  LEU  50          HD22      LEU  50  -1.132   2.432  10.119
  373   HD23  LEU  50          HD23      LEU  50  -0.444   1.531  11.471
  374    H    VAL  51           HN       VAL  51   2.221   5.978  10.084
  375    HA   VAL  51           HA       VAL  51   1.493   8.653  11.054
  376    HB   VAL  51           HB       VAL  51   4.172   7.313  11.438
  377   HG11  VAL  51          HG11      VAL  51   4.803   9.344  12.658
  378   HG12  VAL  51          HG12      VAL  51   3.241  10.059  12.267
  379   HG13  VAL  51          HG13      VAL  51   4.390   9.690  10.980
  380   HG21  VAL  51          HG21      VAL  51   3.707   7.525  13.860
  381   HG22  VAL  51          HG22      VAL  51   2.593   6.438  13.028
  382   HG23  VAL  51          HG23      VAL  51   2.077   8.068  13.462
  383    HA   PRO  52           HA       PRO  52   3.454   9.176   7.053
  384    HB2  PRO  52           HB2      PRO  52   2.090  11.292   6.285
  385    HB3  PRO  52           HB1      PRO  52   1.277   9.754   6.621
  386    HG2  PRO  52           HG2      PRO  52   1.317  12.247   8.240
  387    HG3  PRO  52           HG1      PRO  52   0.038  11.029   8.089
  388    HD2  PRO  52           HD2      PRO  52   2.098  11.220  10.103
  389    HD3  PRO  52           HD1      PRO  52   0.796  10.017   9.970
  390    H    GLY  53           HN       GLY  53   5.192   9.889   9.093
  391    HA2  GLY  53           HA2      GLY  53   7.214  11.029   9.017
  392    HA3  GLY  53           HA1      GLY  53   6.541  12.093   7.792
  393    HA   PRO  54           HA       PRO  54   6.396  14.147  12.109
  394    HB2  PRO  54           HB2      PRO  54   8.877  15.277  12.175
  395    HB3  PRO  54           HB1      PRO  54   8.495  13.748  12.976
  396    HG2  PRO  54           HG2      PRO  54   9.858  14.233  10.359
  397    HG3  PRO  54           HG1      PRO  54  10.221  13.031  11.612
  398    HD2  PRO  54           HD2      PRO  54   8.869  12.429   9.333
  399    HD3  PRO  54           HD1      PRO  54   8.603  11.580  10.868
  400    HA   PRO  55           HA       PRO  55   5.168  17.687   9.787
  401    HB2  PRO  55           HB2      PRO  55   6.228  19.244  12.109
  402    HB3  PRO  55           HB1      PRO  55   4.659  19.357  11.300
  403    HG2  PRO  55           HG2      PRO  55   4.878  18.121  13.642
  404    HG3  PRO  55           HG1      PRO  55   3.823  17.476  12.369
  405    HD2  PRO  55           HD2      PRO  55   6.490  16.508  13.289
  406    HD3  PRO  55           HD1      PRO  55   5.099  15.587  12.686
  407    H    GLY  56           HN       GLY  56   6.456  17.999   8.071
  408    HA2  GLY  56           HA2      GLY  56   7.966  19.555   7.020
  409    HA3  GLY  56           HA1      GLY  56   8.930  19.536   8.489
  410    H    SER  57           HN       SER  57   7.634  16.605   7.096
  411    HA   SER  57           HA       SER  57  10.219  15.463   6.769
  412    HB2  SER  57           HB2      SER  57   8.482  13.796   5.462
  413    HB3  SER  57           HB1      SER  57   8.811  13.739   7.201
  414    HG   SER  57           HG       SER  57   6.509  14.141   6.090
  415    H    SER  58           HN       SER  58  10.041  14.011   4.504
  416    HA   SER  58           HA       SER  58   9.510  15.688   2.230
  417    HB2  SER  58           HB2      SER  58  11.788  16.424   2.883
  418    HB3  SER  58           HB1      SER  58  12.332  14.747   2.823
  419    HG   SER  58           HG       SER  58  12.192  14.747   0.670
  420    H    ARG  59           HN       ARG  59   9.042  14.424   0.498
  421    HA   ARG  59           HA       ARG  59   9.056  11.559   0.977
  422    HB2  ARG  59           HB2      ARG  59   7.536  13.431  -0.735
  423    HB3  ARG  59           HB1      ARG  59   7.776  11.800  -1.379
  424    HG2  ARG  59           HG2      ARG  59   6.729  10.836   0.551
  425    HG3  ARG  59           HG1      ARG  59   6.637  12.409   1.343
  426    HD2  ARG  59           HD2      ARG  59   5.330  11.989  -1.316
  427    HD3  ARG  59           HD1      ARG  59   4.535  11.432   0.160
  428    HE   ARG  59           HE       ARG  59   5.228  14.009   0.711
  429   HH11  ARG  59          HH11      ARG  59   3.410  12.484  -1.859
  430   HH12  ARG  59          HH12      ARG  59   2.327  13.828  -2.068
  431   HH21  ARG  59          HH21      ARG  59   3.829  15.771   0.437
  432   HH22  ARG  59          HH22      ARG  59   2.590  15.718  -0.777
  433    HA   PRO  60           HA       PRO  60  12.971  11.286  -1.201
  434    HB2  PRO  60           HB2      PRO  60  12.811   8.510  -1.371
  435    HB3  PRO  60           HB1      PRO  60  13.523   9.411  -0.026
  436    HG2  PRO  60           HG2      PRO  60  10.773   8.254  -0.300
  437    HG3  PRO  60           HG1      PRO  60  11.853   8.256   1.112
  438    HD2  PRO  60           HD2      PRO  60   9.829   9.955   1.007
  439    HD3  PRO  60           HD1      PRO  60  11.411  10.504   1.590
  440    H    VAL  61           HN       VAL  61  13.637  10.853  -3.308
  441    HA   VAL  61           HA       VAL  61  11.426  10.251  -5.155
  442    HB   VAL  61           HB       VAL  61  12.462  11.483  -6.834
  443   HG11  VAL  61          HG11      VAL  61  13.183  12.899  -4.279
  444   HG12  VAL  61          HG12      VAL  61  11.635  12.962  -5.119
  445   HG13  VAL  61          HG13      VAL  61  13.074  13.654  -5.868
  446   HG21  VAL  61          HG21      VAL  61  14.652  10.462  -6.757
  447   HG22  VAL  61          HG22      VAL  61  15.050  11.366  -5.293
  448   HG23  VAL  61          HG23      VAL  61  14.802  12.219  -6.817
  449    H    LYS  62           HN       LYS  62  11.920   8.902  -6.998
  450    HA   LYS  62           HA       LYS  62  13.271   6.524  -6.314
  451    HB2  LYS  62           HB2      LYS  62  12.273   7.626  -8.941
  452    HB3  LYS  62           HB1      LYS  62  13.004   6.035  -8.791
  453    HG2  LYS  62           HG2      LYS  62  11.257   5.285  -7.356
  454    HG3  LYS  62           HG1      LYS  62  10.575   6.915  -7.246
  455    HD2  LYS  62           HD2      LYS  62  10.118   6.887  -9.623
  456    HD3  LYS  62           HD1      LYS  62  10.825   5.277  -9.764
  457    HE2  LYS  62           HE2      LYS  62   8.468   4.988  -9.700
  458    HE3  LYS  62           HE1      LYS  62   9.087   4.478  -8.133
  459    HZ1  LYS  62           HZ1      LYS  62   7.051   5.893  -8.065
  460    HZ2  LYS  62           HZ2      LYS  62   7.977   7.180  -8.658
  461    HZ3  LYS  62           HZ3      LYS  62   8.348   6.492  -7.157
  462    H    GLY  63           HN       GLY  63  15.339   6.109  -6.335
  463    HA2  GLY  63           HA2      GLY  63  17.445   6.274  -7.697
  464    HA3  GLY  63           HA1      GLY  63  17.135   8.008  -7.698
  465    H    GLN  64           HN       GLN  64  16.057   7.905  -4.960
  466    HA   GLN  64           HA       GLN  64  18.594   7.965  -3.539
  467    HB2  GLN  64           HB2      GLN  64  15.950   8.216  -2.137
  468    HB3  GLN  64           HB1      GLN  64  17.478   9.036  -1.798
  469    HG2  GLN  64           HG2      GLN  64  15.667   9.627  -4.128
  470    HG3  GLN  64           HG1      GLN  64  15.748  10.540  -2.628
  471   HE21  GLN  64          HE21      GLN  64  17.561   9.636  -5.476
  472   HE22  GLN  64          HE22      GLN  64  18.671  10.965  -5.414
  473    H    VAL  65           HN       VAL  65  19.375   6.239  -2.422
  474    HA   VAL  65           HA       VAL  65  17.673   3.925  -2.181
  475    HB   VAL  65           HB       VAL  65  19.505   2.675  -1.426
  476   HG11  VAL  65          HG11      VAL  65  19.639   3.216  -3.765
  477   HG12  VAL  65          HG12      VAL  65  21.261   3.109  -3.082
  478   HG13  VAL  65          HG13      VAL  65  20.542   4.686  -3.408
  479   HG21  VAL  65          HG21      VAL  65  20.352   4.075   0.327
  480   HG22  VAL  65          HG22      VAL  65  20.955   5.252  -0.846
  481   HG23  VAL  65          HG23      VAL  65  21.675   3.643  -0.757
  482    H    VAL  66           HN       VAL  66  16.590   3.359  -0.472
  483    HA   VAL  66           HA       VAL  66  16.713   5.127   1.872
  484    HB   VAL  66           HB       VAL  66  14.229   4.867   2.005
  485   HG11  VAL  66          HG11      VAL  66  13.774   6.350  -0.051
  486   HG12  VAL  66          HG12      VAL  66  15.513   6.238  -0.330
  487   HG13  VAL  66          HG13      VAL  66  14.902   6.934   1.168
  488   HG21  VAL  66          HG21      VAL  66  14.183   2.818   0.528
  489   HG22  VAL  66          HG22      VAL  66  14.416   3.907  -0.848
  490   HG23  VAL  66          HG23      VAL  66  12.974   4.046   0.156
  491    H    THR  67           HN       THR  67  16.298   4.235   3.849
  492    HA   THR  67           HA       THR  67  16.475   1.322   3.939
  493    HB   THR  67           HB       THR  67  16.965   1.643   6.349
  494    HG1  THR  67           HG1      THR  67  17.538   3.917   6.897
  495   HG21  THR  67          HG21      THR  67  18.804   1.485   4.762
  496   HG22  THR  67          HG22      THR  67  19.203   2.592   6.071
  497   HG23  THR  67          HG23      THR  67  18.738   3.226   4.491
  498    H    VAL  68           HN       VAL  68  14.573   0.338   3.967
  499    HA   VAL  68           HA       VAL  68  12.502   1.535   5.662
  500    HB   VAL  68           HB       VAL  68  10.880   0.030   4.489
  501   HG11  VAL  68          HG11      VAL  68  10.827   1.379   2.408
  502   HG12  VAL  68          HG12      VAL  68  12.411   2.030   2.831
  503   HG13  VAL  68          HG13      VAL  68  11.022   2.347   3.869
  504   HG21  VAL  68          HG21      VAL  68  12.460  -1.639   3.669
  505   HG22  VAL  68          HG22      VAL  68  13.214  -0.433   2.624
  506   HG23  VAL  68          HG23      VAL  68  11.547  -0.933   2.337
  507    H    HIS  69           HN       HIS  69  11.561   0.352   7.275
  508    HA   HIS  69           HA       HIS  69  12.678  -2.333   7.722
  509    HB2  HIS  69           HB2      HIS  69  12.734  -0.838   9.704
  510    HB3  HIS  69           HB1      HIS  69  10.992  -0.620   9.588
  511    HD1  HIS  69           HD1      HIS  69  12.305  -1.871  12.143
  512    HD2  HIS  69           HD2      HIS  69  10.667  -4.027   8.992
  513    HE1  HIS  69           HE1      HIS  69  11.845  -4.196  13.019
  514    HE2  HIS  69           HE2      HIS  69  11.197  -5.520  11.030
  515    H    LEU  70           HN       LEU  70  11.511  -3.894   6.808
  516    HA   LEU  70           HA       LEU  70   8.613  -3.522   6.945
  517    HB2  LEU  70           HB2      LEU  70   8.215  -4.195   4.850
  518    HB3  LEU  70           HB1      LEU  70   9.826  -3.562   4.587
  519    HG   LEU  70           HG       LEU  70   9.298  -6.462   5.166
  520   HD11  LEU  70          HD11      LEU  70   9.426  -6.855   2.759
  521   HD12  LEU  70          HD12      LEU  70   9.550  -5.119   2.469
  522   HD13  LEU  70          HD13      LEU  70   8.067  -5.798   3.144
  523   HD21  LEU  70          HD21      LEU  70  11.490  -6.748   4.076
  524   HD22  LEU  70          HD22      LEU  70  11.583  -5.742   5.522
  525   HD23  LEU  70          HD23      LEU  70  11.626  -4.995   3.924
  526    H    GLN  71           HN       GLN  71   7.517  -4.948   7.891
  527    HA   GLN  71           HA       GLN  71   8.489  -7.720   8.081
  528    HB2  GLN  71           HB2      GLN  71   6.602  -6.746  10.133
  529    HB3  GLN  71           HB1      GLN  71   7.861  -7.963  10.280
  530    HG2  GLN  71           HG2      GLN  71   8.783  -6.391  11.587
  531    HG3  GLN  71           HG1      GLN  71   9.413  -5.832  10.041
  532   HE21  GLN  71          HE21      GLN  71   6.625  -4.973   9.310
  533   HE22  GLN  71          HE22      GLN  71   6.461  -3.448  10.107
  534    H    THR  72           HN       THR  72   7.233  -8.852   6.907
  535    HA   THR  72           HA       THR  72   4.728  -7.630   6.076
  536    HB   THR  72           HB       THR  72   6.429  -9.712   4.750
  537    HG1  THR  72           HG1      THR  72   7.350  -8.069   3.653
  538   HG21  THR  72          HG21      THR  72   4.114  -9.823   4.062
  539   HG22  THR  72          HG22      THR  72   5.112  -9.177   2.761
  540   HG23  THR  72          HG23      THR  72   4.112  -8.091   3.732
  541    H    SER  73           HN       SER  73   2.881  -8.540   6.525
  542    HA   SER  73           HA       SER  73   2.826 -11.252   7.613
  543    HB2  SER  73           HB2      SER  73   0.598  -9.193   7.654
  544    HB3  SER  73           HB1      SER  73   0.726 -10.652   8.634
  545    HG   SER  73           HG       SER  73   1.630  -9.419  10.049
  546    H    LEU  74           HN       LEU  74   1.055 -12.563   6.988
  547    HA   LEU  74           HA       LEU  74   0.393 -12.391   4.188
  548    HB2  LEU  74           HB2      LEU  74  -0.113 -14.404   6.359
  549    HB3  LEU  74           HB1      LEU  74  -0.797 -14.579   4.758
  550    HG   LEU  74           HG       LEU  74   2.059 -14.741   5.629
  551   HD11  LEU  74          HD11      LEU  74   0.312 -16.468   3.880
  552   HD12  LEU  74          HD12      LEU  74   0.806 -16.811   5.538
  553   HD13  LEU  74          HD13      LEU  74   2.009 -16.777   4.248
  554   HD21  LEU  74          HD21      LEU  74   2.725 -14.631   3.268
  555   HD22  LEU  74          HD22      LEU  74   2.047 -13.105   3.857
  556   HD23  LEU  74          HD23      LEU  74   1.070 -14.179   2.843
  557    H    GLU  75           HN       GLU  75  -1.886 -12.718   3.506
  558    HA   GLU  75           HA       GLU  75  -3.662 -10.879   4.570
  559    HB2  GLU  75           HB2      GLU  75  -5.417 -12.146   3.300
  560    HB3  GLU  75           HB1      GLU  75  -4.005 -11.697   2.359
  561    HG2  GLU  75           HG2      GLU  75  -3.126 -13.959   2.574
  562    HG3  GLU  75           HG1      GLU  75  -4.537 -14.415   3.530
  563    H    ASN  76           HN       ASN  76  -2.854 -14.055   5.620
  564    HA   ASN  76           HA       ASN  76  -5.178 -14.292   7.355
  565    HB2  ASN  76           HB2      ASN  76  -4.126 -16.464   8.021
  566    HB3  ASN  76           HB1      ASN  76  -4.468 -16.320   6.303
  567   HD21  ASN  76          HD21      ASN  76  -2.903 -16.560   4.871
  568   HD22  ASN  76          HD22      ASN  76  -1.227 -16.773   5.277
  569    H    GLY  77           HN       GLY  77  -2.231 -12.739   7.487
  570    HA2  GLY  77           HA2      GLY  77  -1.846 -11.343   9.417
  571    HA3  GLY  77           HA1      GLY  77  -2.443 -12.645  10.429
  572    H    THR  78           HN       THR  78  -0.749 -14.546   8.725
  573    HA   THR  78           HA       THR  78   1.377 -14.631  10.567
  574    HB   THR  78           HB       THR  78   1.009 -16.193   8.024
  575    HG1  THR  78           HG1      THR  78   0.065 -17.698   9.364
  576   HG21  THR  78          HG21      THR  78   2.608 -17.789   9.008
  577   HG22  THR  78          HG22      THR  78   2.871 -16.680  10.354
  578   HG23  THR  78          HG23      THR  78   3.356 -16.217   8.722
  579    H    ARG  79           HN       ARG  79   3.161 -13.475  10.614
  580    HA   ARG  79           HA       ARG  79   4.045 -12.008   8.311
  581    HB2  ARG  79           HB2      ARG  79   5.141 -12.274  11.094
  582    HB3  ARG  79           HB1      ARG  79   5.947 -11.343   9.833
  583    HG2  ARG  79           HG2      ARG  79   3.526 -10.318   9.563
  584    HG3  ARG  79           HG1      ARG  79   3.402 -10.813  11.252
  585    HD2  ARG  79           HD2      ARG  79   5.162  -9.402  11.902
  586    HD3  ARG  79           HD1      ARG  79   5.740  -9.218  10.243
  587    HE   ARG  79           HE       ARG  79   3.299  -8.125  10.086
  588   HH11  ARG  79          HH11      ARG  79   5.867  -7.671  12.407
  589   HH12  ARG  79          HH12      ARG  79   5.461  -6.013  12.737
  590   HH21  ARG  79          HH21      ARG  79   2.779  -5.916  10.479
  591   HH22  ARG  79          HH22      ARG  79   3.711  -5.007  11.627
  592    H    VAL  80           HN       VAL  80   5.461 -12.481   6.903
  593    HA   VAL  80           HA       VAL  80   6.640 -15.166   7.036
  594    HB   VAL  80           HB       VAL  80   6.607 -15.049   4.561
  595   HG11  VAL  80          HG11      VAL  80   3.970 -14.627   5.943
  596   HG12  VAL  80          HG12      VAL  80   4.830 -16.157   5.765
  597   HG13  VAL  80          HG13      VAL  80   4.180 -15.340   4.344
  598   HG21  VAL  80          HG21      VAL  80   6.680 -12.647   4.252
  599   HG22  VAL  80          HG22      VAL  80   5.102 -12.477   5.021
  600   HG23  VAL  80          HG23      VAL  80   5.245 -13.309   3.472
  601    H    GLN  81           HN       GLN  81   7.472 -11.945   7.151
  602    HA   GLN  81           HA       GLN  81  10.262 -12.492   6.853
  603    HB2  GLN  81           HB2      GLN  81  10.638 -10.797   5.054
  604    HB3  GLN  81           HB1      GLN  81   9.775 -12.227   4.504
  605    HG2  GLN  81           HG2      GLN  81   7.646 -10.927   4.824
  606    HG3  GLN  81           HG1      GLN  81   8.656  -9.495   5.040
  607   HE21  GLN  81          HE21      GLN  81   7.541 -11.913   2.841
  608   HE22  GLN  81          HE22      GLN  81   8.060 -11.135   1.391
  609    H    GLU  82           HN       GLU  82  11.533 -10.866   7.749
  610    HA   GLU  82           HA       GLU  82  10.250  -8.458   8.734
  611    HB2  GLU  82           HB2      GLU  82   9.807 -10.367  10.393
  612    HB3  GLU  82           HB1      GLU  82  11.531 -10.341  10.714
  613    HG2  GLU  82           HG2      GLU  82   9.867  -7.883  10.988
  614    HG3  GLU  82           HG1      GLU  82   9.964  -9.066  12.282
  615    H    GLU  83           HN       GLU  83  11.675  -7.061   7.934
  616    HA   GLU  83           HA       GLU  83  14.522  -7.536   8.479
  617    HB2  GLU  83           HB2      GLU  83  13.687  -5.970   6.070
  618    HB3  GLU  83           HB1      GLU  83  15.160  -6.884   6.338
  619    HG2  GLU  83           HG2      GLU  83  12.460  -8.136   5.880
  620    HG3  GLU  83           HG1      GLU  83  13.630  -7.812   4.603
  621    HA   PRO  84           HA       PRO  84  13.784  -3.728  10.685
  622    HB2  PRO  84           HB2      PRO  84  16.681  -3.954  11.229
  623    HB3  PRO  84           HB1      PRO  84  15.327  -3.854  12.358
  624    HG2  PRO  84           HG2      PRO  84  16.670  -6.140  11.984
  625    HG3  PRO  84           HG1      PRO  84  14.923  -6.123  12.282
  626    HD2  PRO  84           HD2      PRO  84  16.401  -6.484   9.706
  627    HD3  PRO  84           HD1      PRO  84  14.943  -7.311  10.295
  628    H    GLU  85           HN       GLU  85  15.935  -4.278   8.058
  629    HA   GLU  85           HA       GLU  85  15.822  -1.559   7.266
  630    HB2  GLU  85           HB2      GLU  85  17.558  -1.444   9.068
  631    HB3  GLU  85           HB1      GLU  85  18.561  -2.520   8.105
  632    HG2  GLU  85           HG2      GLU  85  19.009  -0.925   6.537
  633    HG3  GLU  85           HG1      GLU  85  17.528  -0.025   6.865
  634    H    LEU  86           HN       LEU  86  15.164  -2.130   5.427
  635    HA   LEU  86           HA       LEU  86  16.930  -3.629   3.639
  636    HB2  LEU  86           HB2      LEU  86  14.701  -4.538   3.737
  637    HB3  LEU  86           HB1      LEU  86  13.990  -2.950   3.547
  638    HG   LEU  86           HG       LEU  86  14.925  -2.855   1.261
  639   HD11  LEU  86          HD11      LEU  86  15.722  -4.929   0.212
  640   HD12  LEU  86          HD12      LEU  86  15.629  -5.745   1.773
  641   HD13  LEU  86          HD13      LEU  86  16.772  -4.424   1.535
  642   HD21  LEU  86          HD21      LEU  86  13.110  -5.188   1.860
  643   HD22  LEU  86          HD22      LEU  86  13.308  -4.433   0.278
  644   HD23  LEU  86          HD23      LEU  86  12.617  -3.512   1.614
  645    H    VAL  87           HN       VAL  87  18.266  -2.246   2.616
  646    HA   VAL  87           HA       VAL  87  17.213   0.398   1.880
  647    HB   VAL  87           HB       VAL  87  19.339   0.334   3.184
  648   HG11  VAL  87          HG11      VAL  87  20.501  -0.906   0.695
  649   HG12  VAL  87          HG12      VAL  87  20.305  -1.703   2.256
  650   HG13  VAL  87          HG13      VAL  87  21.410  -0.340   2.097
  651   HG21  VAL  87          HG21      VAL  87  20.550   1.933   1.758
  652   HG22  VAL  87          HG22      VAL  87  18.816   2.252   1.807
  653   HG23  VAL  87          HG23      VAL  87  19.527   1.467   0.399
  654    H    PHE  88           HN       PHE  88  16.951   0.940  -0.225
  655    HA   PHE  88           HA       PHE  88  18.121  -0.682  -2.342
  656    HB2  PHE  88           HB2      PHE  88  16.000  -1.282  -3.356
  657    HB3  PHE  88           HB1      PHE  88  16.091  -1.938  -1.723
  658    HD1  PHE  88           HD2      PHE  88  14.885  -0.713   0.129
  659    HD2  PHE  88           HD1      PHE  88  14.238   0.116  -3.997
  660    HE1  PHE  88           HE2      PHE  88  12.755   0.370   0.685
  661    HE2  PHE  88           HE1      PHE  88  12.105   1.201  -3.444
  662    HZ   PHE  88           HZ       PHE  88  11.341   1.301  -1.140
  663    H    THR  89           HN       THR  89  17.854   0.238  -4.421
  664    HA   THR  89           HA       THR  89  17.663   3.093  -4.448
  665    HB   THR  89           HB       THR  89  17.750   1.270  -6.858
  666    HG1  THR  89           HG1      THR  89  19.788   0.821  -6.418
  667   HG21  THR  89          HG21      THR  89  18.951   3.154  -7.869
  668   HG22  THR  89          HG22      THR  89  18.802   4.057  -6.361
  669   HG23  THR  89          HG23      THR  89  17.359   3.650  -7.294
  670    H    LEU  90           HN       LEU  90  15.711   4.026  -4.291
  671    HA   LEU  90           HA       LEU  90  13.228   2.903  -4.813
  672    HB2  LEU  90           HB2      LEU  90  13.800   5.084  -3.614
  673    HB3  LEU  90           HB1      LEU  90  13.855   5.821  -5.182
  674    HG   LEU  90           HG       LEU  90  11.515   5.356  -5.554
  675   HD11  LEU  90          HD11      LEU  90  10.155   4.274  -3.845
  676   HD12  LEU  90          HD12      LEU  90  11.596   3.999  -2.865
  677   HD13  LEU  90          HD13      LEU  90  11.423   3.197  -4.426
  678   HD21  LEU  90          HD21      LEU  90  12.172   7.367  -4.261
  679   HD22  LEU  90          HD22      LEU  90  11.903   6.455  -2.774
  680   HD23  LEU  90          HD23      LEU  90  10.559   6.781  -3.868
  681    H    GLY  91           HN       GLY  91  12.137   2.411  -6.640
  682    HA2  GLY  91           HA2      GLY  91  11.293   2.757  -8.779
  683    HA3  GLY  91           HA1      GLY  91  12.439   4.067  -9.003
  684    H    ASP  92           HN       ASP  92  14.133   1.516  -7.815
  685    HA   ASP  92           HA       ASP  92  15.132   0.846 -10.472
  686    HB2  ASP  92           HB2      ASP  92  16.683   1.461  -8.574
  687    HB3  ASP  92           HB1      ASP  92  16.217  -0.050  -7.797
  688    H    CYS  93           HN       CYS  93  12.833  -0.197  -8.399
  689    HA   CYS  93           HA       CYS  93  11.622  -2.096  -8.130
  690    HB2  CYS  93           HB2      CYS  93  12.951  -3.053 -10.667
  691    HB3  CYS  93           HB1      CYS  93  11.427  -3.613  -9.984
  692    HG   CYS  93           HG       CYS  93  12.079  -0.766 -11.715
  693    H    ASP  94           HN       ASP  94  14.363  -1.863  -7.062
  694    HA   ASP  94           HA       ASP  94  15.649  -4.355  -7.198
  695    HB2  ASP  94           HB2      ASP  94  16.853  -2.454  -6.323
  696    HB3  ASP  94           HB1      ASP  94  15.677  -2.253  -5.028
  697    H    VAL  95           HN       VAL  95  12.977  -3.133  -5.570
  698    HA   VAL  95           HA       VAL  95  12.702  -5.467  -3.808
  699    HB   VAL  95           HB       VAL  95  11.117  -3.954  -2.558
  700   HG11  VAL  95          HG11      VAL  95  12.914  -2.670  -1.511
  701   HG12  VAL  95          HG12      VAL  95  13.958  -3.008  -2.894
  702   HG13  VAL  95          HG13      VAL  95  13.428  -4.323  -1.844
  703   HG21  VAL  95          HG21      VAL  95  10.603  -2.412  -4.370
  704   HG22  VAL  95          HG22      VAL  95  12.295  -1.916  -4.456
  705   HG23  VAL  95          HG23      VAL  95  11.334  -1.529  -3.027
  706    H    ILE  96           HN       ILE  96   9.956  -4.818  -3.245
  707    HA   ILE  96           HA       ILE  96   8.694  -5.934  -5.605
  708    HB   ILE  96           HB       ILE  96   6.723  -6.214  -4.192
  709   HG12  ILE  96          HG12      ILE  96   8.362  -4.901  -2.005
  710   HG13  ILE  96          HG11      ILE  96   6.981  -4.170  -2.816
  711   HG21  ILE  96          HG21      ILE  96   8.367  -7.973  -4.136
  712   HG22  ILE  96          HG22      ILE  96   7.668  -7.780  -2.527
  713   HG23  ILE  96          HG23      ILE  96   9.275  -7.136  -2.875
  714   HD11  ILE  96          HD11      ILE  96   5.548  -5.956  -1.929
  715   HD12  ILE  96          HD12      ILE  96   6.329  -5.008  -0.661
  716   HD13  ILE  96          HD13      ILE  96   6.938  -6.614  -1.064
  717    H    GLN  97           HN       GLN  97   7.174  -4.817  -6.765
  718    HA   GLN  97           HA       GLN  97   7.654  -2.079  -7.032
  719    HB2  GLN  97           HB2      GLN  97   6.487  -3.919  -8.623
  720    HB3  GLN  97           HB1      GLN  97   5.062  -3.054  -8.061
  721    HG2  GLN  97           HG2      GLN  97   5.671  -1.981 -10.044
  722    HG3  GLN  97           HG1      GLN  97   6.264  -0.922  -8.765
  723   HE21  GLN  97          HE21      GLN  97   8.522  -0.711  -8.452
  724   HE22  GLN  97          HE22      GLN  97   9.647  -1.268  -9.636
  725    H    ALA  98           HN       ALA  98   5.259  -3.817  -5.190
  726    HA   ALA  98           HA       ALA  98   3.478  -1.787  -4.522
  727    HB1  ALA  98           HB1      ALA  98   4.548  -4.021  -2.796
  728    HB2  ALA  98           HB2      ALA  98   3.116  -4.073  -3.821
  729    HB3  ALA  98           HB3      ALA  98   3.144  -3.027  -2.409
  730    H    LEU  99           HN       LEU  99   6.553  -2.657  -3.057
  731    HA   LEU  99           HA       LEU  99   6.425  -0.547  -1.102
  732    HB2  LEU  99           HB2      LEU  99   7.564  -2.624  -0.547
  733    HB3  LEU  99           HB1      LEU  99   8.692  -2.374  -1.869
  734    HG   LEU  99           HG       LEU  99   9.578  -0.380  -0.750
  735   HD11  LEU  99          HD11      LEU  99   8.929   0.098   1.579
  736   HD12  LEU  99          HD12      LEU  99   7.632  -1.089   1.437
  737   HD13  LEU  99          HD13      LEU  99   7.613   0.364   0.434
  738   HD21  LEU  99          HD21      LEU  99  10.638  -2.527  -0.317
  739   HD22  LEU  99          HD22      LEU  99   9.525  -2.813   1.021
  740   HD23  LEU  99          HD23      LEU  99  10.692  -1.493   1.112
  741    H    ASP 100           HN       ASP 100   7.936  -1.117  -4.173
  742    HA   ASP 100           HA       ASP 100   9.840   0.953  -4.133
  743    HB2  ASP 100           HB2      ASP 100   9.846  -0.989  -5.685
  744    HB3  ASP 100           HB1      ASP 100   8.443  -0.324  -6.497
  745    H    LEU 101           HN       LEU 101   6.451   0.807  -4.917
  746    HA   LEU 101           HA       LEU 101   6.391   3.566  -5.794
  747    HB2  LEU 101           HB2      LEU 101   4.174   1.559  -5.422
  748    HB3  LEU 101           HB1      LEU 101   4.022   3.124  -6.178
  749    HG   LEU 101           HG       LEU 101   5.588   0.767  -7.204
  750   HD11  LEU 101          HD11      LEU 101   3.190   0.593  -7.532
  751   HD12  LEU 101          HD12      LEU 101   4.014   0.852  -9.068
  752   HD13  LEU 101          HD13      LEU 101   3.161   2.184  -8.289
  753   HD21  LEU 101          HD21      LEU 101   6.792   2.849  -7.659
  754   HD22  LEU 101          HD22      LEU 101   5.343   3.526  -8.405
  755   HD23  LEU 101          HD23      LEU 101   6.147   2.137  -9.137
  756    H    SER 102           HN       SER 102   5.583   1.679  -2.955
  757    HA   SER 102           HA       SER 102   3.831   3.545  -1.757
  758    HB2  SER 102           HB2      SER 102   3.766   1.227  -1.076
  759    HB3  SER 102           HB1      SER 102   5.455   1.281  -0.564
  760    HG   SER 102           HG       SER 102   4.828   2.791   1.038
  761    H    VAL 103           HN       VAL 103   7.302   3.131  -1.729
  762    HA   VAL 103           HA       VAL 103   7.907   4.708   0.506
  763    HB   VAL 103           HB       VAL 103   9.509   4.122  -1.954
  764   HG11  VAL 103          HG11      VAL 103  10.245   6.257  -0.949
  765   HG12  VAL 103          HG12      VAL 103  11.465   4.997  -0.793
  766   HG13  VAL 103          HG13      VAL 103  10.472   5.440   0.598
  767   HG21  VAL 103          HG21      VAL 103  10.793   2.778  -0.165
  768   HG22  VAL 103          HG22      VAL 103   9.246   2.155  -0.737
  769   HG23  VAL 103          HG23      VAL 103   9.344   2.987   0.815
  770    HA   PRO 104           HA       PRO 104   8.379   8.531  -2.444
  771    HB2  PRO 104           HB2      PRO 104   6.995   8.307  -4.821
  772    HB3  PRO 104           HB1      PRO 104   8.739   8.078  -4.648
  773    HG2  PRO 104           HG2      PRO 104   6.566   6.039  -4.785
  774    HG3  PRO 104           HG1      PRO 104   8.188   6.002  -5.491
  775    HD2  PRO 104           HD2      PRO 104   7.588   4.621  -3.276
  776    HD3  PRO 104           HD1      PRO 104   9.178   5.356  -3.523
  777    H    LEU 105           HN       LEU 105   5.570   6.486  -2.274
  778    HA   LEU 105           HA       LEU 105   3.703   8.678  -2.111
  779    HB2  LEU 105           HB2      LEU 105   3.552   5.721  -1.627
  780    HB3  LEU 105           HB1      LEU 105   2.194   6.774  -1.253
  781    HG   LEU 105           HG       LEU 105   3.350   6.074  -3.925
  782   HD11  LEU 105          HD11      LEU 105   0.561   6.066  -2.801
  783   HD12  LEU 105          HD12      LEU 105   1.589   4.659  -3.061
  784   HD13  LEU 105          HD13      LEU 105   1.008   5.590  -4.440
  785   HD21  LEU 105          HD21      LEU 105   1.926   7.798  -4.937
  786   HD22  LEU 105          HD22      LEU 105   3.190   8.494  -3.924
  787   HD23  LEU 105          HD23      LEU 105   1.533   8.404  -3.328
  788    H    MET 106           HN       MET 106   5.877   7.175   0.007
  789    HA   MET 106           HA       MET 106   4.421   8.093   2.388
  790    HB2  MET 106           HB2      MET 106   5.056   6.160   3.302
  791    HB3  MET 106           HB1      MET 106   5.751   5.694   1.763
  792    HG2  MET 106           HG2      MET 106   7.847   6.900   2.520
  793    HG3  MET 106           HG1      MET 106   7.093   6.956   4.117
  794    HE1  MET 106           HE1      MET 106   6.658   3.141   4.913
  795    HE2  MET 106           HE2      MET 106   5.486   4.184   4.104
  796    HE3  MET 106           HE3      MET 106   6.401   4.786   5.487
  797    H    ASP 107           HN       ASP 107   5.443   9.415   3.933
  798    HA   ASP 107           HA       ASP 107   7.554  11.086   2.819
  799    HB2  ASP 107           HB2      ASP 107   5.584  11.365   5.013
  800    HB3  ASP 107           HB1      ASP 107   7.128  12.177   5.250
  801    H    VAL 108           HN       VAL 108   9.443  11.670   4.043
  802    HA   VAL 108           HA       VAL 108  10.815   9.417   5.060
  803    HB   VAL 108           HB       VAL 108  11.442  12.325   4.823
  804   HG11  VAL 108          HG11      VAL 108  12.190  11.906   7.085
  805   HG12  VAL 108          HG12      VAL 108  13.589  12.009   6.011
  806   HG13  VAL 108          HG13      VAL 108  13.019  10.436   6.569
  807   HG21  VAL 108          HG21      VAL 108  12.903   9.796   4.073
  808   HG22  VAL 108          HG22      VAL 108  13.421  11.437   3.680
  809   HG23  VAL 108          HG23      VAL 108  11.925  10.794   2.997
  810    H    GLY 109           HN       GLY 109  10.713   8.523   6.937
  811    HA2  GLY 109           HA2      GLY 109  10.949   8.513   9.291
  812    HA3  GLY 109           HA1      GLY 109  10.348  10.166   9.326
  813    H    GLU 110           HN       GLU 110   8.538   8.022   7.331
  814    HA   GLU 110           HA       GLU 110   6.490   7.982   9.427
  815    HB2  GLU 110           HB2      GLU 110   4.823   7.991   7.830
  816    HB3  GLU 110           HB1      GLU 110   6.026   9.082   7.159
  817    HG2  GLU 110           HG2      GLU 110   6.648   7.543   5.516
  818    HG3  GLU 110           HG1      GLU 110   5.883   6.199   6.360
  819    H    THR 111           HN       THR 111   4.975   6.120   9.337
  820    HA   THR 111           HA       THR 111   6.248   3.681   8.369
  821    HB   THR 111           HB       THR 111   4.847   3.830  11.046
  822    HG1  THR 111           HG1      THR 111   7.321   4.622  10.384
  823   HG21  THR 111          HG21      THR 111   5.891   1.625  11.387
  824   HG22  THR 111          HG22      THR 111   6.554   1.697   9.754
  825   HG23  THR 111          HG23      THR 111   4.807   1.623   9.993
  826    H    ALA 112           HN       ALA 112   4.951   2.758   6.982
  827    HA   ALA 112           HA       ALA 112   2.056   3.181   7.302
  828    HB1  ALA 112           HB1      ALA 112   1.858   3.188   4.862
  829    HB2  ALA 112           HB2      ALA 112   3.610   3.036   4.720
  830    HB3  ALA 112           HB3      ALA 112   2.906   4.487   5.430
  831    H    MET 113           HN       MET 113   0.766   1.427   7.079
  832    HA   MET 113           HA       MET 113   2.115  -1.127   6.568
  833    HB2  MET 113           HB2      MET 113   0.901  -1.213   8.639
  834    HB3  MET 113           HB1      MET 113  -0.519  -0.474   7.907
  835    HG2  MET 113           HG2      MET 113  -1.080  -2.388   6.749
  836    HG3  MET 113           HG1      MET 113   0.514  -3.113   6.940
  837    HE1  MET 113           HE1      MET 113  -3.019  -2.593   8.362
  838    HE2  MET 113           HE2      MET 113  -2.117  -1.447   9.351
  839    HE3  MET 113           HE3      MET 113  -2.827  -2.882  10.092
  840    H    VAL 114           HN       VAL 114   1.922  -1.910   4.602
  841    HA   VAL 114           HA       VAL 114  -0.211  -0.815   2.886
  842    HB   VAL 114           HB       VAL 114   2.352  -2.056   1.942
  843   HG11  VAL 114          HG11      VAL 114   0.607  -1.829   0.268
  844   HG12  VAL 114          HG12      VAL 114   1.970  -0.767  -0.083
  845   HG13  VAL 114          HG13      VAL 114   0.493  -0.101   0.615
  846   HG21  VAL 114          HG21      VAL 114   1.882   0.843   2.534
  847   HG22  VAL 114          HG22      VAL 114   3.319   0.166   1.766
  848   HG23  VAL 114          HG23      VAL 114   2.930  -0.247   3.436
  849    H    THR 115           HN       THR 115  -1.641  -2.214   2.060
  850    HA   THR 115           HA       THR 115  -0.880  -5.039   2.127
  851    HB   THR 115           HB       THR 115  -3.661  -3.863   1.958
  852    HG1  THR 115           HG1      THR 115  -2.052  -4.653   4.045
  853   HG21  THR 115          HG21      THR 115  -4.410  -6.164   2.133
  854   HG22  THR 115          HG22      THR 115  -2.734  -6.715   2.165
  855   HG23  THR 115          HG23      THR 115  -3.386  -5.960   0.709
  856    H    ALA 116           HN       ALA 116  -0.166  -5.699   0.343
  857    HA   ALA 116           HA       ALA 116  -1.237  -4.641  -2.206
  858    HB1  ALA 116           HB1      ALA 116   1.017  -3.770  -1.751
  859    HB2  ALA 116           HB2      ALA 116   0.984  -4.839  -3.154
  860    HB3  ALA 116           HB3      ALA 116   1.615  -5.424  -1.613
  861    H    ASP 117           HN       ASP 117  -1.897  -6.160  -3.600
  862    HA   ASP 117           HA       ASP 117  -2.094  -8.860  -2.999
  863    HB2  ASP 117           HB2      ASP 117  -3.198  -7.575  -4.941
  864    HB3  ASP 117           HB1      ASP 117  -1.700  -7.886  -5.796
  865    H    SER 118           HN       SER 118  -0.872 -10.673  -3.632
  866    HA   SER 118           HA       SER 118   1.861 -10.493  -3.254
  867    HB2  SER 118           HB2      SER 118   0.207 -12.539  -3.229
  868    HB3  SER 118           HB1      SER 118   0.717 -12.710  -4.911
  869    HG   SER 118           HG       SER 118   1.974 -13.890  -3.263
  870    H    LYS 119           HN       LYS 119  -0.017 -10.221  -6.180
  871    HA   LYS 119           HA       LYS 119   1.928 -10.518  -8.127
  872    HB2  LYS 119           HB2      LYS 119   0.530  -8.866  -9.427
  873    HB3  LYS 119           HB1      LYS 119  -0.331 -10.267  -8.795
  874    HG2  LYS 119           HG2      LYS 119  -1.250  -8.937  -7.028
  875    HG3  LYS 119           HG1      LYS 119  -0.253  -7.559  -7.500
  876    HD2  LYS 119           HD2      LYS 119  -2.474  -7.217  -8.326
  877    HD3  LYS 119           HD1      LYS 119  -1.406  -7.540  -9.692
  878    HE2  LYS 119           HE2      LYS 119  -2.154  -9.951  -9.529
  879    HE3  LYS 119           HE1      LYS 119  -3.394  -9.393  -8.408
  880    HZ1  LYS 119           HZ1      LYS 119  -4.172  -7.850 -10.146
  881    HZ2  LYS 119           HZ2      LYS 119  -4.313  -9.473 -10.600
  882    HZ3  LYS 119           HZ3      LYS 119  -3.060  -8.533 -11.232
  883    H    TYR 120           HN       TYR 120   1.354  -7.779  -5.951
  884    HA   TYR 120           HA       TYR 120   3.499  -6.280  -7.266
  885    HB2  TYR 120           HB2      TYR 120   1.739  -5.494  -4.933
  886    HB3  TYR 120           HB1      TYR 120   2.905  -4.452  -5.742
  887    HD1  TYR 120           HD2      TYR 120  -0.351  -6.057  -5.956
  888    HD2  TYR 120           HD1      TYR 120   2.427  -3.517  -7.899
  889    HE1  TYR 120           HE2      TYR 120  -2.110  -5.375  -7.512
  890    HE2  TYR 120           HE1      TYR 120   0.675  -2.804  -9.490
  891    HH   TYR 120           HH       TYR 120  -2.648  -3.524  -8.998
  892    H    CYS 121           HN       CYS 121   3.347  -8.703  -5.222
  893    HA   CYS 121           HA       CYS 121   5.527  -7.737  -3.507
  894    HB2  CYS 121           HB2      CYS 121   3.361  -9.715  -2.797
  895    HB3  CYS 121           HB1      CYS 121   4.696  -9.244  -1.753
  896    HG   CYS 121           HG       CYS 121   1.766  -7.827  -2.110
  897    H    TYR 122           HN       TYR 122   4.327 -11.083  -3.611
  898    HA   TYR 122           HA       TYR 122   6.548 -11.821  -5.367
  899    HB2  TYR 122           HB2      TYR 122   6.160 -13.346  -2.788
  900    HB3  TYR 122           HB1      TYR 122   7.494 -13.419  -3.915
  901    HD1  TYR 122           HD2      TYR 122   9.255 -11.755  -3.889
  902    HD2  TYR 122           HD1      TYR 122   6.031 -11.552  -1.120
  903    HE1  TYR 122           HE2      TYR 122  10.536 -10.167  -2.523
  904    HE2  TYR 122           HE1      TYR 122   7.298  -9.964   0.247
  905    HH   TYR 122           HH       TYR 122   9.595  -9.285   0.651
  906    H    GLY 123           HN       GLY 123   3.686 -11.848  -5.870
  907    HA2  GLY 123           HA2      GLY 123   2.383 -14.233  -5.495
  908    HA3  GLY 123           HA1      GLY 123   2.219 -13.253  -6.944
  909    HA   PRO 124           HA       PRO 124   4.255 -16.573  -9.078
  910    HB2  PRO 124           HB2      PRO 124   5.071 -15.364 -11.323
  911    HB3  PRO 124           HB1      PRO 124   3.351 -15.549 -10.959
  912    HG2  PRO 124           HG2      PRO 124   5.093 -13.139 -10.711
  913    HG3  PRO 124           HG1      PRO 124   3.400 -13.257 -11.221
  914    HD2  PRO 124           HD2      PRO 124   4.280 -12.529  -8.676
  915    HD3  PRO 124           HD1      PRO 124   2.645 -13.077  -9.084
  916    H    GLN 125           HN       GLN 125   5.818 -14.456  -7.339
  917    HA   GLN 125           HA       GLN 125   8.482 -14.782  -8.566
  918    HB2  GLN 125           HB2      GLN 125   7.881 -12.934  -6.281
  919    HB3  GLN 125           HB1      GLN 125   9.141 -12.811  -7.499
  920    HG2  GLN 125           HG2      GLN 125   7.601 -12.095  -9.145
  921    HG3  GLN 125           HG1      GLN 125   6.223 -12.493  -8.117
  922   HE21  GLN 125          HE21      GLN 125   5.348 -10.484  -8.025
  923   HE22  GLN 125          HE22      GLN 125   6.094  -9.167  -7.199
  924    H    GLY 126           HN       GLY 126   6.741 -14.856  -5.508
  925    HA2  GLY 126           HA2      GLY 126   7.076 -16.099  -3.621
  926    HA3  GLY 126           HA1      GLY 126   8.389 -16.937  -4.433
  927    H    SER 127           HN       SER 127   8.079 -15.680  -1.762
  928    HA   SER 127           HA       SER 127   9.927 -13.494  -1.829
  929    HB2  SER 127           HB2      SER 127   8.040 -13.105  -0.434
  930    HB3  SER 127           HB1      SER 127   8.179 -14.683   0.310
  931    HG   SER 127           HG       SER 127   9.669 -13.920   1.641
  932    H    ARG 128           HN       ARG 128  11.650 -13.389  -0.134
  933    HA   ARG 128           HA       ARG 128  13.649 -15.183  -0.693
  934    HB2  ARG 128           HB2      ARG 128  13.272 -13.444   1.739
  935    HB3  ARG 128           HB1      ARG 128  14.723 -14.394   1.470
  936    HG2  ARG 128           HG2      ARG 128  15.354 -12.346   0.678
  937    HG3  ARG 128           HG1      ARG 128  14.812 -13.142  -0.797
  938    HD2  ARG 128           HD2      ARG 128  12.822 -11.917  -0.861
  939    HD3  ARG 128           HD1      ARG 128  12.965 -11.429   0.832
  940    HE   ARG 128           HE       ARG 128  15.057 -10.191  -0.035
  941   HH11  ARG 128          HH11      ARG 128  12.082 -10.596  -1.852
  942   HH12  ARG 128          HH12      ARG 128  12.333  -9.170  -2.811
  943   HH21  ARG 128          HH21      ARG 128  15.390  -8.335  -1.318
  944   HH22  ARG 128          HH22      ARG 128  14.206  -7.888  -2.505
  945    H    SER 129           HN       SER 129  12.200 -14.998   2.541
  946    HA   SER 129           HA       SER 129  13.047 -17.560   3.281
  947    HB2  SER 129           HB2      SER 129  10.849 -15.850   4.450
  948    HB3  SER 129           HB1      SER 129  11.559 -17.268   5.229
  949    HG   SER 129           HG       SER 129  12.947 -15.895   5.993
  950    HA   PRO 130           HA       PRO 130   8.998 -19.349   1.825
  951    HB2  PRO 130           HB2      PRO 130   6.669 -17.941   2.182
  952    HB3  PRO 130           HB1      PRO 130   7.460 -18.850   3.463
  953    HG2  PRO 130           HG2      PRO 130   7.105 -16.025   3.309
  954    HG3  PRO 130           HG1      PRO 130   8.005 -16.928   4.538
  955    HD2  PRO 130           HD2      PRO 130   9.004 -15.580   2.067
  956    HD3  PRO 130           HD1      PRO 130   9.788 -15.764   3.641
  957    H    TYR 131           HN       TYR 131   8.932 -19.524  -0.414
  958    HA   TYR 131           HA       TYR 131   8.272 -17.554  -2.244
  959    HB2  TYR 131           HB2      TYR 131   9.016 -19.800  -2.922
  960    HB3  TYR 131           HB1      TYR 131   7.527 -20.502  -2.308
  961    HD1  TYR 131           HD1      TYR 131   5.335 -19.819  -3.463
  962    HD2  TYR 131           HD2      TYR 131   9.164 -19.017  -5.129
  963    HE1  TYR 131           HE1      TYR 131   4.305 -19.511  -5.671
  964    HE2  TYR 131           HE2      TYR 131   8.137 -18.699  -7.342
  965    HH   TYR 131           HH       TYR 131   6.142 -19.318  -8.556
  966    H    ILE 132           HN       ILE 132   6.690 -16.165  -1.631
  967    HA   ILE 132           HA       ILE 132   4.352 -16.901  -0.262
  968    HB   ILE 132           HB       ILE 132   4.748 -14.432  -1.954
  969   HG12  ILE 132          HG12      ILE 132   6.580 -14.463  -0.429
  970   HG13  ILE 132          HG11      ILE 132   5.401 -13.300   0.160
  971   HG21  ILE 132          HG21      ILE 132   2.449 -14.839  -1.266
  972   HG22  ILE 132          HG22      ILE 132   3.111 -13.435  -0.427
  973   HG23  ILE 132          HG23      ILE 132   2.970 -14.979   0.416
  974   HD11  ILE 132          HD11      ILE 132   4.668 -14.826   1.845
  975   HD12  ILE 132          HD12      ILE 132   6.421 -14.626   1.912
  976   HD13  ILE 132          HD13      ILE 132   5.727 -16.087   1.205
  977    HA   PRO 133           HA       PRO 133   2.013 -18.761  -3.557
  978    HB2  PRO 133           HB2      PRO 133  -0.284 -17.698  -1.989
  979    HB3  PRO 133           HB1      PRO 133   0.020 -19.338  -2.576
  980    HG2  PRO 133           HG2      PRO 133   0.351 -18.728  -0.004
  981    HG3  PRO 133           HG1      PRO 133   1.460 -19.840  -0.832
  982    HD2  PRO 133           HD2      PRO 133   1.864 -16.986  -0.053
  983    HD3  PRO 133           HD1      PRO 133   3.025 -18.330  -0.069
  984    HA   PRO 134           HA       PRO 134   1.214 -15.333  -6.250
  985    HB2  PRO 134           HB2      PRO 134  -0.650 -17.226  -7.571
  986    HB3  PRO 134           HB1      PRO 134   0.681 -16.282  -8.257
  987    HG2  PRO 134           HG2      PRO 134   0.925 -18.913  -7.851
  988    HG3  PRO 134           HG1      PRO 134   2.286 -17.813  -7.562
  989    HD2  PRO 134           HD2      PRO 134   0.453 -19.125  -5.592
  990    HD3  PRO 134           HD1      PRO 134   2.198 -18.815  -5.473
  991    H    HIS 135           HN       HIS 135  -0.105 -13.717  -6.014
  992    HA   HIS 135           HA       HIS 135  -1.990 -12.449  -5.835
  993    HB2  HIS 135           HB2      HIS 135  -3.030 -14.901  -6.814
  994    HB3  HIS 135           HB1      HIS 135  -4.073 -14.378  -5.499
  995    HD1  HIS 135           HD1      HIS 135  -4.592 -11.559  -5.827
  996    HD2  HIS 135           HD2      HIS 135  -3.974 -13.990  -9.139
  997    HE1  HIS 135           HE1      HIS 135  -5.723 -10.397  -7.737
  998    HE2  HIS 135           HE2      HIS 135  -5.427 -11.931  -9.717
  999    H    ALA 136           HN       ALA 136  -0.781 -14.386  -3.519
 1000    HA   ALA 136           HA       ALA 136  -2.787 -14.188  -1.499
 1001    HB1  ALA 136           HB1      ALA 136  -1.000 -14.751   0.076
 1002    HB2  ALA 136           HB2      ALA 136   0.199 -14.502  -1.193
 1003    HB3  ALA 136           HB3      ALA 136  -0.966 -15.818  -1.328
 1004    H    ALA 137           HN       ALA 137  -3.351 -12.430  -0.303
 1005    HA   ALA 137           HA       ALA 137  -2.179  -9.946  -1.156
 1006    HB1  ALA 137           HB1      ALA 137  -3.882  -8.878   0.248
 1007    HB2  ALA 137           HB2      ALA 137  -4.340 -10.453   0.890
 1008    HB3  ALA 137           HB3      ALA 137  -4.579 -10.096  -0.816
 1009    H    LEU 138           HN       LEU 138  -0.406  -9.141  -0.313
 1010    HA   LEU 138           HA       LEU 138   0.591 -10.108   2.236
 1011    HB2  LEU 138           HB2      LEU 138   1.744  -9.394  -0.230
 1012    HB3  LEU 138           HB1      LEU 138   2.318  -8.219   0.937
 1013    HG   LEU 138           HG       LEU 138   3.232  -9.943   2.324
 1014   HD11  LEU 138          HD11      LEU 138   1.504 -11.621   1.992
 1015   HD12  LEU 138          HD12      LEU 138   3.120 -12.290   1.753
 1016   HD13  LEU 138          HD13      LEU 138   2.104 -11.917   0.359
 1017   HD21  LEU 138          HD21      LEU 138   3.950 -10.446  -0.547
 1018   HD22  LEU 138          HD22      LEU 138   4.933 -10.850   0.861
 1019   HD23  LEU 138          HD23      LEU 138   4.598  -9.162   0.471
 1020    H    CYS 139           HN       CYS 139   0.715  -8.914   4.043
 1021    HA   CYS 139           HA       CYS 139   0.010  -6.055   3.854
 1022    HB2  CYS 139           HB2      CYS 139  -1.661  -7.605   4.986
 1023    HB3  CYS 139           HB1      CYS 139  -0.445  -7.836   6.236
 1024    HG   CYS 139           HG       CYS 139  -0.833  -5.642   7.543
 1025    H    LEU 140           HN       LEU 140   1.913  -5.042   3.965
 1026    HA   LEU 140           HA       LEU 140   3.883  -6.022   5.925
 1027    HB2  LEU 140           HB2      LEU 140   5.574  -5.008   4.389
 1028    HB3  LEU 140           HB1      LEU 140   4.748  -6.429   3.775
 1029    HG   LEU 140           HG       LEU 140   3.206  -4.364   2.816
 1030   HD11  LEU 140          HD11      LEU 140   4.790  -2.780   1.812
 1031   HD12  LEU 140          HD12      LEU 140   6.111  -3.556   2.691
 1032   HD13  LEU 140          HD13      LEU 140   4.835  -2.720   3.573
 1033   HD21  LEU 140          HD21      LEU 140   4.153  -4.936   0.660
 1034   HD22  LEU 140          HD22      LEU 140   3.952  -6.397   1.629
 1035   HD23  LEU 140          HD23      LEU 140   5.551  -5.677   1.439
 1036    H    GLU 141           HN       GLU 141   4.786  -4.619   7.326
 1037    HA   GLU 141           HA       GLU 141   3.814  -1.856   7.197
 1038    HB2  GLU 141           HB2      GLU 141   3.195  -2.597   9.273
 1039    HB3  GLU 141           HB1      GLU 141   4.534  -3.722   9.388
 1040    HG2  GLU 141           HG2      GLU 141   6.019  -2.059  10.079
 1041    HG3  GLU 141           HG1      GLU 141   4.929  -0.752   9.613
 1042    H    VAL 142           HN       VAL 142   5.200  -0.317   6.601
 1043    HA   VAL 142           HA       VAL 142   8.044  -1.012   6.640
 1044    HB   VAL 142           HB       VAL 142   8.221   0.582   4.649
 1045   HG11  VAL 142          HG11      VAL 142   6.778  -2.051   4.341
 1046   HG12  VAL 142          HG12      VAL 142   8.522  -1.830   4.489
 1047   HG13  VAL 142          HG13      VAL 142   7.671  -1.210   3.075
 1048   HG21  VAL 142          HG21      VAL 142   5.258   0.013   4.563
 1049   HG22  VAL 142          HG22      VAL 142   6.195   0.737   3.257
 1050   HG23  VAL 142          HG23      VAL 142   6.018   1.588   4.789
 1051    H    THR 143           HN       THR 143   9.081   0.107   8.088
 1052    HA   THR 143           HA       THR 143   8.502   2.890   8.683
 1053    HB   THR 143           HB       THR 143  10.962   1.325   9.501
 1054    HG1  THR 143           HG1      THR 143   8.343   1.347  10.661
 1055   HG21  THR 143          HG21      THR 143   9.496   3.706  10.661
 1056   HG22  THR 143          HG22      THR 143  11.139   3.662  10.003
 1057   HG23  THR 143          HG23      THR 143  10.767   2.829  11.514
 1058    H    LEU 144           HN       LEU 144   9.115   4.400   7.203
 1059    HA   LEU 144           HA       LEU 144  11.641   4.038   5.784
 1060    HB2  LEU 144           HB2      LEU 144   9.674   5.060   4.630
 1061    HB3  LEU 144           HB1      LEU 144   9.747   6.400   5.757
 1062    HG   LEU 144           HG       LEU 144  11.969   7.011   4.908
 1063   HD11  LEU 144          HD11      LEU 144  12.869   5.959   2.911
 1064   HD12  LEU 144          HD12      LEU 144  11.550   4.786   2.920
 1065   HD13  LEU 144          HD13      LEU 144  12.730   4.799   4.229
 1066   HD21  LEU 144          HD21      LEU 144   9.921   6.701   2.721
 1067   HD22  LEU 144          HD22      LEU 144  11.266   7.841   2.742
 1068   HD23  LEU 144          HD23      LEU 144   9.959   7.995   3.915
 1069    H    LYS 145           HN       LYS 145  13.303   4.260   7.054
 1070    HA   LYS 145           HA       LYS 145  13.194   6.150   9.269
 1071    HB2  LYS 145           HB2      LYS 145  15.275   4.059   8.610
 1072    HB3  LYS 145           HB1      LYS 145  15.183   4.997  10.086
 1073    HG2  LYS 145           HG2      LYS 145  14.085   3.262  10.921
 1074    HG3  LYS 145           HG1      LYS 145  12.738   3.897   9.987
 1075    HD2  LYS 145           HD2      LYS 145  13.162   1.448   9.681
 1076    HD3  LYS 145           HD1      LYS 145  13.128   2.401   8.198
 1077    HE2  LYS 145           HE2      LYS 145  14.926   0.766   8.218
 1078    HE3  LYS 145           HE1      LYS 145  15.536   2.415   8.110
 1079    HZ1  LYS 145           HZ1      LYS 145  15.500   0.715  10.546
 1080    HZ2  LYS 145           HZ2      LYS 145  16.004   2.326  10.506
 1081    HZ3  LYS 145           HZ3      LYS 145  16.870   1.147   9.644
 1082    H    THR 146           HN       THR 146  14.549   5.798   6.168
 1083    HA   THR 146           HA       THR 146  16.162   8.158   6.446
 1084    HB   THR 146           HB       THR 146  17.406   5.447   6.045
 1085    HG1  THR 146           HG1      THR 146  17.070   7.045   8.246
 1086   HG21  THR 146          HG21      THR 146  18.746   8.160   6.031
 1087   HG22  THR 146          HG22      THR 146  18.516   7.108   4.635
 1088   HG23  THR 146          HG23      THR 146  19.574   6.603   5.952
 1089    H    ALA 147           HN       ALA 147  16.631   9.072   4.489
 1090    HA   ALA 147           HA       ALA 147  16.464   7.403   2.086
 1091    HB1  ALA 147           HB1      ALA 147  14.368   8.628   2.178
 1092    HB2  ALA 147           HB2      ALA 147  15.377   9.268   0.882
 1093    HB3  ALA 147           HB3      ALA 147  15.236  10.147   2.405
 1094    H    VAL 148           HN       VAL 148  18.278   7.606   0.881
 1095    HA   VAL 148           HA       VAL 148  19.781  10.120   1.135
 1096    HB   VAL 148           HB       VAL 148  21.903   9.003   1.377
 1097   HG11  VAL 148          HG11      VAL 148  21.655   8.022   3.612
 1098   HG12  VAL 148          HG12      VAL 148  19.908   7.922   3.368
 1099   HG13  VAL 148          HG13      VAL 148  20.704   9.498   3.437
 1100   HG21  VAL 148          HG21      VAL 148  21.474   6.974   0.107
 1101   HG22  VAL 148          HG22      VAL 148  20.385   6.400   1.369
 1102   HG23  VAL 148          HG23      VAL 148  22.106   6.587   1.709
 1103    H    ASP 149           HN       ASP 149  20.514  10.896  -0.745
 1104    HA   ASP 149           HA       ASP 149  19.672   9.656  -3.152
 1105    HB2  ASP 149           HB2      ASP 149  19.675  12.006  -3.128
 1106    HB3  ASP 149           HB1      ASP 149  21.349  12.091  -2.568
 1107    H    LEU 150           HN       LEU 150  20.667   8.110  -4.223
 1108    HA   LEU 150           HA       LEU 150  23.571   7.988  -4.317
 1109    HB2  LEU 150           HB2      LEU 150  22.208   6.488  -2.463
 1110    HB3  LEU 150           HB1      LEU 150  22.321   5.375  -3.810
 1111    HG   LEU 150           HG       LEU 150  24.155   4.980  -2.300
 1112   HD11  LEU 150          HD11      LEU 150  26.074   5.287  -3.772
 1113   HD12  LEU 150          HD12      LEU 150  25.146   6.424  -4.748
 1114   HD13  LEU 150          HD13      LEU 150  24.662   4.732  -4.672
 1115   HD21  LEU 150          HD21      LEU 150  25.836   6.725  -1.849
 1116   HD22  LEU 150          HD22      LEU 150  24.248   7.114  -1.188
 1117   HD23  LEU 150          HD23      LEU 150  24.803   7.894  -2.668
 1118    H    GLU 151           HN       GLU 151  21.458   8.666  -6.165
 1119    HA   GLU 151           HA       GLU 151  20.810   6.463  -7.845
 1120    HB2  GLU 151           HB2      GLU 151  19.767   8.904  -7.557
 1121    HB3  GLU 151           HB1      GLU 151  20.855   9.262  -8.888
 1122    HG2  GLU 151           HG2      GLU 151  18.736   7.126  -8.910
 1123    HG3  GLU 151           HG1      GLU 151  18.575   8.735  -9.617
 1124    H    HIS 152           HN       HIS 152  22.907   9.290  -8.459
 1125    HA   HIS 152           HA       HIS 152  24.547   7.564 -10.189
 1126    HB2  HIS 152           HB2      HIS 152  23.905  10.498 -10.373
 1127    HB3  HIS 152           HB1      HIS 152  25.331   9.831 -11.157
 1128    HD1  HIS 152           HD1      HIS 152  23.141  11.112 -12.837
 1129    HD2  HIS 152           HD2      HIS 152  23.305   7.048 -11.957
 1130    HE1  HIS 152           HE1      HIS 152  21.824   9.976 -14.647
 1131    HE2  HIS 152           HE2      HIS 152  21.782   7.538 -13.993
 1132    H    HIS 153           HN       HIS 153  26.327   6.949  -9.194
 1133    HA   HIS 153           HA       HIS 153  27.557   8.653  -7.162
 1134    HB2  HIS 153           HB2      HIS 153  27.203   6.112  -6.941
 1135    HB3  HIS 153           HB1      HIS 153  28.529   5.945  -8.086
 1136    HD1  HIS 153           HD1      HIS 153  30.897   6.759  -7.254
 1137    HD2  HIS 153           HD2      HIS 153  27.935   6.644  -4.344
 1138    HE1  HIS 153           HE1      HIS 153  32.111   6.871  -5.052
 1139    HE2  HIS 153           HE2      HIS 153  30.300   6.670  -3.300
 1140    H    HIS 154           HN       HIS 154  27.704   9.955  -9.418
 1141    HA   HIS 154           HA       HIS 154  30.010   9.227 -11.000
 1142    HB2  HIS 154           HB2      HIS 154  28.009  10.133 -12.081
 1143    HB3  HIS 154           HB1      HIS 154  28.156  11.614 -11.147
 1144    HD1  HIS 154           HD1      HIS 154  30.203   9.676 -13.729
 1145    HD2  HIS 154           HD2      HIS 154  29.471  13.566 -12.443
 1146    HE1  HIS 154           HE1      HIS 154  31.458  11.163 -15.314
 1147    HE2  HIS 154           HE2      HIS 154  30.798  13.505 -14.660
 1148    H    HIS 155           HN       HIS 155  29.361  11.094  -8.242
 1149    HA   HIS 155           HA       HIS 155  31.433  13.007  -8.422
 1150    HB2  HIS 155           HB2      HIS 155  29.805  11.872  -6.190
 1151    HB3  HIS 155           HB1      HIS 155  31.234  12.820  -5.794
 1152    HD1  HIS 155           HD1      HIS 155  28.069  13.564  -5.386
 1153    HD2  HIS 155           HD2      HIS 155  30.763  15.134  -8.140
 1154    HE1  HIS 155           HE1      HIS 155  27.151  15.810  -6.036
 1155    HE2  HIS 155           HE2      HIS 155  28.892  16.813  -7.569
 1156    H    HIS 156           HN       HIS 156  33.441  13.055  -7.361
 1157    HA   HIS 156           HA       HIS 156  35.473  12.302  -6.716
 1158    HB2  HIS 156           HB2      HIS 156  33.967  11.079  -4.989
 1159    HB3  HIS 156           HB1      HIS 156  34.279   9.646  -5.958
 1160    HD1  HIS 156           HD1      HIS 156  35.238   9.455  -3.190
 1161    HD2  HIS 156           HD2      HIS 156  37.554  11.214  -6.158
 1162    HE1  HIS 156           HE1      HIS 156  37.609   9.333  -2.362
 1163    HE2  HIS 156           HE2      HIS 156  38.947  10.622  -4.067
 1164    H    HIS 157           HN       HIS 157  34.325  11.806  -9.393
 1165    HA   HIS 157           HA       HIS 157  36.420   9.962 -10.266
 1166    HB2  HIS 157           HB2      HIS 157  34.205   8.720 -10.203
 1167    HB3  HIS 157           HB1      HIS 157  33.625   9.839 -11.428
 1168    HD1  HIS 157           HD1      HIS 157  33.523   7.069 -12.336
 1169    HD2  HIS 157           HD2      HIS 157  37.047   9.271 -12.587
 1170    HE1  HIS 157           HE1      HIS 157  34.911   5.939 -14.105
 1171    HE2  HIS 157           HE2      HIS 157  37.126   7.144 -14.055
  Start of MODEL   17
    1    H1   MET   1           HT1      MET   1 -55.490  32.581  -0.242
    2    H2   MET   1           HT2      MET   1 -56.812  33.109   0.670
    3    H3   MET   1           HT3      MET   1 -55.245  33.576   1.111
    4    HA   MET   1           HA       MET   1 -56.608  34.317  -1.411
    5    HB2  MET   1           HB2      MET   1 -55.982  36.057   0.982
    6    HB3  MET   1           HB1      MET   1 -56.833  36.539  -0.481
    7    HG2  MET   1           HG2      MET   1 -57.784  34.652   1.657
    8    HG3  MET   1           HG1      MET   1 -58.437  36.238   1.251
    9    HE1  MET   1           HE1      MET   1 -60.882  35.095   1.198
   10    HE2  MET   1           HE2      MET   1 -60.142  33.535   1.564
   11    HE3  MET   1           HE3      MET   1 -61.261  33.686   0.209
   12    H    GLY   2           HN       GLY   2 -55.282  35.185  -2.920
   13    HA2  GLY   2           HA2      GLY   2 -53.291  35.630  -3.979
   14    HA3  GLY   2           HA1      GLY   2 -52.739  36.299  -2.448
   15    H    GLN   3           HN       GLN   3 -53.566  33.061  -3.674
   16    HA   GLN   3           HA       GLN   3 -51.297  32.026  -2.124
   17    HB2  GLN   3           HB2      GLN   3 -53.472  31.109  -1.557
   18    HB3  GLN   3           HB1      GLN   3 -53.751  30.649  -3.230
   19    HG2  GLN   3           HG2      GLN   3 -51.855  29.083  -3.081
   20    HG3  GLN   3           HG1      GLN   3 -51.663  29.517  -1.381
   21   HE21  GLN   3          HE21      GLN   3 -52.322  26.942  -2.646
   22   HE22  GLN   3          HE22      GLN   3 -53.813  26.437  -1.926
   23    HA   PRO   4           HA       PRO   4 -49.585  31.020  -6.176
   24    HB2  PRO   4           HB2      PRO   4 -47.039  31.734  -5.574
   25    HB3  PRO   4           HB1      PRO   4 -48.263  32.901  -6.076
   26    HG2  PRO   4           HG2      PRO   4 -47.025  32.545  -3.457
   27    HG3  PRO   4           HG1      PRO   4 -48.005  33.892  -4.057
   28    HD2  PRO   4           HD2      PRO   4 -48.802  31.634  -2.385
   29    HD3  PRO   4           HD1      PRO   4 -49.696  33.121  -2.754
   30    HA   PRO   5           HA       PRO   5 -48.445  26.982  -4.455
   31    HB2  PRO   5           HB2      PRO   5 -48.006  25.851  -6.940
   32    HB3  PRO   5           HB1      PRO   5 -49.569  25.900  -6.121
   33    HG2  PRO   5           HG2      PRO   5 -48.498  27.663  -8.275
   34    HG3  PRO   5           HG1      PRO   5 -50.143  27.043  -8.047
   35    HD2  PRO   5           HD2      PRO   5 -49.469  29.578  -7.431
   36    HD3  PRO   5           HD1      PRO   5 -50.673  28.671  -6.490
   37    H    ALA   6           HN       ALA   6 -46.475  26.725  -3.665
   38    HA   ALA   6           HA       ALA   6 -44.178  27.743  -5.146
   39    HB1  ALA   6           HB1      ALA   6 -44.387  26.754  -2.299
   40    HB2  ALA   6           HB2      ALA   6 -44.395  28.440  -2.820
   41    HB3  ALA   6           HB3      ALA   6 -42.947  27.454  -3.037
   42    H    GLU   7           HN       GLU   7 -45.047  24.808  -3.330
   43    HA   GLU   7           HA       GLU   7 -43.405  23.281  -5.225
   44    HB2  GLU   7           HB2      GLU   7 -43.735  22.689  -2.277
   45    HB3  GLU   7           HB1      GLU   7 -42.767  21.767  -3.421
   46    HG2  GLU   7           HG2      GLU   7 -41.292  23.668  -3.737
   47    HG3  GLU   7           HG1      GLU   7 -42.276  24.633  -2.640
   48    H    GLU   8           HN       GLU   8 -45.370  22.984  -6.414
   49    HA   GLU   8           HA       GLU   8 -46.933  20.765  -5.298
   50    HB2  GLU   8           HB2      GLU   8 -48.226  22.960  -5.384
   51    HB3  GLU   8           HB1      GLU   8 -48.115  22.850  -7.139
   52    HG2  GLU   8           HG2      GLU   8 -49.273  20.679  -7.048
   53    HG3  GLU   8           HG1      GLU   8 -49.418  20.851  -5.303
   54    H    ALA   9           HN       ALA   9 -46.732  19.016  -6.484
   55    HA   ALA   9           HA       ALA   9 -45.246  19.091  -8.920
   56    HB1  ALA   9           HB1      ALA   9 -45.419  16.662  -8.876
   57    HB2  ALA   9           HB2      ALA   9 -46.622  16.757  -7.590
   58    HB3  ALA   9           HB3      ALA   9 -44.965  17.277  -7.284
   59    H    GLU  10           HN       GLU  10 -45.907  18.104 -10.908
   60    HA   GLU  10           HA       GLU  10 -48.500  19.031 -11.755
   61    HB2  GLU  10           HB2      GLU  10 -46.633  17.318 -13.390
   62    HB3  GLU  10           HB1      GLU  10 -47.788  18.518 -13.954
   63    HG2  GLU  10           HG2      GLU  10 -45.833  19.635 -14.262
   64    HG3  GLU  10           HG1      GLU  10 -46.238  20.167 -12.632
   65    H    GLN  11           HN       GLN  11 -46.988  16.030 -10.917
   66    HA   GLN  11           HA       GLN  11 -49.462  14.575 -11.541
   67    HB2  GLN  11           HB2      GLN  11 -47.686  12.606 -11.805
   68    HB3  GLN  11           HB1      GLN  11 -48.125  13.659 -13.147
   69    HG2  GLN  11           HG2      GLN  11 -46.162  15.028 -12.739
   70    HG3  GLN  11           HG1      GLN  11 -45.739  14.044 -11.342
   71   HE21  GLN  11          HE21      GLN  11 -43.718  13.661 -12.308
   72   HE22  GLN  11          HE22      GLN  11 -43.542  12.498 -13.574
   73    HA   PRO  12           HA       PRO  12 -48.726  13.804  -7.118
   74    HB2  PRO  12           HB2      PRO  12 -51.339  13.773  -6.424
   75    HB3  PRO  12           HB1      PRO  12 -50.424  15.274  -6.593
   76    HG2  PRO  12           HG2      PRO  12 -52.381  14.029  -8.464
   77    HG3  PRO  12           HG1      PRO  12 -52.106  15.740  -8.095
   78    HD2  PRO  12           HD2      PRO  12 -51.150  14.440 -10.338
   79    HD3  PRO  12           HD1      PRO  12 -50.461  15.928  -9.661
   80    H    GLY  13           HN       GLY  13 -48.166  11.723  -6.829
   81    HA2  GLY  13           HA2      GLY  13 -49.374   9.578  -6.173
   82    HA3  GLY  13           HA1      GLY  13 -50.012   9.639  -7.810
   83    H    ALA  14           HN       ALA  14 -47.333  10.767  -8.695
   84    HA   ALA  14           HA       ALA  14 -46.093   8.246  -9.268
   85    HB1  ALA  14           HB1      ALA  14 -44.463   9.562 -10.533
   86    HB2  ALA  14           HB2      ALA  14 -45.116  11.049  -9.845
   87    HB3  ALA  14           HB3      ALA  14 -46.110  10.060 -10.917
   88    H    LEU  15           HN       LEU  15 -44.659  11.177  -7.892
   89    HA   LEU  15           HA       LEU  15 -43.253  11.575  -6.179
   90    HB2  LEU  15           HB2      LEU  15 -44.980  10.512  -4.831
   91    HB3  LEU  15           HB1      LEU  15 -44.286   8.935  -5.153
   92    HG   LEU  15           HG       LEU  15 -42.237   9.604  -3.939
   93   HD11  LEU  15          HD11      LEU  15 -42.362  12.015  -4.310
   94   HD12  LEU  15          HD12      LEU  15 -42.253  11.642  -2.588
   95   HD13  LEU  15          HD13      LEU  15 -43.803  12.100  -3.295
   96   HD21  LEU  15          HD21      LEU  15 -43.202   9.537  -1.707
   97   HD22  LEU  15          HD22      LEU  15 -44.041   8.418  -2.781
   98   HD23  LEU  15          HD23      LEU  15 -44.781   9.964  -2.363
   99    H    ALA  16           HN       ALA  16 -41.287  11.562  -7.155
  100    HA   ALA  16           HA       ALA  16 -39.802   9.026  -7.188
  101    HB1  ALA  16           HB1      ALA  16 -38.198  10.150  -8.638
  102    HB2  ALA  16           HB2      ALA  16 -39.053  11.678  -8.440
  103    HB3  ALA  16           HB3      ALA  16 -39.825  10.340  -9.295
  104    H    ARG  17           HN       ARG  17 -38.967   8.695  -5.223
  105    HA   ARG  17           HA       ARG  17 -38.042  11.021  -3.709
  106    HB2  ARG  17           HB2      ARG  17 -37.957   9.315  -1.787
  107    HB3  ARG  17           HB1      ARG  17 -39.521   9.863  -2.360
  108    HG2  ARG  17           HG2      ARG  17 -39.910   7.628  -2.146
  109    HG3  ARG  17           HG1      ARG  17 -39.401   7.691  -3.827
  110    HD2  ARG  17           HD2      ARG  17 -37.457   7.130  -1.614
  111    HD3  ARG  17           HD1      ARG  17 -38.440   5.853  -2.324
  112    HE   ARG  17           HE       ARG  17 -36.886   7.473  -4.172
  113   HH11  ARG  17          HH11      ARG  17 -37.056   4.503  -2.307
  114   HH12  ARG  17          HH12      ARG  17 -35.901   3.681  -3.304
  115   HH21  ARG  17          HH21      ARG  17 -35.376   6.392  -5.456
  116   HH22  ARG  17          HH22      ARG  17 -34.945   4.745  -5.097
  117    H    GLU  18           HN       GLU  18 -36.113  10.873  -2.418
  118    HA   GLU  18           HA       GLU  18 -34.111   8.971  -3.436
  119    HB2  GLU  18           HB2      GLU  18 -33.802  11.840  -2.551
  120    HB3  GLU  18           HB1      GLU  18 -32.431  10.743  -2.682
  121    HG2  GLU  18           HG2      GLU  18 -32.907  10.430  -5.056
  122    HG3  GLU  18           HG1      GLU  18 -34.302  11.498  -4.920
  123    H    PHE  19           HN       PHE  19 -32.257   8.815  -1.657
  124    HA   PHE  19           HA       PHE  19 -33.330   8.773   1.032
  125    HB2  PHE  19           HB2      PHE  19 -33.289   6.402   1.339
  126    HB3  PHE  19           HB1      PHE  19 -34.228   6.697  -0.122
  127    HD1  PHE  19           HD2      PHE  19 -33.120   6.375  -2.361
  128    HD2  PHE  19           HD1      PHE  19 -31.348   5.088   1.288
  129    HE1  PHE  19           HE2      PHE  19 -31.594   4.910  -3.615
  130    HE2  PHE  19           HE1      PHE  19 -29.823   3.621   0.036
  131    HZ   PHE  19           HZ       PHE  19 -29.945   3.542  -2.420
  132    H    LEU  20           HN       LEU  20 -31.758   8.175   2.600
  133    HA   LEU  20           HA       LEU  20 -29.193   7.178   2.036
  134    HB2  LEU  20           HB2      LEU  20 -29.473  10.119   2.062
  135    HB3  LEU  20           HB1      LEU  20 -28.182   9.479   3.064
  136    HG   LEU  20           HG       LEU  20 -28.503   8.887   0.111
  137   HD11  LEU  20          HD11      LEU  20 -26.622  10.800   1.507
  138   HD12  LEU  20          HD12      LEU  20 -27.994  11.254   0.496
  139   HD13  LEU  20          HD13      LEU  20 -26.620  10.408  -0.215
  140   HD21  LEU  20          HD21      LEU  20 -26.238   8.000   0.290
  141   HD22  LEU  20          HD22      LEU  20 -27.330   7.150   1.382
  142   HD23  LEU  20          HD23      LEU  20 -26.220   8.361   2.018
  143    H    ALA  21           HN       ALA  21 -30.772   9.471   4.261
  144    HA   ALA  21           HA       ALA  21 -30.488   7.468   6.386
  145    HB1  ALA  21           HB1      ALA  21 -29.778   9.212   7.989
  146    HB2  ALA  21           HB2      ALA  21 -29.670  10.368   6.660
  147    HB3  ALA  21           HB3      ALA  21 -28.593   8.971   6.702
  148    H    ALA  22           HN       ALA  22 -32.611   7.034   6.635
  149    HA   ALA  22           HA       ALA  22 -34.430   9.320   7.007
  150    HB1  ALA  22           HB1      ALA  22 -35.112   6.522   6.093
  151    HB2  ALA  22           HB2      ALA  22 -34.994   7.944   5.058
  152    HB3  ALA  22           HB3      ALA  22 -36.252   7.853   6.290
  153    H    MET  23           HN       MET  23 -34.793   5.899   7.856
  154    HA   MET  23           HA       MET  23 -35.204   6.746  10.650
  155    HB2  MET  23           HB2      MET  23 -36.887   4.996  10.880
  156    HB3  MET  23           HB1      MET  23 -37.317   6.091   9.571
  157    HG2  MET  23           HG2      MET  23 -36.529   4.480   7.938
  158    HG3  MET  23           HG1      MET  23 -36.021   3.390   9.228
  159    HE1  MET  23           HE1      MET  23 -38.386   3.669  11.321
  160    HE2  MET  23           HE2      MET  23 -37.707   2.114  10.843
  161    HE3  MET  23           HE3      MET  23 -39.454   2.359  10.818
  162    H    GLU  24           HN       GLU  24 -33.311   4.924   8.596
  163    HA   GLU  24           HA       GLU  24 -32.140   3.453  10.808
  164    HB2  GLU  24           HB2      GLU  24 -33.929   1.979   9.866
  165    HB3  GLU  24           HB1      GLU  24 -33.104   2.031   8.315
  166    HG2  GLU  24           HG2      GLU  24 -32.465   0.006   9.283
  167    HG3  GLU  24           HG1      GLU  24 -31.086   1.078   9.519
  168    HA   PRO  25           HA       PRO  25 -28.646   4.546   8.178
  169    HB2  PRO  25           HB2      PRO  25 -26.975   3.637  10.359
  170    HB3  PRO  25           HB1      PRO  25 -27.223   5.284   9.777
  171    HG2  PRO  25           HG2      PRO  25 -28.093   4.378  12.211
  172    HG3  PRO  25           HG1      PRO  25 -28.843   5.721  11.331
  173    HD2  PRO  25           HD2      PRO  25 -29.710   2.866  11.539
  174    HD3  PRO  25           HD1      PRO  25 -30.692   4.347  11.543
  175    H    GLU  26           HN       GLU  26 -26.406   3.185   7.977
  176    HA   GLU  26           HA       GLU  26 -27.210   0.371   7.674
  177    HB2  GLU  26           HB2      GLU  26 -26.589   1.617   5.584
  178    HB3  GLU  26           HB1      GLU  26 -24.961   1.788   6.233
  179    HG2  GLU  26           HG2      GLU  26 -24.709  -0.633   6.283
  180    HG3  GLU  26           HG1      GLU  26 -26.355  -0.822   5.683
  181    HA   PRO  27           HA       PRO  27 -24.540  -0.735  11.031
  182    HB2  PRO  27           HB2      PRO  27 -24.208  -3.180   9.348
  183    HB3  PRO  27           HB1      PRO  27 -24.606  -3.042  11.065
  184    HG2  PRO  27           HG2      PRO  27 -26.500  -3.628   9.294
  185    HG3  PRO  27           HG1      PRO  27 -26.832  -2.527  10.645
  186    HD2  PRO  27           HD2      PRO  27 -26.381  -1.913   7.761
  187    HD3  PRO  27           HD1      PRO  27 -27.454  -1.122   8.933
  188    H    ALA  28           HN       ALA  28 -22.606   0.214  11.122
  189    HA   ALA  28           HA       ALA  28 -20.760   0.012   8.875
  190    HB1  ALA  28           HB1      ALA  28 -19.449   1.704  10.069
  191    HB2  ALA  28           HB2      ALA  28 -20.585   1.624  11.416
  192    HB3  ALA  28           HB3      ALA  28 -21.122   2.211   9.842
  193    HA   PRO  29           HA       PRO  29 -18.489  -3.244  10.906
  194    HB2  PRO  29           HB2      PRO  29 -16.502  -2.738   8.814
  195    HB3  PRO  29           HB1      PRO  29 -17.456  -4.195   9.116
  196    HG2  PRO  29           HG2      PRO  29 -17.902  -2.621   6.978
  197    HG3  PRO  29           HG1      PRO  29 -19.217  -3.466   7.814
  198    HD2  PRO  29           HD2      PRO  29 -18.384  -0.594   8.020
  199    HD3  PRO  29           HD1      PRO  29 -20.017  -1.290   7.930
  200    H    ALA  30           HN       ALA  30 -17.152  -3.018  12.578
  201    HA   ALA  30           HA       ALA  30 -15.469  -0.661  12.736
  202    HB1  ALA  30           HB1      ALA  30 -15.948  -2.774  14.830
  203    HB2  ALA  30           HB2      ALA  30 -16.853  -1.268  14.671
  204    HB3  ALA  30           HB3      ALA  30 -15.135  -1.226  15.063
  205    HA   PRO  31           HA       PRO  31 -12.046  -4.023  13.077
  206    HB2  PRO  31           HB2      PRO  31 -13.207  -6.606  12.397
  207    HB3  PRO  31           HB1      PRO  31 -12.374  -6.125  13.876
  208    HG2  PRO  31           HG2      PRO  31 -15.023  -6.685  13.805
  209    HG3  PRO  31           HG1      PRO  31 -14.320  -5.498  14.923
  210    HD2  PRO  31           HD2      PRO  31 -15.717  -5.036  12.304
  211    HD3  PRO  31           HD1      PRO  31 -15.924  -4.185  13.853
  212    H    ALA  32           HN       ALA  32 -12.909  -2.655  10.833
  213    HA   ALA  32           HA       ALA  32 -12.505  -4.470   8.565
  214    HB1  ALA  32           HB1      ALA  32 -14.449  -3.002   8.450
  215    HB2  ALA  32           HB2      ALA  32 -13.284  -2.601   7.188
  216    HB3  ALA  32           HB3      ALA  32 -13.409  -1.590   8.627
  217    HA   PRO  33           HA       PRO  33  -8.289  -3.171   8.177
  218    HB2  PRO  33           HB2      PRO  33  -8.549  -3.665   5.290
  219    HB3  PRO  33           HB1      PRO  33  -7.527  -4.476   6.478
  220    HG2  PRO  33           HG2      PRO  33  -9.660  -5.686   5.383
  221    HG3  PRO  33           HG1      PRO  33  -9.170  -5.981   7.061
  222    HD2  PRO  33           HD2      PRO  33 -11.380  -4.255   6.011
  223    HD3  PRO  33           HD1      PRO  33 -11.365  -5.331   7.425
  224    H    GLU  34           HN       GLU  34 -10.799  -1.876   6.156
  225    HA   GLU  34           HA       GLU  34 -11.249   0.224   5.444
  226    HB2  GLU  34           HB2      GLU  34 -10.063   1.168   7.359
  227    HB3  GLU  34           HB1      GLU  34  -8.525   0.955   6.541
  228    HG2  GLU  34           HG2      GLU  34  -9.152   2.585   4.867
  229    HG3  GLU  34           HG1      GLU  34 -10.746   2.749   5.598
  230    H    GLU  35           HN       GLU  35 -11.027   1.260   3.495
  231    HA   GLU  35           HA       GLU  35  -9.112   0.012   1.678
  232    HB2  GLU  35           HB2      GLU  35 -10.678   1.454   0.027
  233    HB3  GLU  35           HB1      GLU  35 -11.046  -0.190   0.526
  234    HG2  GLU  35           HG2      GLU  35 -12.286   1.002   2.492
  235    HG3  GLU  35           HG1      GLU  35 -12.274   2.381   1.391
  236    H    TRP  36           HN       TRP  36  -7.286   1.074   2.142
  237    HA   TRP  36           HA       TRP  36  -7.109   3.905   2.415
  238    HB2  TRP  36           HB2      TRP  36  -4.678   2.328   1.737
  239    HB3  TRP  36           HB1      TRP  36  -4.901   3.572   2.959
  240    HD1  TRP  36           HD1      TRP  36  -7.173   2.296   4.715
  241    HE1  TRP  36           HE1      TRP  36  -6.724   0.168   6.090
  242    HE3  TRP  36           HE3      TRP  36  -3.070   0.521   2.190
  243    HZ2  TRP  36           HZ2      TRP  36  -4.863  -1.949   6.122
  244    HZ3  TRP  36           HZ3      TRP  36  -2.038  -1.547   2.975
  245    HH2  TRP  36           HH2      TRP  36  -2.902  -2.765   4.883
  246    H    LEU  37           HN       LEU  37  -4.918   4.678   1.054
  247    HA   LEU  37           HA       LEU  37  -5.928   5.287  -1.534
  248    HB2  LEU  37           HB2      LEU  37  -4.473   6.799  -0.256
  249    HB3  LEU  37           HB1      LEU  37  -3.171   5.640  -0.360
  250    HG   LEU  37           HG       LEU  37  -3.208   5.922  -2.853
  251   HD11  LEU  37          HD11      LEU  37  -5.493   6.757  -3.044
  252   HD12  LEU  37          HD12      LEU  37  -4.328   7.854  -3.787
  253   HD13  LEU  37          HD13      LEU  37  -5.020   8.238  -2.210
  254   HD21  LEU  37          HD21      LEU  37  -1.559   7.058  -1.476
  255   HD22  LEU  37          HD22      LEU  37  -2.681   8.390  -1.202
  256   HD23  LEU  37          HD23      LEU  37  -2.058   8.084  -2.823
  257    H    ASP  38           HN       ASP  38  -5.995   3.794  -3.129
  258    HA   ASP  38           HA       ASP  38  -4.070   1.679  -3.248
  259    HB2  ASP  38           HB2      ASP  38  -6.489   1.558  -4.130
  260    HB3  ASP  38           HB1      ASP  38  -5.853   2.376  -5.558
  261    H    ILE  39           HN       ILE  39  -2.209   1.682  -4.111
  262    HA   ILE  39           HA       ILE  39  -1.003   4.025  -5.091
  263    HB   ILE  39           HB       ILE  39   0.014   1.198  -5.386
  264   HG12  ILE  39          HG12      ILE  39  -0.048   3.042  -3.007
  265   HG13  ILE  39          HG11      ILE  39  -0.532   1.359  -3.096
  266   HG21  ILE  39          HG21      ILE  39   2.216   2.221  -5.295
  267   HG22  ILE  39          HG22      ILE  39   1.485   3.818  -5.132
  268   HG23  ILE  39          HG23      ILE  39   1.268   2.896  -6.619
  269   HD11  ILE  39          HD11      ILE  39   1.526   1.620  -1.839
  270   HD12  ILE  39          HD12      ILE  39   2.294   2.371  -3.239
  271   HD13  ILE  39          HD13      ILE  39   1.790   0.683  -3.311
  272    H    LEU  40           HN       LEU  40  -2.536   1.297  -6.647
  273    HA   LEU  40           HA       LEU  40  -1.781   2.351  -9.290
  274    HB2  LEU  40           HB2      LEU  40  -2.953  -0.312  -8.500
  275    HB3  LEU  40           HB1      LEU  40  -2.742   0.203 -10.158
  276    HG   LEU  40           HG       LEU  40  -0.872  -1.097  -8.405
  277   HD11  LEU  40          HD11      LEU  40  -0.760  -0.257 -11.295
  278   HD12  LEU  40          HD12      LEU  40  -1.373  -1.788 -10.669
  279   HD13  LEU  40          HD13      LEU  40   0.340  -1.393 -10.520
  280   HD21  LEU  40          HD21      LEU  40   1.113   0.232  -8.887
  281   HD22  LEU  40          HD22      LEU  40  -0.040   1.124  -7.892
  282   HD23  LEU  40          HD23      LEU  40   0.102   1.482  -9.613
  283    H    GLY  41           HN       GLY  41  -4.156   2.522  -7.048
  284    HA2  GLY  41           HA2      GLY  41  -6.367   3.099  -7.026
  285    HA3  GLY  41           HA1      GLY  41  -6.141   3.659  -8.673
  286    H    ASN  42           HN       ASN  42  -5.432   0.377  -7.817
  287    HA   ASN  42           HA       ASN  42  -7.707  -0.436  -9.488
  288    HB2  ASN  42           HB2      ASN  42  -6.538  -2.368 -10.150
  289    HB3  ASN  42           HB1      ASN  42  -5.415  -1.037 -10.294
  290   HD21  ASN  42          HD21      ASN  42  -4.725  -1.005  -7.422
  291   HD22  ASN  42          HD22      ASN  42  -3.769  -2.422  -7.183
  292    H    GLY  43           HN       GLY  43  -6.284  -0.930  -6.330
  293    HA2  GLY  43           HA2      GLY  43  -7.947  -1.294  -4.574
  294    HA3  GLY  43           HA1      GLY  43  -8.757  -2.406  -5.669
  295    H    LEU  44           HN       LEU  44  -5.430  -2.712  -5.891
  296    HA   LEU  44           HA       LEU  44  -5.553  -5.151  -4.239
  297    HB2  LEU  44           HB2      LEU  44  -4.025  -4.503  -6.751
  298    HB3  LEU  44           HB1      LEU  44  -3.570  -5.842  -5.719
  299    HG   LEU  44           HG       LEU  44  -5.814  -6.824  -6.092
  300   HD11  LEU  44          HD11      LEU  44  -7.055  -4.807  -6.654
  301   HD12  LEU  44          HD12      LEU  44  -7.206  -6.034  -7.914
  302   HD13  LEU  44          HD13      LEU  44  -6.125  -4.661  -8.147
  303   HD21  LEU  44          HD21      LEU  44  -3.928  -7.589  -7.379
  304   HD22  LEU  44          HD22      LEU  44  -4.173  -6.293  -8.549
  305   HD23  LEU  44          HD23      LEU  44  -5.377  -7.572  -8.385
  306    H    LEU  45           HN       LEU  45  -3.850  -2.241  -4.921
  307    HA   LEU  45           HA       LEU  45  -1.722  -2.950  -3.023
  308    HB2  LEU  45           HB2      LEU  45  -0.768  -3.087  -5.150
  309    HB3  LEU  45           HB1      LEU  45  -1.630  -1.685  -5.728
  310    HG   LEU  45           HG       LEU  45  -0.195  -0.227  -4.392
  311   HD11  LEU  45          HD11      LEU  45   1.264  -2.747  -3.632
  312   HD12  LEU  45          HD12      LEU  45   0.260  -1.782  -2.550
  313   HD13  LEU  45          HD13      LEU  45   1.737  -1.097  -3.229
  314   HD21  LEU  45          HD21      LEU  45   1.839  -0.556  -5.665
  315   HD22  LEU  45          HD22      LEU  45   0.420  -0.843  -6.677
  316   HD23  LEU  45          HD23      LEU  45   1.347  -2.207  -6.047
  317    H    ARG  46           HN       ARG  46  -2.173  -1.730  -1.213
  318    HA   ARG  46           HA       ARG  46  -2.695   1.153  -1.624
  319    HB2  ARG  46           HB2      ARG  46  -4.253  -0.728   0.145
  320    HB3  ARG  46           HB1      ARG  46  -4.367   1.023   0.235
  321    HG2  ARG  46           HG2      ARG  46  -5.230   1.167  -1.947
  322    HG3  ARG  46           HG1      ARG  46  -4.907  -0.532  -2.268
  323    HD2  ARG  46           HD2      ARG  46  -6.870   0.565  -0.254
  324    HD3  ARG  46           HD1      ARG  46  -7.279  -0.138  -1.818
  325    HE   ARG  46           HE       ARG  46  -5.760  -1.932  -0.207
  326   HH11  ARG  46          HH11      ARG  46  -8.990  -0.702  -0.741
  327   HH12  ARG  46          HH12      ARG  46  -9.777  -2.081  -0.040
  328   HH21  ARG  46          HH21      ARG  46  -6.769  -3.737   0.733
  329   HH22  ARG  46          HH22      ARG  46  -8.500  -3.811   0.808
  330    H    LYS  47           HN       LYS  47  -1.912   2.540  -0.043
  331    HA   LYS  47           HA       LYS  47  -0.254   1.278   2.065
  332    HB2  LYS  47           HB2      LYS  47   0.953   2.611   0.249
  333    HB3  LYS  47           HB1      LYS  47   0.177   4.037   0.918
  334    HG2  LYS  47           HG2      LYS  47   1.232   3.009   3.153
  335    HG3  LYS  47           HG1      LYS  47   2.387   2.399   1.968
  336    HD2  LYS  47           HD2      LYS  47   3.185   4.487   2.822
  337    HD3  LYS  47           HD1      LYS  47   2.688   4.710   1.153
  338    HE2  LYS  47           HE2      LYS  47   0.721   5.846   1.778
  339    HE3  LYS  47           HE1      LYS  47   0.870   5.327   3.457
  340    HZ1  LYS  47           HZ1      LYS  47   2.854   6.696   3.675
  341    HZ2  LYS  47           HZ2      LYS  47   1.517   7.627   3.216
  342    HZ3  LYS  47           HZ3      LYS  47   2.691   7.219   2.066
  343    H    LYS  48           HN       LYS  48  -0.804   1.710   4.109
  344    HA   LYS  48           HA       LYS  48  -2.609   3.982   4.628
  345    HB2  LYS  48           HB2      LYS  48  -3.532   1.775   5.211
  346    HB3  LYS  48           HB1      LYS  48  -2.164   1.484   6.277
  347    HG2  LYS  48           HG2      LYS  48  -2.849   3.345   7.691
  348    HG3  LYS  48           HG1      LYS  48  -4.197   3.685   6.606
  349    HD2  LYS  48           HD2      LYS  48  -4.967   2.440   8.548
  350    HD3  LYS  48           HD1      LYS  48  -5.136   1.466   7.087
  351    HE2  LYS  48           HE2      LYS  48  -3.184   0.190   7.640
  352    HE3  LYS  48           HE1      LYS  48  -2.804   1.263   8.987
  353    HZ1  LYS  48           HZ1      LYS  48  -5.114  -0.594   8.784
  354    HZ2  LYS  48           HZ2      LYS  48  -4.928   0.550  10.018
  355    HZ3  LYS  48           HZ3      LYS  48  -3.801  -0.704   9.852
  356    H    THR  49           HN       THR  49  -1.707   5.662   5.545
  357    HA   THR  49           HA       THR  49   0.829   5.621   6.833
  358    HB   THR  49           HB       THR  49   0.068   7.998   7.522
  359    HG1  THR  49           HG1      THR  49  -2.204   7.496   7.131
  360   HG21  THR  49          HG21      THR  49   0.264   7.231   4.608
  361   HG22  THR  49          HG22      THR  49   1.609   7.581   5.691
  362   HG23  THR  49          HG23      THR  49   0.476   8.860   5.256
  363    H    LEU  50           HN       LEU  50   0.867   4.341   8.657
  364    HA   LEU  50           HA       LEU  50  -1.010   4.537  10.800
  365    HB2  LEU  50           HB2      LEU  50   1.916   3.917  11.146
  366    HB3  LEU  50           HB1      LEU  50   0.554   3.287  12.054
  367    HG   LEU  50           HG       LEU  50   1.044   2.603   9.159
  368   HD11  LEU  50          HD11      LEU  50   2.006   0.509   9.971
  369   HD12  LEU  50          HD12      LEU  50   1.904   1.105  11.629
  370   HD13  LEU  50          HD13      LEU  50   2.962   1.907  10.463
  371   HD21  LEU  50          HD21      LEU  50  -1.237   2.274   9.987
  372   HD22  LEU  50          HD22      LEU  50  -0.616   1.283  11.307
  373   HD23  LEU  50          HD23      LEU  50  -0.446   0.739   9.638
  374    H    VAL  51           HN       VAL  51   2.209   5.747  10.245
  375    HA   VAL  51           HA       VAL  51   1.487   8.375  11.343
  376    HB   VAL  51           HB       VAL  51   4.153   6.987  11.705
  377   HG11  VAL  51          HG11      VAL  51   3.200   9.675  12.683
  378   HG12  VAL  51          HG12      VAL  51   4.390   9.381  11.414
  379   HG13  VAL  51          HG13      VAL  51   4.746   8.931  13.082
  380   HG21  VAL  51          HG21      VAL  51   2.047   7.661  13.757
  381   HG22  VAL  51          HG22      VAL  51   3.641   6.991  14.107
  382   HG23  VAL  51          HG23      VAL  51   2.468   6.042  13.193
  383    HA   PRO  52           HA       PRO  52   3.566   9.071   7.432
  384    HB2  PRO  52           HB2      PRO  52   2.277  11.268   6.748
  385    HB3  PRO  52           HB1      PRO  52   1.442   9.718   6.930
  386    HG2  PRO  52           HG2      PRO  52   1.386  12.094   8.710
  387    HG3  PRO  52           HG1      PRO  52   0.136  10.872   8.434
  388    HD2  PRO  52           HD2      PRO  52   2.125  10.971  10.530
  389    HD3  PRO  52           HD1      PRO  52   0.822   9.784  10.301
  390    H    GLY  53           HN       GLY  53   5.287   9.551   9.443
  391    HA2  GLY  53           HA2      GLY  53   7.263  10.682   9.725
  392    HA3  GLY  53           HA1      GLY  53   6.780  11.753   8.419
  393    HA   PRO  54           HA       PRO  54   6.341  14.126  12.432
  394    HB2  PRO  54           HB2      PRO  54   8.483  15.745  12.153
  395    HB3  PRO  54           HB1      PRO  54   8.581  14.195  12.998
  396    HG2  PRO  54           HG2      PRO  54   9.404  14.884  10.201
  397    HG3  PRO  54           HG1      PRO  54  10.241  13.881  11.400
  398    HD2  PRO  54           HD2      PRO  54   8.750  12.846   9.370
  399    HD3  PRO  54           HD1      PRO  54   8.968  12.033  10.932
  400    HA   PRO  55           HA       PRO  55   4.279  17.172   9.974
  401    HB2  PRO  55           HB2      PRO  55   4.549  19.370  11.665
  402    HB3  PRO  55           HB1      PRO  55   3.268  18.156  11.757
  403    HG2  PRO  55           HG2      PRO  55   5.787  18.388  13.335
  404    HG3  PRO  55           HG1      PRO  55   4.179  17.858  13.860
  405    HD2  PRO  55           HD2      PRO  55   6.162  16.107  13.411
  406    HD3  PRO  55           HD1      PRO  55   4.475  15.716  13.021
  407    H    GLY  56           HN       GLY  56   5.639  17.424   8.238
  408    HA2  GLY  56           HA2      GLY  56   6.744  19.243   7.019
  409    HA3  GLY  56           HA1      GLY  56   7.683  19.547   8.474
  410    H    SER  57           HN       SER  57   6.919  16.408   7.071
  411    HA   SER  57           HA       SER  57   9.722  15.732   6.948
  412    HB2  SER  57           HB2      SER  57   8.516  13.565   6.018
  413    HB3  SER  57           HB1      SER  57   8.517  13.936   7.743
  414    HG   SER  57           HG       SER  57   6.450  14.073   5.862
  415    H    SER  58           HN       SER  58   9.838  14.030   4.816
  416    HA   SER  58           HA       SER  58   9.061  15.514   2.438
  417    HB2  SER  58           HB2      SER  58  11.948  14.766   2.987
  418    HB3  SER  58           HB1      SER  58  11.335  15.587   1.552
  419    HG   SER  58           HG       SER  58  10.516  17.094   3.472
  420    H    ARG  59           HN       ARG  59   8.666  14.155   0.725
  421    HA   ARG  59           HA       ARG  59   9.019  11.307   1.220
  422    HB2  ARG  59           HB2      ARG  59   7.605  12.684  -1.078
  423    HB3  ARG  59           HB1      ARG  59   7.510  10.967  -0.658
  424    HG2  ARG  59           HG2      ARG  59   6.497  11.603   1.501
  425    HG3  ARG  59           HG1      ARG  59   6.494  13.284   0.978
  426    HD2  ARG  59           HD2      ARG  59   5.009  12.726  -0.867
  427    HD3  ARG  59           HD1      ARG  59   5.056  11.020  -0.407
  428    HE   ARG  59           HE       ARG  59   4.198  12.154   1.862
  429   HH11  ARG  59          HH11      ARG  59   3.152  12.647  -1.454
  430   HH12  ARG  59          HH12      ARG  59   1.510  13.012  -1.005
  431   HH21  ARG  59          HH21      ARG  59   2.059  12.627   2.447
  432   HH22  ARG  59          HH22      ARG  59   0.890  13.014   1.216
  433    HA   PRO  60           HA       PRO  60  12.917  11.372  -0.952
  434    HB2  PRO  60           HB2      PRO  60  12.849   8.590  -1.347
  435    HB3  PRO  60           HB1      PRO  60  13.615   9.438   0.000
  436    HG2  PRO  60           HG2      PRO  60  10.947   8.124  -0.152
  437    HG3  PRO  60           HG1      PRO  60  12.073   8.232   1.213
  438    HD2  PRO  60           HD2      PRO  60   9.868   9.735   1.130
  439    HD3  PRO  60           HD1      PRO  60  11.396  10.384   1.763
  440    H    VAL  61           HN       VAL  61  13.718  10.910  -3.051
  441    HA   VAL  61           HA       VAL  61  11.550  10.570  -5.011
  442    HB   VAL  61           HB       VAL  61  12.542  12.735  -5.212
  443   HG11  VAL  61          HG11      VAL  61  14.657  12.350  -4.095
  444   HG12  VAL  61          HG12      VAL  61  14.925  13.090  -5.674
  445   HG13  VAL  61          HG13      VAL  61  15.210  11.364  -5.446
  446   HG21  VAL  61          HG21      VAL  61  13.390  12.721  -7.516
  447   HG22  VAL  61          HG22      VAL  61  11.961  11.707  -7.319
  448   HG23  VAL  61          HG23      VAL  61  13.557  10.967  -7.426
  449    H    LYS  62           HN       LYS  62  12.016   9.384  -6.920
  450    HA   LYS  62           HA       LYS  62  13.381   6.941  -6.424
  451    HB2  LYS  62           HB2      LYS  62  12.282   8.161  -8.976
  452    HB3  LYS  62           HB1      LYS  62  12.988   6.549  -8.905
  453    HG2  LYS  62           HG2      LYS  62  11.290   5.922  -7.222
  454    HG3  LYS  62           HG1      LYS  62  10.556   7.516  -7.406
  455    HD2  LYS  62           HD2      LYS  62   9.906   7.071  -9.627
  456    HD3  LYS  62           HD1      LYS  62  10.962   5.660  -9.741
  457    HE2  LYS  62           HE2      LYS  62   8.653   4.958  -9.511
  458    HE3  LYS  62           HE1      LYS  62   9.568   4.508  -8.072
  459    HZ1  LYS  62           HZ1      LYS  62   7.685   5.405  -7.176
  460    HZ2  LYS  62           HZ2      LYS  62   7.496   6.565  -8.391
  461    HZ3  LYS  62           HZ3      LYS  62   8.684   6.768  -7.201
  462    H    GLY  63           HN       GLY  63  15.377   6.401  -6.681
  463    HA2  GLY  63           HA2      GLY  63  17.517   6.686  -7.843
  464    HA3  GLY  63           HA1      GLY  63  17.176   8.415  -7.855
  465    H    GLN  64           HN       GLN  64  15.953   7.745  -5.022
  466    HA   GLN  64           HA       GLN  64  18.511   8.106  -3.659
  467    HB2  GLN  64           HB2      GLN  64  15.797   8.131  -2.346
  468    HB3  GLN  64           HB1      GLN  64  17.314   8.765  -1.712
  469    HG2  GLN  64           HG2      GLN  64  15.595   9.918  -3.888
  470    HG3  GLN  64           HG1      GLN  64  15.932  10.593  -2.302
  471   HE21  GLN  64          HE21      GLN  64  18.259   9.268  -4.646
  472   HE22  GLN  64          HE22      GLN  64  19.105  10.758  -4.868
  473    H    VAL  65           HN       VAL  65  19.428   6.610  -2.396
  474    HA   VAL  65           HA       VAL  65  18.201   4.001  -2.198
  475    HB   VAL  65           HB       VAL  65  20.578   4.010  -2.589
  476   HG11  VAL  65          HG11      VAL  65  22.191   4.937  -1.012
  477   HG12  VAL  65          HG12      VAL  65  20.871   5.568  -0.025
  478   HG13  VAL  65          HG13      VAL  65  21.131   6.189  -1.655
  479   HG21  VAL  65          HG21      VAL  65  20.018   3.171   0.253
  480   HG22  VAL  65          HG22      VAL  65  21.358   2.615  -0.748
  481   HG23  VAL  65          HG23      VAL  65  19.700   2.209  -1.192
  482    H    VAL  66           HN       VAL  66  16.862   3.499  -0.638
  483    HA   VAL  66           HA       VAL  66  16.770   5.255   1.724
  484    HB   VAL  66           HB       VAL  66  14.290   4.826   1.730
  485   HG11  VAL  66          HG11      VAL  66  15.500   6.251  -0.638
  486   HG12  VAL  66          HG12      VAL  66  15.110   6.945   0.934
  487   HG13  VAL  66          HG13      VAL  66  13.819   6.413  -0.137
  488   HG21  VAL  66          HG21      VAL  66  14.775   3.900  -1.093
  489   HG22  VAL  66          HG22      VAL  66  13.226   4.012  -0.254
  490   HG23  VAL  66          HG23      VAL  66  14.424   2.822   0.261
  491    H    THR  67           HN       THR  67  16.202   4.369   3.700
  492    HA   THR  67           HA       THR  67  16.576   1.467   3.876
  493    HB   THR  67           HB       THR  67  16.825   1.819   6.303
  494    HG1  THR  67           HG1      THR  67  17.184   4.212   6.819
  495   HG21  THR  67          HG21      THR  67  18.930   3.166   6.262
  496   HG22  THR  67          HG22      THR  67  18.600   3.503   4.560
  497   HG23  THR  67          HG23      THR  67  18.863   1.844   5.104
  498    H    VAL  68           HN       VAL  68  14.689   0.346   3.770
  499    HA   VAL  68           HA       VAL  68  12.510   1.433   5.386
  500    HB   VAL  68           HB       VAL  68  10.964  -0.115   4.219
  501   HG11  VAL  68          HG11      VAL  68  11.120   2.198   3.510
  502   HG12  VAL  68          HG12      VAL  68  10.877   1.149   2.112
  503   HG13  VAL  68          HG13      VAL  68  12.476   1.807   2.454
  504   HG21  VAL  68          HG21      VAL  68  11.688  -1.138   2.106
  505   HG22  VAL  68          HG22      VAL  68  12.564  -1.794   3.489
  506   HG23  VAL  68          HG23      VAL  68  13.342  -0.619   2.429
  507    H    HIS  69           HN       HIS  69  11.717   0.323   7.062
  508    HA   HIS  69           HA       HIS  69  12.816  -2.363   7.547
  509    HB2  HIS  69           HB2      HIS  69  13.003  -0.856   9.482
  510    HB3  HIS  69           HB1      HIS  69  11.279  -0.498   9.397
  511    HD1  HIS  69           HD1      HIS  69  13.010  -2.056  11.798
  512    HD2  HIS  69           HD2      HIS  69  10.272  -3.615   9.112
  513    HE1  HIS  69           HE1      HIS  69  12.116  -4.209  12.811
  514    HE2  HIS  69           HE2      HIS  69  10.308  -4.935  11.320
  515    H    LEU  70           HN       LEU  70  11.536  -3.986   6.744
  516    HA   LEU  70           HA       LEU  70   8.671  -3.464   6.950
  517    HB2  LEU  70           HB2      LEU  70   8.156  -3.985   4.869
  518    HB3  LEU  70           HB1      LEU  70   9.814  -3.545   4.538
  519    HG   LEU  70           HG       LEU  70   9.043  -6.382   5.100
  520   HD11  LEU  70          HD11      LEU  70   8.784  -6.703   2.683
  521   HD12  LEU  70          HD12      LEU  70   9.001  -4.971   2.425
  522   HD13  LEU  70          HD13      LEU  70   7.589  -5.563   3.301
  523   HD21  LEU  70          HD21      LEU  70  11.426  -5.802   5.095
  524   HD22  LEU  70          HD22      LEU  70  11.258  -5.123   3.475
  525   HD23  LEU  70          HD23      LEU  70  11.019  -6.852   3.738
  526    H    GLN  71           HN       GLN  71   7.581  -4.841   8.001
  527    HA   GLN  71           HA       GLN  71   8.461  -7.648   8.116
  528    HB2  GLN  71           HB2      GLN  71   6.586  -6.674  10.168
  529    HB3  GLN  71           HB1      GLN  71   7.848  -7.887  10.308
  530    HG2  GLN  71           HG2      GLN  71   8.775  -6.326  11.615
  531    HG3  GLN  71           HG1      GLN  71   9.386  -5.752  10.067
  532   HE21  GLN  71          HE21      GLN  71   6.622  -4.883   9.327
  533   HE22  GLN  71          HE22      GLN  71   6.441  -3.378  10.153
  534    H    THR  72           HN       THR  72   7.180  -8.805   7.009
  535    HA   THR  72           HA       THR  72   4.726  -7.553   6.082
  536    HB   THR  72           HB       THR  72   6.393  -9.738   4.873
  537    HG1  THR  72           HG1      THR  72   6.359  -7.485   3.436
  538   HG21  THR  72          HG21      THR  72   4.080  -9.865   4.186
  539   HG22  THR  72          HG22      THR  72   5.087  -9.294   2.853
  540   HG23  THR  72          HG23      THR  72   4.099  -8.154   3.771
  541    H    SER  73           HN       SER  73   2.852  -8.384   6.544
  542    HA   SER  73           HA       SER  73   2.708 -11.086   7.655
  543    HB2  SER  73           HB2      SER  73   0.437  -9.090   7.602
  544    HB3  SER  73           HB1      SER  73   0.694 -10.426   8.716
  545    HG   SER  73           HG       SER  73   1.137  -8.447   9.721
  546    H    LEU  74           HN       LEU  74   1.079 -12.448   6.901
  547    HA   LEU  74           HA       LEU  74   0.413 -12.186   4.111
  548    HB2  LEU  74           HB2      LEU  74  -0.156 -14.273   6.202
  549    HB3  LEU  74           HB1      LEU  74  -0.701 -14.408   4.544
  550    HG   LEU  74           HG       LEU  74   2.071 -14.569   5.640
  551   HD11  LEU  74          HD11      LEU  74   0.555 -16.233   3.640
  552   HD12  LEU  74          HD12      LEU  74   0.789 -16.623   5.344
  553   HD13  LEU  74          HD13      LEU  74   2.174 -16.562   4.256
  554   HD21  LEU  74          HD21      LEU  74   2.965 -14.384   3.363
  555   HD22  LEU  74          HD22      LEU  74   2.213 -12.879   3.902
  556   HD23  LEU  74          HD23      LEU  74   1.360 -13.942   2.776
  557    H    GLU  75           HN       GLU  75  -1.848 -12.473   3.397
  558    HA   GLU  75           HA       GLU  75  -3.686 -10.734   4.507
  559    HB2  GLU  75           HB2      GLU  75  -5.395 -12.004   3.195
  560    HB3  GLU  75           HB1      GLU  75  -3.983 -11.513   2.270
  561    HG2  GLU  75           HG2      GLU  75  -3.069 -13.755   2.410
  562    HG3  GLU  75           HG1      GLU  75  -4.425 -14.265   3.418
  563    H    ASN  76           HN       ASN  76  -2.799 -13.888   5.469
  564    HA   ASN  76           HA       ASN  76  -5.164 -14.367   7.071
  565    HB2  ASN  76           HB2      ASN  76  -2.617 -15.988   6.885
  566    HB3  ASN  76           HB1      ASN  76  -4.137 -16.502   7.610
  567   HD21  ASN  76          HD21      ASN  76  -2.382 -16.046   4.666
  568   HD22  ASN  76          HD22      ASN  76  -3.561 -16.739   3.608
  569    H    GLY  77           HN       GLY  77  -2.369 -12.600   7.424
  570    HA2  GLY  77           HA2      GLY  77  -2.037 -11.284   9.379
  571    HA3  GLY  77           HA1      GLY  77  -2.745 -12.572  10.341
  572    H    THR  78           HN       THR  78  -0.789 -14.161   8.335
  573    HA   THR  78           HA       THR  78   1.135 -14.581  10.413
  574    HB   THR  78           HB       THR  78   1.047 -15.833   7.672
  575    HG1  THR  78           HG1      THR  78   0.116 -17.560   9.354
  576   HG21  THR  78          HG21      THR  78   2.277 -17.672   8.765
  577   HG22  THR  78          HG22      THR  78   2.337 -16.724  10.252
  578   HG23  THR  78          HG23      THR  78   3.174 -16.152   8.808
  579    H    ARG  79           HN       ARG  79   2.823 -13.269  10.654
  580    HA   ARG  79           HA       ARG  79   3.935 -11.805   8.452
  581    HB2  ARG  79           HB2      ARG  79   4.723 -12.087  11.331
  582    HB3  ARG  79           HB1      ARG  79   5.718 -11.211  10.166
  583    HG2  ARG  79           HG2      ARG  79   3.344 -10.122   9.617
  584    HG3  ARG  79           HG1      ARG  79   3.093 -10.517  11.320
  585    HD2  ARG  79           HD2      ARG  79   4.911  -9.192  12.004
  586    HD3  ARG  79           HD1      ARG  79   5.556  -9.089  10.361
  587    HE   ARG  79           HE       ARG  79   3.170  -7.884  10.103
  588   HH11  ARG  79          HH11      ARG  79   5.691  -7.474  12.485
  589   HH12  ARG  79          HH12      ARG  79   5.423  -5.771  12.676
  590   HH21  ARG  79          HH21      ARG  79   2.810  -5.616  10.361
  591   HH22  ARG  79          HH22      ARG  79   3.790  -4.708  11.476
  592    H    VAL  80           HN       VAL  80   5.423 -12.349   7.130
  593    HA   VAL  80           HA       VAL  80   6.553 -15.040   7.450
  594    HB   VAL  80           HB       VAL  80   6.635 -15.064   4.988
  595   HG11  VAL  80          HG11      VAL  80   3.935 -14.412   6.133
  596   HG12  VAL  80          HG12      VAL  80   4.728 -15.988   6.195
  597   HG13  VAL  80          HG13      VAL  80   4.242 -15.305   4.642
  598   HG21  VAL  80          HG21      VAL  80   6.830 -12.677   4.565
  599   HG22  VAL  80          HG22      VAL  80   5.209 -12.421   5.209
  600   HG23  VAL  80          HG23      VAL  80   5.432 -13.342   3.721
  601    H    GLN  81           HN       GLN  81   7.444 -11.808   7.424
  602    HA   GLN  81           HA       GLN  81  10.228 -12.481   7.257
  603    HB2  GLN  81           HB2      GLN  81  10.746 -10.944   5.399
  604    HB3  GLN  81           HB1      GLN  81   9.733 -12.286   4.883
  605    HG2  GLN  81           HG2      GLN  81   7.775 -10.845   4.953
  606    HG3  GLN  81           HG1      GLN  81   8.789  -9.484   5.453
  607   HE21  GLN  81          HE21      GLN  81   7.764 -11.508   2.882
  608   HE22  GLN  81          HE22      GLN  81   8.531 -10.632   1.602
  609    H    GLU  82           HN       GLU  82  11.358 -11.173   8.580
  610    HA   GLU  82           HA       GLU  82  10.228  -8.515   9.127
  611    HB2  GLU  82           HB2      GLU  82  10.078  -9.936  11.137
  612    HB3  GLU  82           HB1      GLU  82  11.816 -10.203  11.071
  613    HG2  GLU  82           HG2      GLU  82  12.201  -7.807  11.377
  614    HG3  GLU  82           HG1      GLU  82  10.460  -7.542  11.447
  615    H    GLU  83           HN       GLU  83  11.361  -7.165   7.998
  616    HA   GLU  83           HA       GLU  83  14.280  -7.453   7.894
  617    HB2  GLU  83           HB2      GLU  83  13.070  -7.505   5.715
  618    HB3  GLU  83           HB1      GLU  83  12.398  -5.930   6.083
  619    HG2  GLU  83           HG2      GLU  83  14.091  -5.230   4.809
  620    HG3  GLU  83           HG1      GLU  83  14.985  -5.345   6.326
  621    HA   PRO  84           HA       PRO  84  13.891  -3.865  10.581
  622    HB2  PRO  84           HB2      PRO  84  16.783  -4.150  10.898
  623    HB3  PRO  84           HB1      PRO  84  15.504  -4.245  12.112
  624    HG2  PRO  84           HG2      PRO  84  16.914  -6.417  11.300
  625    HG3  PRO  84           HG1      PRO  84  15.228  -6.507  11.842
  626    HD2  PRO  84           HD2      PRO  84  16.337  -6.534   9.067
  627    HD3  PRO  84           HD1      PRO  84  14.979  -7.454   9.750
  628    H    GLU  85           HN       GLU  85  15.965  -4.403   7.864
  629    HA   GLU  85           HA       GLU  85  15.674  -1.719   7.006
  630    HB2  GLU  85           HB2      GLU  85  17.449  -1.310   8.639
  631    HB3  GLU  85           HB1      GLU  85  18.435  -2.578   7.923
  632    HG2  GLU  85           HG2      GLU  85  17.646  -0.580   5.973
  633    HG3  GLU  85           HG1      GLU  85  18.512   0.120   7.340
  634    H    LEU  86           HN       LEU  86  15.459  -1.797   5.022
  635    HA   LEU  86           HA       LEU  86  17.105  -3.565   3.363
  636    HB2  LEU  86           HB2      LEU  86  14.926  -4.567   3.447
  637    HB3  LEU  86           HB1      LEU  86  14.143  -3.014   3.221
  638    HG   LEU  86           HG       LEU  86  15.092  -2.902   0.956
  639   HD11  LEU  86          HD11      LEU  86  15.984  -4.944  -0.068
  640   HD12  LEU  86          HD12      LEU  86  15.981  -5.724   1.515
  641   HD13  LEU  86          HD13      LEU  86  17.017  -4.326   1.220
  642   HD21  LEU  86          HD21      LEU  86  13.588  -4.589  -0.030
  643   HD22  LEU  86          HD22      LEU  86  12.828  -3.666   1.266
  644   HD23  LEU  86          HD23      LEU  86  13.389  -5.311   1.566
  645    H    VAL  87           HN       VAL  87  18.443  -2.086   2.438
  646    HA   VAL  87           HA       VAL  87  17.385   0.476   1.634
  647    HB   VAL  87           HB       VAL  87  19.703   1.000   1.081
  648   HG11  VAL  87          HG11      VAL  87  20.640   0.888   3.347
  649   HG12  VAL  87          HG12      VAL  87  19.354  -0.238   3.784
  650   HG13  VAL  87          HG13      VAL  87  18.956   1.416   3.319
  651   HG21  VAL  87          HG21      VAL  87  20.468  -1.171   0.331
  652   HG22  VAL  87          HG22      VAL  87  20.332  -1.791   1.976
  653   HG23  VAL  87          HG23      VAL  87  21.520  -0.545   1.601
  654    H    PHE  88           HN       PHE  88  17.125   1.097  -0.452
  655    HA   PHE  88           HA       PHE  88  18.216  -0.422  -2.653
  656    HB2  PHE  88           HB2      PHE  88  16.087  -0.970  -3.689
  657    HB3  PHE  88           HB1      PHE  88  16.185  -1.718  -2.100
  658    HD1  PHE  88           HD2      PHE  88  14.987  -0.639  -0.181
  659    HD2  PHE  88           HD1      PHE  88  14.337   0.490  -4.232
  660    HE1  PHE  88           HE2      PHE  88  12.859   0.397   0.458
  661    HE2  PHE  88           HE1      PHE  88  12.200   1.529  -3.602
  662    HZ   PHE  88           HZ       PHE  88  11.457   1.479  -1.267
  663    H    THR  89           HN       THR  89  17.874   0.624  -4.704
  664    HA   THR  89           HA       THR  89  17.642   3.480  -4.540
  665    HB   THR  89           HB       THR  89  17.668   1.816  -7.065
  666    HG1  THR  89           HG1      THR  89  19.775   1.493  -6.808
  667   HG21  THR  89          HG21      THR  89  18.832   3.793  -7.981
  668   HG22  THR  89          HG22      THR  89  18.644   4.604  -6.427
  669   HG23  THR  89          HG23      THR  89  17.221   4.186  -7.381
  670    H    LEU  90           HN       LEU  90  15.716   4.451  -4.389
  671    HA   LEU  90           HA       LEU  90  13.230   3.295  -4.841
  672    HB2  LEU  90           HB2      LEU  90  13.849   5.517  -3.685
  673    HB3  LEU  90           HB1      LEU  90  13.739   6.215  -5.264
  674    HG   LEU  90           HG       LEU  90  11.414   5.619  -5.456
  675   HD11  LEU  90          HD11      LEU  90  11.723   4.336  -2.745
  676   HD12  LEU  90          HD12      LEU  90  11.545   3.471  -4.269
  677   HD13  LEU  90          HD13      LEU  90  10.228   4.479  -3.669
  678   HD21  LEU  90          HD21      LEU  90  11.937   7.703  -4.299
  679   HD22  LEU  90          HD22      LEU  90  12.011   6.838  -2.765
  680   HD23  LEU  90          HD23      LEU  90  10.483   6.959  -3.635
  681    H    GLY  91           HN       GLY  91  12.083   2.844  -6.632
  682    HA2  GLY  91           HA2      GLY  91  11.167   3.280  -8.737
  683    HA3  GLY  91           HA1      GLY  91  12.391   4.512  -8.994
  684    H    ASP  92           HN       ASP  92  14.034   1.942  -7.880
  685    HA   ASP  92           HA       ASP  92  14.991   1.348 -10.553
  686    HB2  ASP  92           HB2      ASP  92  16.508   1.848  -8.585
  687    HB3  ASP  92           HB1      ASP  92  16.033   0.285  -7.928
  688    H    CYS  93           HN       CYS  93  12.723   0.156  -8.436
  689    HA   CYS  93           HA       CYS  93  11.614  -1.813  -8.180
  690    HB2  CYS  93           HB2      CYS  93  12.788  -2.609 -10.849
  691    HB3  CYS  93           HB1      CYS  93  11.314  -3.216 -10.103
  692    HG   CYS  93           HG       CYS  93  11.673   0.046 -11.089
  693    H    ASP  94           HN       ASP  94  14.273  -1.468  -7.199
  694    HA   ASP  94           HA       ASP  94  15.750  -3.886  -7.506
  695    HB2  ASP  94           HB2      ASP  94  16.745  -1.700  -6.797
  696    HB3  ASP  94           HB1      ASP  94  15.890  -1.852  -5.265
  697    H    VAL  95           HN       VAL  95  12.950  -3.053  -6.055
  698    HA   VAL  95           HA       VAL  95  12.982  -5.284  -4.131
  699    HB   VAL  95           HB       VAL  95  11.416  -3.840  -2.748
  700   HG11  VAL  95          HG11      VAL  95  13.721  -4.167  -2.095
  701   HG12  VAL  95          HG12      VAL  95  13.250  -2.493  -1.790
  702   HG13  VAL  95          HG13      VAL  95  14.238  -2.891  -3.197
  703   HG21  VAL  95          HG21      VAL  95  11.602  -1.388  -3.141
  704   HG22  VAL  95          HG22      VAL  95  10.750  -2.244  -4.426
  705   HG23  VAL  95          HG23      VAL  95  12.423  -1.734  -4.668
  706    H    ILE  96           HN       ILE  96  10.258  -4.891  -3.371
  707    HA   ILE  96           HA       ILE  96   8.894  -5.944  -5.681
  708    HB   ILE  96           HB       ILE  96   6.948  -6.138  -4.150
  709   HG12  ILE  96          HG12      ILE  96   8.854  -5.093  -2.036
  710   HG13  ILE  96          HG11      ILE  96   7.474  -4.217  -2.687
  711   HG21  ILE  96          HG21      ILE  96   7.902  -7.887  -2.711
  712   HG22  ILE  96          HG22      ILE  96   9.520  -7.326  -3.134
  713   HG23  ILE  96          HG23      ILE  96   8.463  -7.993  -4.378
  714   HD11  ILE  96          HD11      ILE  96   6.976  -5.184  -0.519
  715   HD12  ILE  96          HD12      ILE  96   7.340  -6.792  -1.144
  716   HD13  ILE  96          HD13      ILE  96   5.963  -5.890  -1.779
  717    H    GLN  97           HN       GLN  97   7.349  -4.851  -6.811
  718    HA   GLN  97           HA       GLN  97   7.775  -2.092  -7.043
  719    HB2  GLN  97           HB2      GLN  97   6.803  -3.803  -8.759
  720    HB3  GLN  97           HB1      GLN  97   5.251  -3.326  -8.076
  721    HG2  GLN  97           HG2      GLN  97   5.524  -1.906  -9.888
  722    HG3  GLN  97           HG1      GLN  97   6.012  -0.928  -8.505
  723   HE21  GLN  97          HE21      GLN  97   8.303  -0.548  -8.169
  724   HE22  GLN  97          HE22      GLN  97   9.395  -0.678  -9.503
  725    H    ALA  98           HN       ALA  98   5.394  -3.907  -5.232
  726    HA   ALA  98           HA       ALA  98   3.607  -1.917  -4.490
  727    HB1  ALA  98           HB1      ALA  98   4.750  -4.160  -2.826
  728    HB2  ALA  98           HB2      ALA  98   3.296  -4.222  -3.821
  729    HB3  ALA  98           HB3      ALA  98   3.341  -3.201  -2.386
  730    H    LEU  99           HN       LEU  99   6.803  -2.667  -3.251
  731    HA   LEU  99           HA       LEU  99   6.657  -0.688  -1.160
  732    HB2  LEU  99           HB2      LEU  99   7.954  -2.727  -0.806
  733    HB3  LEU  99           HB1      LEU  99   9.001  -2.289  -2.152
  734    HG   LEU  99           HG       LEU  99   9.767  -0.309  -0.920
  735   HD11  LEU  99          HD11      LEU  99   8.036  -1.358   1.318
  736   HD12  LEU  99          HD12      LEU  99   7.744   0.109   0.382
  737   HD13  LEU  99          HD13      LEU  99   9.161  -0.005   1.427
  738   HD21  LEU  99          HD21      LEU  99   9.982  -2.874   0.643
  739   HD22  LEU  99          HD22      LEU  99  11.032  -1.467   0.823
  740   HD23  LEU  99          HD23      LEU  99  11.021  -2.372  -0.693
  741    H    ASP 100           HN       ASP 100   8.136  -1.031  -4.288
  742    HA   ASP 100           HA       ASP 100   9.951   1.102  -4.169
  743    HB2  ASP 100           HB2      ASP 100  10.054  -0.723  -5.818
  744    HB3  ASP 100           HB1      ASP 100   8.574  -0.149  -6.557
  745    H    LEU 101           HN       LEU 101   6.580   0.894  -4.944
  746    HA   LEU 101           HA       LEU 101   6.416   3.681  -5.694
  747    HB2  LEU 101           HB2      LEU 101   4.306   1.547  -5.433
  748    HB3  LEU 101           HB1      LEU 101   4.045   3.155  -6.050
  749    HG   LEU 101           HG       LEU 101   5.781   1.038  -7.307
  750   HD11  LEU 101          HD11      LEU 101   3.408   0.589  -7.553
  751   HD12  LEU 101          HD12      LEU 101   4.102   1.079  -9.097
  752   HD13  LEU 101          HD13      LEU 101   3.141   2.222  -8.159
  753   HD21  LEU 101          HD21      LEU 101   5.996   2.652  -9.176
  754   HD22  LEU 101          HD22      LEU 101   6.755   3.213  -7.688
  755   HD23  LEU 101          HD23      LEU 101   5.194   3.868  -8.180
  756    H    SER 102           HN       SER 102   5.668   1.634  -2.935
  757    HA   SER 102           HA       SER 102   3.882   3.392  -1.631
  758    HB2  SER 102           HB2      SER 102   3.946   1.085  -0.947
  759    HB3  SER 102           HB1      SER 102   5.652   1.206  -0.521
  760    HG   SER 102           HG       SER 102   4.959   2.805   1.073
  761    H    VAL 103           HN       VAL 103   7.363   3.130  -1.633
  762    HA   VAL 103           HA       VAL 103   7.908   4.633   0.649
  763    HB   VAL 103           HB       VAL 103   9.517   4.208  -1.831
  764   HG11  VAL 103          HG11      VAL 103  10.441   5.414   0.794
  765   HG12  VAL 103          HG12      VAL 103  10.268   6.284  -0.731
  766   HG13  VAL 103          HG13      VAL 103  11.475   5.008  -0.577
  767   HG21  VAL 103          HG21      VAL 103   9.299   2.165  -0.741
  768   HG22  VAL 103          HG22      VAL 103   9.354   2.905   0.857
  769   HG23  VAL 103          HG23      VAL 103  10.823   2.788  -0.107
  770    HA   PRO 104           HA       PRO 104   8.248   8.607  -2.122
  771    HB2  PRO 104           HB2      PRO 104   6.965   8.450  -4.548
  772    HB3  PRO 104           HB1      PRO 104   8.703   8.222  -4.330
  773    HG2  PRO 104           HG2      PRO 104   6.541   6.175  -4.586
  774    HG3  PRO 104           HG1      PRO 104   8.164   6.185  -5.294
  775    HD2  PRO 104           HD2      PRO 104   7.584   4.706  -3.146
  776    HD3  PRO 104           HD1      PRO 104   9.165   5.482  -3.343
  777    H    LEU 105           HN       LEU 105   5.507   6.453  -2.118
  778    HA   LEU 105           HA       LEU 105   3.551   8.566  -1.958
  779    HB2  LEU 105           HB2      LEU 105   3.512   5.596  -1.642
  780    HB3  LEU 105           HB1      LEU 105   2.132   6.547  -1.099
  781    HG   LEU 105           HG       LEU 105   3.182   6.207  -3.890
  782   HD11  LEU 105          HD11      LEU 105   0.471   5.814  -2.650
  783   HD12  LEU 105          HD12      LEU 105   1.616   4.541  -3.072
  784   HD13  LEU 105          HD13      LEU 105   0.889   5.528  -4.340
  785   HD21  LEU 105          HD21      LEU 105   2.789   8.590  -3.573
  786   HD22  LEU 105          HD22      LEU 105   1.180   8.252  -2.940
  787   HD23  LEU 105          HD23      LEU 105   1.561   7.887  -4.624
  788    H    MET 106           HN       MET 106   5.743   7.179   0.191
  789    HA   MET 106           HA       MET 106   4.162   8.011   2.523
  790    HB2  MET 106           HB2      MET 106   5.009   6.241   3.627
  791    HB3  MET 106           HB1      MET 106   5.424   5.640   2.032
  792    HG2  MET 106           HG2      MET 106   7.633   6.904   2.373
  793    HG3  MET 106           HG1      MET 106   7.163   6.932   4.077
  794    HE1  MET 106           HE1      MET 106   6.767   4.756   5.525
  795    HE2  MET 106           HE2      MET 106   6.930   3.113   4.906
  796    HE3  MET 106           HE3      MET 106   5.615   4.144   4.341
  797    H    ASP 107           HN       ASP 107   5.286   9.171   4.242
  798    HA   ASP 107           HA       ASP 107   7.233  11.056   3.147
  799    HB2  ASP 107           HB2      ASP 107   5.308  11.071   5.396
  800    HB3  ASP 107           HB1      ASP 107   6.808  11.954   5.660
  801    H    VAL 108           HN       VAL 108   9.155  11.639   4.367
  802    HA   VAL 108           HA       VAL 108  10.592   9.346   5.180
  803    HB   VAL 108           HB       VAL 108  11.482  11.617   4.228
  804   HG11  VAL 108          HG11      VAL 108  10.655  12.921   6.221
  805   HG12  VAL 108          HG12      VAL 108  12.333  13.192   5.756
  806   HG13  VAL 108          HG13      VAL 108  11.955  12.167   7.141
  807   HG21  VAL 108          HG21      VAL 108  12.978  10.055   6.326
  808   HG22  VAL 108          HG22      VAL 108  13.705  11.109   5.112
  809   HG23  VAL 108          HG23      VAL 108  12.847   9.649   4.617
  810    H    GLY 109           HN       GLY 109  10.704   8.376   7.006
  811    HA2  GLY 109           HA2      GLY 109  11.026   8.210   9.333
  812    HA3  GLY 109           HA1      GLY 109  10.344   9.819   9.517
  813    H    GLU 110           HN       GLU 110   8.437   7.938   7.434
  814    HA   GLU 110           HA       GLU 110   6.484   7.730   9.579
  815    HB2  GLU 110           HB2      GLU 110   4.793   7.824   8.032
  816    HB3  GLU 110           HB1      GLU 110   6.008   8.862   7.309
  817    HG2  GLU 110           HG2      GLU 110   6.510   7.286   5.654
  818    HG3  GLU 110           HG1      GLU 110   5.717   5.980   6.540
  819    H    THR 111           HN       THR 111   4.938   5.910   9.448
  820    HA   THR 111           HA       THR 111   6.250   3.412   8.657
  821    HB   THR 111           HB       THR 111   4.459   3.634  11.076
  822    HG1  THR 111           HG1      THR 111   6.961   4.574  10.817
  823   HG21  THR 111          HG21      THR 111   4.750   1.395  10.160
  824   HG22  THR 111          HG22      THR 111   5.584   1.532  11.707
  825   HG23  THR 111          HG23      THR 111   6.505   1.592  10.204
  826    H    ALA 112           HN       ALA 112   5.066   2.468   7.135
  827    HA   ALA 112           HA       ALA 112   2.202   3.137   7.022
  828    HB1  ALA 112           HB1      ALA 112   4.108   2.709   4.736
  829    HB2  ALA 112           HB2      ALA 112   3.450   4.255   5.271
  830    HB3  ALA 112           HB3      ALA 112   2.379   3.028   4.599
  831    H    MET 113           HN       MET 113   0.826   1.501   6.892
  832    HA   MET 113           HA       MET 113   1.918  -1.201   6.528
  833    HB2  MET 113           HB2      MET 113   0.475  -1.164   8.408
  834    HB3  MET 113           HB1      MET 113  -0.697  -0.125   7.601
  835    HG2  MET 113           HG2      MET 113  -1.273  -1.981   6.099
  836    HG3  MET 113           HG1      MET 113  -0.127  -3.011   6.951
  837    HE1  MET 113           HE1      MET 113  -0.357  -2.747   9.866
  838    HE2  MET 113           HE2      MET 113  -0.591  -4.286   9.035
  839    HE3  MET 113           HE3      MET 113  -1.729  -3.773  10.286
  840    H    VAL 114           HN       VAL 114   1.858  -1.969   4.504
  841    HA   VAL 114           HA       VAL 114  -0.050  -0.746   2.602
  842    HB   VAL 114           HB       VAL 114   2.466  -2.232   1.900
  843   HG11  VAL 114          HG11      VAL 114   0.893  -1.945   0.089
  844   HG12  VAL 114          HG12      VAL 114   2.341  -0.979  -0.183
  845   HG13  VAL 114          HG13      VAL 114   0.859  -0.202   0.375
  846   HG21  VAL 114          HG21      VAL 114   3.060  -0.416   3.392
  847   HG22  VAL 114          HG22      VAL 114   2.211   0.723   2.348
  848   HG23  VAL 114          HG23      VAL 114   3.642  -0.122   1.756
  849    H    THR 115           HN       THR 115  -1.558  -2.115   1.737
  850    HA   THR 115           HA       THR 115  -0.902  -4.965   1.926
  851    HB   THR 115           HB       THR 115  -3.671  -3.773   1.648
  852    HG1  THR 115           HG1      THR 115  -3.259  -5.257   3.861
  853   HG21  THR 115          HG21      THR 115  -4.397  -6.073   2.046
  854   HG22  THR 115          HG22      THR 115  -2.712  -6.594   2.078
  855   HG23  THR 115          HG23      THR 115  -3.410  -5.956   0.588
  856    H    ALA 116           HN       ALA 116  -0.184  -5.703   0.199
  857    HA   ALA 116           HA       ALA 116  -1.114  -4.686  -2.422
  858    HB1  ALA 116           HB1      ALA 116   1.150  -5.002  -3.249
  859    HB2  ALA 116           HB2      ALA 116   1.675  -5.515  -1.645
  860    HB3  ALA 116           HB3      ALA 116   1.128  -3.859  -1.906
  861    H    ASP 117           HN       ASP 117  -1.776  -6.216  -3.806
  862    HA   ASP 117           HA       ASP 117  -2.064  -8.891  -3.193
  863    HB2  ASP 117           HB2      ASP 117  -3.002  -7.615  -5.231
  864    HB3  ASP 117           HB1      ASP 117  -1.457  -7.954  -5.974
  865    H    SER 118           HN       SER 118  -0.840 -10.735  -3.637
  866    HA   SER 118           HA       SER 118   1.891 -10.567  -3.190
  867    HB2  SER 118           HB2      SER 118   0.246 -12.575  -3.000
  868    HB3  SER 118           HB1      SER 118   0.685 -12.879  -4.679
  869    HG   SER 118           HG       SER 118   1.963 -13.963  -2.979
  870    H    LYS 119           HN       LYS 119   0.079 -10.392  -6.176
  871    HA   LYS 119           HA       LYS 119   2.145 -10.853  -8.002
  872    HB2  LYS 119           HB2      LYS 119   0.833  -9.267  -9.489
  873    HB3  LYS 119           HB1      LYS 119  -0.031 -10.676  -8.886
  874    HG2  LYS 119           HG2      LYS 119  -1.079  -9.275  -7.191
  875    HG3  LYS 119           HG1      LYS 119  -0.168  -7.886  -7.791
  876    HD2  LYS 119           HD2      LYS 119  -2.411  -7.843  -8.699
  877    HD3  LYS 119           HD1      LYS 119  -1.251  -8.153  -9.992
  878    HE2  LYS 119           HE2      LYS 119  -1.739 -10.604  -9.695
  879    HE3  LYS 119           HE1      LYS 119  -3.051 -10.139  -8.615
  880    HZ1  LYS 119           HZ1      LYS 119  -4.057  -8.890 -10.441
  881    HZ2  LYS 119           HZ2      LYS 119  -3.865 -10.529 -10.845
  882    HZ3  LYS 119           HZ3      LYS 119  -2.801  -9.374 -11.473
  883    H    TYR 120           HN       TYR 120   1.478  -8.025  -6.003
  884    HA   TYR 120           HA       TYR 120   3.655  -6.547  -7.275
  885    HB2  TYR 120           HB2      TYR 120   1.845  -5.774  -4.972
  886    HB3  TYR 120           HB1      TYR 120   3.011  -4.712  -5.758
  887    HD1  TYR 120           HD2      TYR 120  -0.196  -6.416  -6.076
  888    HD2  TYR 120           HD1      TYR 120   2.567  -3.760  -7.902
  889    HE1  TYR 120           HE2      TYR 120  -1.925  -5.781  -7.696
  890    HE2  TYR 120           HE1      TYR 120   0.846  -3.104  -9.543
  891    HH   TYR 120           HH       TYR 120  -1.214  -4.074 -10.522
  892    H    CYS 121           HN       CYS 121   3.388  -8.919  -5.141
  893    HA   CYS 121           HA       CYS 121   5.631  -7.996  -3.486
  894    HB2  CYS 121           HB2      CYS 121   3.394  -9.877  -2.737
  895    HB3  CYS 121           HB1      CYS 121   4.731  -9.412  -1.690
  896    HG   CYS 121           HG       CYS 121   1.850  -7.888  -2.210
  897    H    TYR 122           HN       TYR 122   4.307 -11.291  -3.480
  898    HA   TYR 122           HA       TYR 122   6.482 -12.165  -5.225
  899    HB2  TYR 122           HB2      TYR 122   6.130 -13.562  -2.584
  900    HB3  TYR 122           HB1      TYR 122   7.467 -13.651  -3.712
  901    HD1  TYR 122           HD2      TYR 122   9.143 -11.877  -3.811
  902    HD2  TYR 122           HD1      TYR 122   6.013 -11.804  -0.926
  903    HE1  TYR 122           HE2      TYR 122  10.395 -10.225  -2.495
  904    HE2  TYR 122           HE1      TYR 122   7.252 -10.161   0.387
  905    HH   TYR 122           HH       TYR 122   9.895  -8.457  -0.811
  906    H    GLY 123           HN       GLY 123   3.642 -12.213  -5.761
  907    HA2  GLY 123           HA2      GLY 123   2.358 -14.603  -5.232
  908    HA3  GLY 123           HA1      GLY 123   2.164 -13.694  -6.723
  909    HA   PRO 124           HA       PRO 124   4.213 -17.114  -8.733
  910    HB2  PRO 124           HB2      PRO 124   4.895 -15.970 -11.067
  911    HB3  PRO 124           HB1      PRO 124   3.205 -16.297 -10.666
  912    HG2  PRO 124           HG2      PRO 124   4.729 -13.723 -10.493
  913    HG3  PRO 124           HG1      PRO 124   3.086 -14.014 -11.094
  914    HD2  PRO 124           HD2      PRO 124   3.635 -13.060  -8.589
  915    HD3  PRO 124           HD1      PRO 124   2.180 -13.992  -8.992
  916    H    GLN 125           HN       GLN 125   5.670 -14.765  -7.180
  917    HA   GLN 125           HA       GLN 125   8.322 -15.023  -8.417
  918    HB2  GLN 125           HB2      GLN 125   7.391 -13.044  -6.334
  919    HB3  GLN 125           HB1      GLN 125   8.891 -12.990  -7.255
  920    HG2  GLN 125           HG2      GLN 125   7.705 -12.570  -9.282
  921    HG3  GLN 125           HG1      GLN 125   6.158 -12.817  -8.485
  922   HE21  GLN 125          HE21      GLN 125   5.317 -11.214  -7.183
  923   HE22  GLN 125          HE22      GLN 125   5.946  -9.610  -7.142
  924    H    GLY 126           HN       GLY 126   6.595 -15.144  -5.360
  925    HA2  GLY 126           HA2      GLY 126   6.962 -16.319  -3.452
  926    HA3  GLY 126           HA1      GLY 126   8.277 -17.156  -4.253
  927    H    SER 127           HN       SER 127   7.971 -15.942  -1.577
  928    HA   SER 127           HA       SER 127   9.852 -13.782  -1.648
  929    HB2  SER 127           HB2      SER 127   8.033 -13.305  -0.226
  930    HB3  SER 127           HB1      SER 127   8.079 -14.896   0.498
  931    HG   SER 127           HG       SER 127   9.153 -12.724   1.451
  932    H    ARG 128           HN       ARG 128  11.558 -13.702   0.065
  933    HA   ARG 128           HA       ARG 128  13.473 -15.597  -0.623
  934    HB2  ARG 128           HB2      ARG 128  14.864 -14.512   1.134
  935    HB3  ARG 128           HB1      ARG 128  14.114 -13.376   0.020
  936    HG2  ARG 128           HG2      ARG 128  12.375 -12.905   1.692
  937    HG3  ARG 128           HG1      ARG 128  13.171 -14.011   2.814
  938    HD2  ARG 128           HD2      ARG 128  13.802 -11.755   3.350
  939    HD3  ARG 128           HD1      ARG 128  15.199 -12.603   2.692
  940    HE   ARG 128           HE       ARG 128  14.451 -11.448   0.500
  941   HH11  ARG 128          HH11      ARG 128  14.264 -10.060   3.704
  942   HH12  ARG 128          HH12      ARG 128  14.428  -8.422   3.147
  943   HH21  ARG 128          HH21      ARG 128  14.634  -9.309  -0.244
  944   HH22  ARG 128          HH22      ARG 128  14.631  -7.998   0.897
  945    H    SER 129           HN       SER 129  11.614 -15.295   2.404
  946    HA   SER 129           HA       SER 129  12.816 -17.748   3.367
  947    HB2  SER 129           HB2      SER 129  10.764 -15.929   4.655
  948    HB3  SER 129           HB1      SER 129  11.484 -17.347   5.422
  949    HG   SER 129           HG       SER 129  13.576 -16.214   4.866
  950    HA   PRO 130           HA       PRO 130   8.662 -19.461   2.180
  951    HB2  PRO 130           HB2      PRO 130   6.402 -17.902   2.457
  952    HB3  PRO 130           HB1      PRO 130   7.134 -18.810   3.776
  953    HG2  PRO 130           HG2      PRO 130   6.945 -15.983   3.552
  954    HG3  PRO 130           HG1      PRO 130   7.833 -16.892   4.780
  955    HD2  PRO 130           HD2      PRO 130   8.823 -15.698   2.222
  956    HD3  PRO 130           HD1      PRO 130   9.637 -15.821   3.792
  957    H    TYR 131           HN       TYR 131   8.571 -19.738  -0.062
  958    HA   TYR 131           HA       TYR 131   8.041 -17.782  -1.960
  959    HB2  TYR 131           HB2      TYR 131   8.689 -20.118  -2.512
  960    HB3  TYR 131           HB1      TYR 131   7.100 -20.671  -1.999
  961    HD1  TYR 131           HD1      TYR 131   5.056 -19.725  -3.300
  962    HD2  TYR 131           HD2      TYR 131   9.058 -19.500  -4.736
  963    HE1  TYR 131           HE1      TYR 131   4.210 -19.383  -5.584
  964    HE2  TYR 131           HE2      TYR 131   8.224 -19.148  -7.027
  965    HH   TYR 131           HH       TYR 131   6.187 -19.594  -8.332
  966    H    ILE 132           HN       ILE 132   6.521 -16.316  -1.429
  967    HA   ILE 132           HA       ILE 132   4.193 -16.874   0.018
  968    HB   ILE 132           HB       ILE 132   4.705 -14.522  -1.803
  969   HG12  ILE 132          HG12      ILE 132   6.472 -14.506  -0.248
  970   HG13  ILE 132          HG11      ILE 132   5.292 -13.334   0.343
  971   HG21  ILE 132          HG21      ILE 132   2.788 -14.914   0.477
  972   HG22  ILE 132          HG22      ILE 132   2.386 -14.711  -1.230
  973   HG23  ILE 132          HG23      ILE 132   3.092 -13.373  -0.327
  974   HD11  ILE 132          HD11      ILE 132   4.531 -14.880   2.002
  975   HD12  ILE 132          HD12      ILE 132   6.287 -14.695   2.097
  976   HD13  ILE 132          HD13      ILE 132   5.590 -16.139   1.359
  977    HA   PRO 133           HA       PRO 133   1.655 -18.872  -3.035
  978    HB2  PRO 133           HB2      PRO 133  -0.741 -17.918  -1.906
  979    HB3  PRO 133           HB1      PRO 133   0.050 -19.448  -1.531
  980    HG2  PRO 133           HG2      PRO 133   0.146 -16.860  -0.070
  981    HG3  PRO 133           HG1      PRO 133   0.178 -18.515   0.569
  982    HD2  PRO 133           HD2      PRO 133   2.394 -17.026   0.471
  983    HD3  PRO 133           HD1      PRO 133   2.446 -18.767   0.125
  984    HA   PRO 134           HA       PRO 134   1.041 -15.568  -5.917
  985    HB2  PRO 134           HB2      PRO 134  -0.832 -17.460  -7.212
  986    HB3  PRO 134           HB1      PRO 134   0.583 -16.627  -7.876
  987    HG2  PRO 134           HG2      PRO 134   0.648 -19.242  -7.301
  988    HG3  PRO 134           HG1      PRO 134   2.059 -18.198  -7.051
  989    HD2  PRO 134           HD2      PRO 134   0.118 -19.278  -5.047
  990    HD3  PRO 134           HD1      PRO 134   1.872 -19.045  -4.907
  991    H    HIS 135           HN       HIS 135  -0.247 -13.924  -5.854
  992    HA   HIS 135           HA       HIS 135  -2.081 -12.593  -5.793
  993    HB2  HIS 135           HB2      HIS 135  -3.775 -15.088  -5.508
  994    HB3  HIS 135           HB1      HIS 135  -4.367 -13.464  -5.813
  995    HD1  HIS 135           HD1      HIS 135  -4.178 -16.386  -7.540
  996    HD2  HIS 135           HD2      HIS 135  -2.719 -12.581  -8.396
  997    HE1  HIS 135           HE1      HIS 135  -3.878 -16.319 -10.038
  998    HE2  HIS 135           HE2      HIS 135  -2.822 -14.076 -10.506
  999    H    ALA 136           HN       ALA 136  -0.929 -14.406  -3.307
 1000    HA   ALA 136           HA       ALA 136  -2.941 -13.990  -1.328
 1001    HB1  ALA 136           HB1      ALA 136  -1.186 -14.498   0.300
 1002    HB2  ALA 136           HB2      ALA 136   0.028 -14.395  -0.975
 1003    HB3  ALA 136           HB3      ALA 136  -1.194 -15.668  -1.019
 1004    H    ALA 137           HN       ALA 137  -3.493 -12.155  -0.323
 1005    HA   ALA 137           HA       ALA 137  -2.201  -9.740  -1.197
 1006    HB1  ALA 137           HB1      ALA 137  -3.885  -8.581   0.155
 1007    HB2  ALA 137           HB2      ALA 137  -4.391 -10.117   0.853
 1008    HB3  ALA 137           HB3      ALA 137  -4.626  -9.813  -0.868
 1009    H    LEU 138           HN       LEU 138  -0.395  -9.035  -0.357
 1010    HA   LEU 138           HA       LEU 138   0.482  -9.968   2.234
 1011    HB2  LEU 138           HB2      LEU 138   1.732  -9.181  -0.197
 1012    HB3  LEU 138           HB1      LEU 138   2.341  -8.157   1.093
 1013    HG   LEU 138           HG       LEU 138   3.031 -10.100   2.360
 1014   HD11  LEU 138          HD11      LEU 138   1.262 -11.596   1.774
 1015   HD12  LEU 138          HD12      LEU 138   2.813 -12.345   1.393
 1016   HD13  LEU 138          HD13      LEU 138   1.822 -11.661   0.104
 1017   HD21  LEU 138          HD21      LEU 138   3.915 -10.265  -0.508
 1018   HD22  LEU 138          HD22      LEU 138   4.752 -10.982   0.870
 1019   HD23  LEU 138          HD23      LEU 138   4.606  -9.228   0.740
 1020    H    CYS 139           HN       CYS 139   0.531  -8.776   4.025
 1021    HA   CYS 139           HA       CYS 139  -0.072  -5.901   3.781
 1022    HB2  CYS 139           HB2      CYS 139  -1.738  -7.494   4.963
 1023    HB3  CYS 139           HB1      CYS 139  -0.533  -7.565   6.242
 1024    HG   CYS 139           HG       CYS 139  -1.868  -4.608   5.176
 1025    H    LEU 140           HN       LEU 140   1.895  -4.988   3.831
 1026    HA   LEU 140           HA       LEU 140   3.816  -5.989   5.823
 1027    HB2  LEU 140           HB2      LEU 140   5.536  -5.017   4.270
 1028    HB3  LEU 140           HB1      LEU 140   4.684  -6.436   3.690
 1029    HG   LEU 140           HG       LEU 140   3.211  -4.249   2.757
 1030   HD11  LEU 140          HD11      LEU 140   5.096  -2.802   3.307
 1031   HD12  LEU 140          HD12      LEU 140   4.903  -2.937   1.556
 1032   HD13  LEU 140          HD13      LEU 140   6.177  -3.841   2.379
 1033   HD21  LEU 140          HD21      LEU 140   3.951  -5.017   0.566
 1034   HD22  LEU 140          HD22      LEU 140   3.564  -6.387   1.606
 1035   HD23  LEU 140          HD23      LEU 140   5.247  -5.952   1.314
 1036    H    GLU 141           HN       GLU 141   4.655  -4.640   7.251
 1037    HA   GLU 141           HA       GLU 141   3.802  -1.840   7.178
 1038    HB2  GLU 141           HB2      GLU 141   3.223  -3.066   9.178
 1039    HB3  GLU 141           HB1      GLU 141   4.881  -3.607   9.373
 1040    HG2  GLU 141           HG2      GLU 141   5.592  -1.343   9.868
 1041    HG3  GLU 141           HG1      GLU 141   3.942  -0.760   9.605
 1042    H    VAL 142           HN       VAL 142   5.219  -0.491   6.304
 1043    HA   VAL 142           HA       VAL 142   8.074  -1.123   6.485
 1044    HB   VAL 142           HB       VAL 142   8.298   0.469   4.522
 1045   HG11  VAL 142          HG11      VAL 142   6.722  -2.077   4.172
 1046   HG12  VAL 142          HG12      VAL 142   8.477  -1.946   4.301
 1047   HG13  VAL 142          HG13      VAL 142   7.640  -1.257   2.909
 1048   HG21  VAL 142          HG21      VAL 142   5.314   0.029   4.404
 1049   HG22  VAL 142          HG22      VAL 142   6.293   0.745   3.122
 1050   HG23  VAL 142          HG23      VAL 142   6.131   1.570   4.674
 1051    H    THR 143           HN       THR 143   9.207   0.042   7.802
 1052    HA   THR 143           HA       THR 143   8.463   2.789   8.471
 1053    HB   THR 143           HB       THR 143  10.892   1.305   9.479
 1054    HG1  THR 143           HG1      THR 143   8.191   1.142  10.419
 1055   HG21  THR 143          HG21      THR 143  10.592   2.750  11.429
 1056   HG22  THR 143          HG22      THR 143   9.150   3.456  10.697
 1057   HG23  THR 143          HG23      THR 143  10.731   3.706   9.952
 1058    H    LEU 144           HN       LEU 144   9.106   4.238   6.978
 1059    HA   LEU 144           HA       LEU 144  11.644   3.974   5.595
 1060    HB2  LEU 144           HB2      LEU 144   9.705   4.981   4.458
 1061    HB3  LEU 144           HB1      LEU 144   9.654   6.251   5.665
 1062    HG   LEU 144           HG       LEU 144  11.868   7.041   4.918
 1063   HD11  LEU 144          HD11      LEU 144  11.571   4.913   2.792
 1064   HD12  LEU 144          HD12      LEU 144  12.751   4.912   4.103
 1065   HD13  LEU 144          HD13      LEU 144  12.830   6.148   2.848
 1066   HD21  LEU 144          HD21      LEU 144   9.880   6.771   2.666
 1067   HD22  LEU 144          HD22      LEU 144  11.126   8.009   2.828
 1068   HD23  LEU 144          HD23      LEU 144   9.781   7.954   3.966
 1069    H    LYS 145           HN       LYS 145  13.348   4.205   6.835
 1070    HA   LYS 145           HA       LYS 145  13.167   6.062   9.088
 1071    HB2  LYS 145           HB2      LYS 145  15.319   4.003   8.645
 1072    HB3  LYS 145           HB1      LYS 145  14.835   4.766  10.153
 1073    HG2  LYS 145           HG2      LYS 145  12.738   3.571  10.130
 1074    HG3  LYS 145           HG1      LYS 145  13.152   2.844   8.573
 1075    HD2  LYS 145           HD2      LYS 145  14.702   2.477  11.134
 1076    HD3  LYS 145           HD1      LYS 145  13.537   1.325  10.472
 1077    HE2  LYS 145           HE2      LYS 145  14.877   0.954   8.546
 1078    HE3  LYS 145           HE1      LYS 145  15.987   2.259   8.977
 1079    HZ1  LYS 145           HZ1      LYS 145  15.690  -0.405  10.220
 1080    HZ2  LYS 145           HZ2      LYS 145  16.362   0.880  11.098
 1081    HZ3  LYS 145           HZ3      LYS 145  17.097   0.358   9.665
 1082    H    THR 146           HN       THR 146  14.706   5.631   6.048
 1083    HA   THR 146           HA       THR 146  16.142   8.100   6.384
 1084    HB   THR 146           HB       THR 146  17.723   5.602   5.753
 1085    HG1  THR 146           HG1      THR 146  16.989   6.662   8.162
 1086   HG21  THR 146          HG21      THR 146  18.633   7.641   4.762
 1087   HG22  THR 146          HG22      THR 146  19.675   7.065   6.063
 1088   HG23  THR 146          HG23      THR 146  18.602   8.436   6.341
 1089    H    ALA 147           HN       ALA 147  16.635   9.075   4.464
 1090    HA   ALA 147           HA       ALA 147  16.550   7.445   2.029
 1091    HB1  ALA 147           HB1      ALA 147  14.446   8.729   2.190
 1092    HB2  ALA 147           HB2      ALA 147  15.435   9.249   0.825
 1093    HB3  ALA 147           HB3      ALA 147  15.385  10.219   2.295
 1094    H    VAL 148           HN       VAL 148  18.388   7.656   0.869
 1095    HA   VAL 148           HA       VAL 148  20.017  10.066   1.318
 1096    HB   VAL 148           HB       VAL 148  21.402   7.653   0.372
 1097   HG11  VAL 148          HG11      VAL 148  22.546   9.723   0.791
 1098   HG12  VAL 148          HG12      VAL 148  23.117   8.475   1.898
 1099   HG13  VAL 148          HG13      VAL 148  22.000   9.713   2.466
 1100   HG21  VAL 148          HG21      VAL 148  21.649   6.672   2.623
 1101   HG22  VAL 148          HG22      VAL 148  19.985   6.588   2.049
 1102   HG23  VAL 148          HG23      VAL 148  20.448   7.804   3.241
 1103    H    ASP 149           HN       ASP 149  21.092  10.849  -0.534
 1104    HA   ASP 149           HA       ASP 149  19.821  10.002  -2.994
 1105    HB2  ASP 149           HB2      ASP 149  20.775  12.135  -3.836
 1106    HB3  ASP 149           HB1      ASP 149  19.606  12.333  -2.547
 1107    H    LEU 150           HN       LEU 150  20.951   8.923  -4.506
 1108    HA   LEU 150           HA       LEU 150  23.867   9.038  -4.428
 1109    HB2  LEU 150           HB2      LEU 150  22.781   6.978  -3.283
 1110    HB3  LEU 150           HB1      LEU 150  22.442   6.450  -4.916
 1111    HG   LEU 150           HG       LEU 150  24.462   5.404  -3.916
 1112   HD11  LEU 150          HD11      LEU 150  24.268   5.504  -6.326
 1113   HD12  LEU 150          HD12      LEU 150  25.948   5.725  -5.837
 1114   HD13  LEU 150          HD13      LEU 150  24.986   7.116  -6.337
 1115   HD21  LEU 150          HD21      LEU 150  25.602   8.187  -4.068
 1116   HD22  LEU 150          HD22      LEU 150  26.492   6.722  -3.655
 1117   HD23  LEU 150          HD23      LEU 150  25.211   7.305  -2.593
 1118    H    GLU 151           HN       GLU 151  20.994   8.342  -6.139
 1119    HA   GLU 151           HA       GLU 151  22.291   7.923  -8.689
 1120    HB2  GLU 151           HB2      GLU 151  20.382   6.586  -8.267
 1121    HB3  GLU 151           HB1      GLU 151  19.432   7.969  -7.752
 1122    HG2  GLU 151           HG2      GLU 151  18.569   7.373  -9.821
 1123    HG3  GLU 151           HG1      GLU 151  19.589   8.783 -10.143
 1124    H    HIS 152           HN       HIS 152  20.594  10.530  -7.075
 1125    HA   HIS 152           HA       HIS 152  20.018  11.975  -9.456
 1126    HB2  HIS 152           HB2      HIS 152  18.941  13.521  -8.125
 1127    HB3  HIS 152           HB1      HIS 152  18.885  12.108  -7.090
 1128    HD1  HIS 152           HD1      HIS 152  18.820  15.240  -6.293
 1129    HD2  HIS 152           HD2      HIS 152  21.999  12.589  -5.818
 1130    HE1  HIS 152           HE1      HIS 152  20.221  16.184  -4.417
 1131    HE2  HIS 152           HE2      HIS 152  22.023  14.463  -4.028
 1132    H    HIS 153           HN       HIS 153  20.918  13.949 -10.174
 1133    HA   HIS 153           HA       HIS 153  22.471  15.553 -10.555
 1134    HB2  HIS 153           HB2      HIS 153  22.016  15.845  -8.055
 1135    HB3  HIS 153           HB1      HIS 153  23.544  15.016  -7.793
 1136    HD1  HIS 153           HD1      HIS 153  22.303  18.083  -9.708
 1137    HD2  HIS 153           HD2      HIS 153  25.623  16.721  -7.602
 1138    HE1  HIS 153           HE1      HIS 153  23.894  20.026  -9.615
 1139    HE2  HIS 153           HE2      HIS 153  25.745  19.257  -8.090
 1140    H    HIS 154           HN       HIS 154  23.118  12.573 -10.866
 1141    HA   HIS 154           HA       HIS 154  26.044  12.830 -11.012
 1142    HB2  HIS 154           HB2      HIS 154  24.206  10.480 -10.798
 1143    HB3  HIS 154           HB1      HIS 154  25.755  10.272 -11.598
 1144    HD1  HIS 154           HD1      HIS 154  26.152   8.589  -9.530
 1145    HD2  HIS 154           HD2      HIS 154  26.061  12.650  -8.634
 1146    HE1  HIS 154           HE1      HIS 154  27.245   8.813  -7.280
 1147    HE2  HIS 154           HE2      HIS 154  27.415  11.295  -6.890
 1148    H    HIS 155           HN       HIS 155  27.118  12.549 -12.928
 1149    HA   HIS 155           HA       HIS 155  27.491  12.812 -15.140
 1150    HB2  HIS 155           HB2      HIS 155  25.031  11.075 -15.284
 1151    HB3  HIS 155           HB1      HIS 155  25.864  11.634 -16.728
 1152    HD1  HIS 155           HD1      HIS 155  28.590  10.980 -16.648
 1153    HD2  HIS 155           HD2      HIS 155  25.933   8.685 -14.424
 1154    HE1  HIS 155           HE1      HIS 155  29.765   8.802 -16.233
 1155    HE2  HIS 155           HE2      HIS 155  28.075   7.366 -15.037
 1156    H    HIS 156           HN       HIS 156  27.123  15.093 -14.800
 1157    HA   HIS 156           HA       HIS 156  24.648  16.038 -16.082
 1158    HB2  HIS 156           HB2      HIS 156  24.859  16.840 -13.781
 1159    HB3  HIS 156           HB1      HIS 156  26.448  17.506 -14.140
 1160    HD1  HIS 156           HD1      HIS 156  22.811  17.992 -15.108
 1161    HD2  HIS 156           HD2      HIS 156  26.417  20.074 -15.108
 1162    HE1  HIS 156           HE1      HIS 156  22.240  20.346 -15.796
 1163    HE2  HIS 156           HE2      HIS 156  24.461  21.523 -15.984
 1164    H    HIS 157           HN       HIS 157  24.806  17.000 -17.967
 1165    HA   HIS 157           HA       HIS 157  27.437  17.896 -18.906
 1166    HB2  HIS 157           HB2      HIS 157  26.312  16.222 -20.325
 1167    HB3  HIS 157           HB1      HIS 157  24.907  17.270 -20.454
 1168    HD1  HIS 157           HD1      HIS 157  25.383  19.617 -21.711
 1169    HD2  HIS 157           HD2      HIS 157  28.194  16.610 -22.259
 1170    HE1  HIS 157           HE1      HIS 157  26.646  20.244 -23.795
 1171    HE2  HIS 157           HE2      HIS 157  28.184  18.299 -24.224
  Start of MODEL   18
    1    H1   MET   1           HT1      MET   1  26.040  -4.169 -12.902
    2    H2   MET   1           HT2      MET   1  25.522  -5.777 -12.897
    3    H3   MET   1           HT3      MET   1  24.392  -4.528 -13.065
    4    HA   MET   1           HA       MET   1  26.504  -5.275 -14.995
    5    HB2  MET   1           HB2      MET   1  23.497  -5.527 -15.083
    6    HB3  MET   1           HB1      MET   1  24.537  -5.753 -16.482
    7    HG2  MET   1           HG2      MET   1  25.634  -7.625 -15.375
    8    HG3  MET   1           HG1      MET   1  24.621  -7.387 -13.953
    9    HE1  MET   1           HE1      MET   1  23.045  -8.758 -18.077
   10    HE2  MET   1           HE2      MET   1  24.734  -8.402 -17.724
   11    HE3  MET   1           HE3      MET   1  23.549  -7.097 -17.766
   12    H    GLY   2           HN       GLY   2  23.548  -3.261 -14.619
   13    HA2  GLY   2           HA2      GLY   2  24.174  -0.804 -14.750
   14    HA3  GLY   2           HA1      GLY   2  24.936  -1.240 -16.270
   15    H    GLN   3           HN       GLN   3  22.507  -3.191 -16.571
   16    HA   GLN   3           HA       GLN   3  20.517  -1.180 -17.332
   17    HB2  GLN   3           HB2      GLN   3  22.009  -1.709 -19.294
   18    HB3  GLN   3           HB1      GLN   3  21.432  -3.367 -19.208
   19    HG2  GLN   3           HG2      GLN   3  20.156  -2.350 -20.888
   20    HG3  GLN   3           HG1      GLN   3  19.096  -2.425 -19.483
   21   HE21  GLN   3          HE21      GLN   3  18.925  -0.669 -21.789
   22   HE22  GLN   3          HE22      GLN   3  19.033   0.951 -21.187
   23    HA   PRO   4           HA       PRO   4  17.989  -4.414 -15.535
   24    HB2  PRO   4           HB2      PRO   4  15.692  -3.014 -15.481
   25    HB3  PRO   4           HB1      PRO   4  17.012  -2.672 -14.356
   26    HG2  PRO   4           HG2      PRO   4  16.280  -1.258 -16.895
   27    HG3  PRO   4           HG1      PRO   4  16.712  -0.565 -15.319
   28    HD2  PRO   4           HD2      PRO   4  18.478  -0.785 -17.379
   29    HD3  PRO   4           HD1      PRO   4  18.964  -0.850 -15.672
   30    HA   PRO   5           HA       PRO   5  16.050  -6.144 -19.185
   31    HB2  PRO   5           HB2      PRO   5  14.245  -7.577 -17.363
   32    HB3  PRO   5           HB1      PRO   5  15.449  -8.219 -18.485
   33    HG2  PRO   5           HG2      PRO   5  15.813  -8.306 -15.822
   34    HG3  PRO   5           HG1      PRO   5  17.164  -8.065 -16.945
   35    HD2  PRO   5           HD2      PRO   5  15.695  -6.043 -15.287
   36    HD3  PRO   5           HD1      PRO   5  17.440  -6.203 -15.590
   37    H    ALA   6           HN       ALA   6  14.604  -5.130 -20.410
   38    HA   ALA   6           HA       ALA   6  12.003  -4.406 -19.264
   39    HB1  ALA   6           HB1      ALA   6  12.090  -2.176 -20.240
   40    HB2  ALA   6           HB2      ALA   6  13.715  -2.488 -20.846
   41    HB3  ALA   6           HB3      ALA   6  13.423  -2.406 -19.108
   42    H    GLU   7           HN       GLU   7  10.317  -4.169 -20.786
   43    HA   GLU   7           HA       GLU   7  10.906  -5.070 -23.526
   44    HB2  GLU   7           HB2      GLU   7   9.958  -6.936 -22.236
   45    HB3  GLU   7           HB1      GLU   7   8.596  -5.930 -21.767
   46    HG2  GLU   7           HG2      GLU   7   7.902  -7.407 -23.507
   47    HG3  GLU   7           HG1      GLU   7   7.952  -5.767 -24.148
   48    H    GLU   8           HN       GLU   8   9.631  -4.100 -25.136
   49    HA   GLU   8           HA       GLU   8   8.423  -1.589 -24.301
   50    HB2  GLU   8           HB2      GLU   8   9.000  -2.712 -27.046
   51    HB3  GLU   8           HB1      GLU   8   8.249  -1.148 -26.756
   52    HG2  GLU   8           HG2      GLU   8  10.273  -0.491 -25.474
   53    HG3  GLU   8           HG1      GLU   8  11.025  -2.006 -25.973
   54    H    ALA   9           HN       ALA   9   6.309  -0.938 -24.859
   55    HA   ALA   9           HA       ALA   9   4.479  -3.197 -25.332
   56    HB1  ALA   9           HB1      ALA   9   2.845  -2.031 -23.918
   57    HB2  ALA   9           HB2      ALA   9   4.030  -0.761 -23.611
   58    HB3  ALA   9           HB3      ALA   9   4.329  -2.403 -23.039
   59    H    GLU  10           HN       GLU  10   2.977  -3.006 -26.844
   60    HA   GLU  10           HA       GLU  10   2.502  -0.363 -28.066
   61    HB2  GLU  10           HB2      GLU  10   2.576  -3.031 -29.495
   62    HB3  GLU  10           HB1      GLU  10   2.204  -1.481 -30.236
   63    HG2  GLU  10           HG2      GLU  10   4.453  -0.703 -29.809
   64    HG3  GLU  10           HG1      GLU  10   4.831  -2.203 -28.960
   65    H    GLN  11           HN       GLN  11   1.218  -3.672 -28.086
   66    HA   GLN  11           HA       GLN  11  -1.394  -2.587 -27.275
   67    HB2  GLN  11           HB2      GLN  11  -0.906  -4.862 -29.212
   68    HB3  GLN  11           HB1      GLN  11  -2.480  -4.357 -28.616
   69    HG2  GLN  11           HG2      GLN  11  -2.261  -2.226 -29.725
   70    HG3  GLN  11           HG1      GLN  11  -0.626  -2.632 -30.243
   71   HE21  GLN  11          HE21      GLN  11  -0.324  -4.125 -31.885
   72   HE22  GLN  11          HE22      GLN  11  -1.604  -4.619 -32.938
   73    HA   PRO  12           HA       PRO  12   0.053  -5.590 -24.138
   74    HB2  PRO  12           HB2      PRO  12  -1.716  -4.067 -22.362
   75    HB3  PRO  12           HB1      PRO  12   0.019  -4.369 -22.225
   76    HG2  PRO  12           HG2      PRO  12  -0.955  -1.930 -22.831
   77    HG3  PRO  12           HG1      PRO  12   0.574  -2.525 -23.505
   78    HD2  PRO  12           HD2      PRO  12  -2.140  -2.427 -24.773
   79    HD3  PRO  12           HD1      PRO  12  -0.559  -2.004 -25.467
   80    H    GLY  13           HN       GLY  13  -3.263  -4.328 -23.680
   81    HA2  GLY  13           HA2      GLY  13  -4.192  -7.136 -23.680
   82    HA3  GLY  13           HA1      GLY  13  -4.886  -5.881 -22.664
   83    H    ALA  14           HN       ALA  14  -6.376  -7.500 -24.402
   84    HA   ALA  14           HA       ALA  14  -6.930  -6.073 -26.827
   85    HB1  ALA  14           HB1      ALA  14  -8.721  -7.694 -27.147
   86    HB2  ALA  14           HB2      ALA  14  -8.532  -8.256 -25.486
   87    HB3  ALA  14           HB3      ALA  14  -7.236  -8.510 -26.656
   88    H    LEU  15           HN       LEU  15  -8.761  -6.635 -23.812
   89    HA   LEU  15           HA       LEU  15 -10.126  -4.069 -24.307
   90    HB2  LEU  15           HB2      LEU  15 -11.524  -6.195 -24.632
   91    HB3  LEU  15           HB1      LEU  15 -11.385  -6.417 -22.899
   92    HG   LEU  15           HG       LEU  15 -12.583  -3.925 -24.126
   93   HD11  LEU  15          HD11      LEU  15 -13.969  -6.447 -23.223
   94   HD12  LEU  15          HD12      LEU  15 -13.909  -5.805 -24.867
   95   HD13  LEU  15          HD13      LEU  15 -14.771  -4.925 -23.606
   96   HD21  LEU  15          HD21      LEU  15 -13.639  -3.714 -21.907
   97   HD22  LEU  15          HD22      LEU  15 -11.878  -3.657 -21.822
   98   HD23  LEU  15          HD23      LEU  15 -12.738  -5.128 -21.360
   99    H    ALA  16           HN       ALA  16  -9.114  -2.752 -22.937
  100    HA   ALA  16           HA       ALA  16  -8.692  -3.643 -20.164
  101    HB1  ALA  16           HB1      ALA  16  -7.375  -1.389 -21.695
  102    HB2  ALA  16           HB2      ALA  16  -6.642  -2.940 -21.294
  103    HB3  ALA  16           HB3      ALA  16  -7.052  -1.803 -20.011
  104    H    ARG  17           HN       ARG  17  -9.952  -2.800 -18.634
  105    HA   ARG  17           HA       ARG  17 -11.326  -0.264 -19.190
  106    HB2  ARG  17           HB2      ARG  17 -13.272  -1.256 -17.892
  107    HB3  ARG  17           HB1      ARG  17 -12.998  -1.893 -19.508
  108    HG2  ARG  17           HG2      ARG  17 -11.877  -3.841 -18.567
  109    HG3  ARG  17           HG1      ARG  17 -12.134  -3.207 -16.941
  110    HD2  ARG  17           HD2      ARG  17 -14.516  -3.348 -17.221
  111    HD3  ARG  17           HD1      ARG  17 -14.331  -3.844 -18.901
  112    HE   ARG  17           HE       ARG  17 -12.987  -5.605 -17.093
  113   HH11  ARG  17          HH11      ARG  17 -16.150  -4.794 -18.373
  114   HH12  ARG  17          HH12      ARG  17 -16.749  -6.419 -18.237
  115   HH21  ARG  17          HH21      ARG  17 -13.797  -7.725 -16.897
  116   HH22  ARG  17          HH22      ARG  17 -15.429  -8.077 -17.386
  117    H    GLU  18           HN       GLU  18 -11.585   1.130 -17.509
  118    HA   GLU  18           HA       GLU  18  -9.764   0.835 -15.315
  119    HB2  GLU  18           HB2      GLU  18 -10.325   2.974 -16.594
  120    HB3  GLU  18           HB1      GLU  18 -11.818   3.013 -15.667
  121    HG2  GLU  18           HG2      GLU  18 -10.209   4.447 -14.631
  122    HG3  GLU  18           HG1      GLU  18 -10.481   3.044 -13.596
  123    H    PHE  19           HN       PHE  19 -13.224   0.593 -15.777
  124    HA   PHE  19           HA       PHE  19 -13.691   0.438 -12.905
  125    HB2  PHE  19           HB2      PHE  19 -15.187   1.822 -14.358
  126    HB3  PHE  19           HB1      PHE  19 -15.703   0.347 -15.166
  127    HD1  PHE  19           HD2      PHE  19 -15.362   1.627 -11.670
  128    HD2  PHE  19           HD1      PHE  19 -17.702  -0.530 -14.493
  129    HE1  PHE  19           HE2      PHE  19 -17.115   1.318  -9.975
  130    HE2  PHE  19           HE1      PHE  19 -19.454  -0.852 -12.799
  131    HZ   PHE  19           HZ       PHE  19 -19.166   0.077 -10.537
  132    H    LEU  20           HN       LEU  20 -15.015  -1.336 -12.055
  133    HA   LEU  20           HA       LEU  20 -13.970  -3.860 -12.962
  134    HB2  LEU  20           HB2      LEU  20 -15.890  -3.215 -10.722
  135    HB3  LEU  20           HB1      LEU  20 -15.145  -4.779 -10.999
  136    HG   LEU  20           HG       LEU  20 -13.659  -2.241 -10.307
  137   HD11  LEU  20          HD11      LEU  20 -13.303  -3.289  -8.132
  138   HD12  LEU  20          HD12      LEU  20 -14.293  -4.663  -8.622
  139   HD13  LEU  20          HD13      LEU  20 -15.022  -3.067  -8.456
  140   HD21  LEU  20          HD21      LEU  20 -12.334  -3.757 -11.683
  141   HD22  LEU  20          HD22      LEU  20 -12.700  -5.092 -10.591
  142   HD23  LEU  20          HD23      LEU  20 -11.730  -3.732 -10.027
  143    H    ALA  21           HN       ALA  21 -15.577  -5.785 -12.888
  144    HA   ALA  21           HA       ALA  21 -17.633  -5.212 -14.864
  145    HB1  ALA  21           HB1      ALA  21 -17.773  -7.673 -15.090
  146    HB2  ALA  21           HB2      ALA  21 -16.592  -7.840 -13.789
  147    HB3  ALA  21           HB3      ALA  21 -16.125  -7.075 -15.308
  148    H    ALA  22           HN       ALA  22 -19.274  -4.258 -13.723
  149    HA   ALA  22           HA       ALA  22 -20.608  -5.952 -11.715
  150    HB1  ALA  22           HB1      ALA  22 -21.576  -3.900 -10.783
  151    HB2  ALA  22           HB2      ALA  22 -20.717  -2.943 -11.990
  152    HB3  ALA  22           HB3      ALA  22 -19.813  -3.830 -10.763
  153    H    MET  23           HN       MET  23 -22.945  -6.004 -11.826
  154    HA   MET  23           HA       MET  23 -23.865  -5.630 -14.590
  155    HB2  MET  23           HB2      MET  23 -24.905  -7.431 -12.406
  156    HB3  MET  23           HB1      MET  23 -25.627  -7.279 -14.001
  157    HG2  MET  23           HG2      MET  23 -22.840  -8.254 -13.418
  158    HG3  MET  23           HG1      MET  23 -24.229  -9.270 -13.799
  159    HE1  MET  23           HE1      MET  23 -21.447  -9.425 -15.326
  160    HE2  MET  23           HE2      MET  23 -21.970  -9.531 -17.005
  161    HE3  MET  23           HE3      MET  23 -22.825 -10.440 -15.760
  162    H    GLU  24           HN       GLU  24 -25.294  -5.605 -11.326
  163    HA   GLU  24           HA       GLU  24 -26.450  -3.052 -11.576
  164    HB2  GLU  24           HB2      GLU  24 -27.790  -4.233 -13.308
  165    HB3  GLU  24           HB1      GLU  24 -28.409  -5.296 -12.054
  166    HG2  GLU  24           HG2      GLU  24 -29.376  -3.348 -10.907
  167    HG3  GLU  24           HG1      GLU  24 -28.791  -2.319 -12.215
  168    HA   PRO  25           HA       PRO  25 -28.404  -5.243  -7.738
  169    HB2  PRO  25           HB2      PRO  25 -27.192  -7.896  -7.561
  170    HB3  PRO  25           HB1      PRO  25 -28.898  -7.442  -7.546
  171    HG2  PRO  25           HG2      PRO  25 -27.769  -8.740  -9.629
  172    HG3  PRO  25           HG1      PRO  25 -29.088  -7.573  -9.833
  173    HD2  PRO  25           HD2      PRO  25 -26.144  -7.194 -10.249
  174    HD3  PRO  25           HD1      PRO  25 -27.502  -6.650 -11.257
  175    H    GLU  26           HN       GLU  26 -26.148  -3.768  -7.857
  176    HA   GLU  26           HA       GLU  26 -23.964  -4.835  -6.371
  177    HB2  GLU  26           HB2      GLU  26 -24.769  -1.967  -6.900
  178    HB3  GLU  26           HB1      GLU  26 -23.227  -2.479  -6.230
  179    HG2  GLU  26           HG2      GLU  26 -22.676  -3.631  -8.277
  180    HG3  GLU  26           HG1      GLU  26 -24.257  -3.239  -8.953
  181    HA   PRO  27           HA       PRO  27 -25.876  -4.482  -2.354
  182    HB2  PRO  27           HB2      PRO  27 -23.176  -4.957  -1.318
  183    HB3  PRO  27           HB1      PRO  27 -24.624  -5.952  -1.155
  184    HG2  PRO  27           HG2      PRO  27 -22.538  -6.699  -2.690
  185    HG3  PRO  27           HG1      PRO  27 -24.212  -7.104  -3.106
  186    HD2  PRO  27           HD2      PRO  27 -22.458  -4.946  -4.212
  187    HD3  PRO  27           HD1      PRO  27 -23.584  -6.027  -5.060
  188    H    ALA  28           HN       ALA  28 -25.974  -2.939  -0.758
  189    HA   ALA  28           HA       ALA  28 -24.647  -0.450  -1.290
  190    HB1  ALA  28           HB1      ALA  28 -26.459  -1.237   0.991
  191    HB2  ALA  28           HB2      ALA  28 -26.971  -0.509  -0.530
  192    HB3  ALA  28           HB3      ALA  28 -25.960   0.407   0.585
  193    HA   PRO  29           HA       PRO  29 -20.967  -1.071   1.166
  194    HB2  PRO  29           HB2      PRO  29 -21.297   1.868   1.563
  195    HB3  PRO  29           HB1      PRO  29 -19.878   0.955   1.037
  196    HG2  PRO  29           HG2      PRO  29 -21.309   2.348  -0.718
  197    HG3  PRO  29           HG1      PRO  29 -20.650   0.760  -1.149
  198    HD2  PRO  29           HD2      PRO  29 -23.445   1.533  -0.445
  199    HD3  PRO  29           HD1      PRO  29 -22.866   0.339  -1.625
  200    H    ALA  30           HN       ALA  30 -20.803  -1.645   3.237
  201    HA   ALA  30           HA       ALA  30 -22.243  -0.210   5.296
  202    HB1  ALA  30           HB1      ALA  30 -23.468  -2.122   6.115
  203    HB2  ALA  30           HB2      ALA  30 -22.801  -3.136   4.835
  204    HB3  ALA  30           HB3      ALA  30 -23.892  -1.811   4.433
  205    HA   PRO  31           HA       PRO  31 -19.212  -3.211   7.433
  206    HB2  PRO  31           HB2      PRO  31 -17.855  -4.914   5.558
  207    HB3  PRO  31           HB1      PRO  31 -19.007  -5.377   6.809
  208    HG2  PRO  31           HG2      PRO  31 -19.498  -5.576   4.117
  209    HG3  PRO  31           HG1      PRO  31 -20.755  -5.431   5.357
  210    HD2  PRO  31           HD2      PRO  31 -19.604  -3.316   3.574
  211    HD3  PRO  31           HD1      PRO  31 -21.292  -3.587   4.062
  212    H    ALA  32           HN       ALA  32 -16.820  -3.470   7.678
  213    HA   ALA  32           HA       ALA  32 -15.399  -1.408   6.149
  214    HB1  ALA  32           HB1      ALA  32 -14.682  -2.724   8.770
  215    HB2  ALA  32           HB2      ALA  32 -15.396  -1.124   8.573
  216    HB3  ALA  32           HB3      ALA  32 -13.766  -1.440   7.980
  217    HA   PRO  33           HA       PRO  33 -13.498  -4.955   4.249
  218    HB2  PRO  33           HB2      PRO  33 -12.829  -3.622   1.955
  219    HB3  PRO  33           HB1      PRO  33 -14.441  -4.242   2.310
  220    HG2  PRO  33           HG2      PRO  33 -13.555  -1.491   2.142
  221    HG3  PRO  33           HG1      PRO  33 -15.197  -2.117   2.322
  222    HD2  PRO  33           HD2      PRO  33 -13.395  -1.040   4.359
  223    HD3  PRO  33           HD1      PRO  33 -15.147  -1.313   4.435
  224    H    GLU  34           HN       GLU  34 -11.868  -2.282   5.462
  225    HA   GLU  34           HA       GLU  34  -9.691  -1.854   5.945
  226    HB2  GLU  34           HB2      GLU  34  -9.666  -4.757   5.369
  227    HB3  GLU  34           HB1      GLU  34  -8.111  -3.947   5.250
  228    HG2  GLU  34           HG2      GLU  34  -8.367  -4.870   7.447
  229    HG3  GLU  34           HG1      GLU  34  -8.396  -3.113   7.547
  230    H    GLU  35           HN       GLU  35 -10.832  -1.251   3.329
  231    HA   GLU  35           HA       GLU  35  -8.513  -1.570   1.569
  232    HB2  GLU  35           HB2      GLU  35 -11.351  -0.766   0.901
  233    HB3  GLU  35           HB1      GLU  35 -10.047  -0.982  -0.264
  234    HG2  GLU  35           HG2      GLU  35  -9.859  -3.351   0.594
  235    HG3  GLU  35           HG1      GLU  35 -11.374  -3.063   1.443
  236    H    TRP  36           HN       TRP  36  -7.189  -0.021   2.225
  237    HA   TRP  36           HA       TRP  36  -8.033   2.680   2.743
  238    HB2  TRP  36           HB2      TRP  36  -5.155   1.992   2.333
  239    HB3  TRP  36           HB1      TRP  36  -5.894   3.049   3.533
  240    HD1  TRP  36           HD1      TRP  36  -7.612   1.398   5.289
  241    HE1  TRP  36           HE1      TRP  36  -6.792  -0.679   6.570
  242    HE3  TRP  36           HE3      TRP  36  -3.451   0.282   2.472
  243    HZ2  TRP  36           HZ2      TRP  36  -4.670  -2.530   6.412
  244    HZ3  TRP  36           HZ3      TRP  36  -2.119  -1.656   3.120
  245    HH2  TRP  36           HH2      TRP  36  -2.703  -3.039   5.024
  246    H    LEU  37           HN       LEU  37  -5.713   3.958   1.652
  247    HA   LEU  37           HA       LEU  37  -6.729   4.691  -0.898
  248    HB2  LEU  37           HB2      LEU  37  -5.593   6.272   0.566
  249    HB3  LEU  37           HB1      LEU  37  -4.127   5.325   0.490
  250    HG   LEU  37           HG       LEU  37  -3.992   5.831  -1.951
  251   HD11  LEU  37          HD11      LEU  37  -6.366   6.303  -2.320
  252   HD12  LEU  37          HD12      LEU  37  -5.340   7.633  -2.857
  253   HD13  LEU  37          HD13      LEU  37  -6.223   7.757  -1.337
  254   HD21  LEU  37          HD21      LEU  37  -2.703   7.107  -0.322
  255   HD22  LEU  37          HD22      LEU  37  -4.061   8.209  -0.095
  256   HD23  LEU  37          HD23      LEU  37  -3.232   8.137  -1.649
  257    H    ASP  38           HN       ASP  38  -6.538   3.350  -2.614
  258    HA   ASP  38           HA       ASP  38  -4.356   1.548  -2.877
  259    HB2  ASP  38           HB2      ASP  38  -6.652   1.241  -3.908
  260    HB3  ASP  38           HB1      ASP  38  -6.128   2.384  -5.147
  261    H    ILE  39           HN       ILE  39  -2.517   1.728  -3.826
  262    HA   ILE  39           HA       ILE  39  -1.402   4.257  -4.352
  263    HB   ILE  39           HB       ILE  39  -0.358   1.503  -5.023
  264   HG12  ILE  39          HG12      ILE  39  -0.296   3.189  -2.540
  265   HG13  ILE  39          HG11      ILE  39  -0.706   1.493  -2.722
  266   HG21  ILE  39          HG21      ILE  39   1.854   2.513  -5.017
  267   HG22  ILE  39          HG22      ILE  39   1.137   4.105  -4.763
  268   HG23  ILE  39          HG23      ILE  39   0.828   3.225  -6.262
  269   HD11  ILE  39          HD11      ILE  39   2.058   2.670  -2.904
  270   HD12  ILE  39          HD12      ILE  39   1.654   0.970  -3.145
  271   HD13  ILE  39          HD13      ILE  39   1.398   1.723  -1.572
  272    H    LEU  40           HN       LEU  40  -2.747   1.764  -6.400
  273    HA   LEU  40           HA       LEU  40  -2.094   3.352  -8.790
  274    HB2  LEU  40           HB2      LEU  40  -2.966   0.471  -8.621
  275    HB3  LEU  40           HB1      LEU  40  -2.462   1.318 -10.073
  276    HG   LEU  40           HG       LEU  40  -0.679   0.703  -7.708
  277   HD11  LEU  40          HD11      LEU  40  -0.842  -0.532 -10.455
  278   HD12  LEU  40          HD12      LEU  40  -1.281  -1.307  -8.932
  279   HD13  LEU  40          HD13      LEU  40   0.398  -0.874  -9.250
  280   HD21  LEU  40          HD21      LEU  40   1.124   1.492  -9.147
  281   HD22  LEU  40          HD22      LEU  40  -0.071   2.764  -8.893
  282   HD23  LEU  40          HD23      LEU  40  -0.041   1.876 -10.414
  283    H    GLY  41           HN       GLY  41  -4.425   2.930  -6.609
  284    HA2  GLY  41           HA2      GLY  41  -6.673   3.317  -6.514
  285    HA3  GLY  41           HA1      GLY  41  -6.523   4.053  -8.094
  286    H    ASN  42           HN       ASN  42  -5.501   0.778  -7.627
  287    HA   ASN  42           HA       ASN  42  -7.725  -0.039  -9.352
  288    HB2  ASN  42           HB2      ASN  42  -6.435  -1.838 -10.164
  289    HB3  ASN  42           HB1      ASN  42  -5.396  -0.433 -10.159
  290   HD21  ASN  42          HD21      ASN  42  -4.791  -0.630  -7.276
  291   HD22  ASN  42          HD22      ASN  42  -3.736  -1.986  -7.137
  292    H    GLY  43           HN       GLY  43  -6.287  -0.824  -6.219
  293    HA2  GLY  43           HA2      GLY  43  -8.055  -1.277  -4.544
  294    HA3  GLY  43           HA1      GLY  43  -8.761  -2.388  -5.713
  295    H    LEU  44           HN       LEU  44  -5.530  -2.678  -6.013
  296    HA   LEU  44           HA       LEU  44  -5.537  -5.165  -4.464
  297    HB2  LEU  44           HB2      LEU  44  -3.867  -4.201  -6.789
  298    HB3  LEU  44           HB1      LEU  44  -3.501  -5.666  -5.899
  299    HG   LEU  44           HG       LEU  44  -5.655  -6.613  -6.585
  300   HD11  LEU  44          HD11      LEU  44  -6.904  -4.499  -6.868
  301   HD12  LEU  44          HD12      LEU  44  -7.038  -5.581  -8.258
  302   HD13  LEU  44          HD13      LEU  44  -5.961  -4.186  -8.329
  303   HD21  LEU  44          HD21      LEU  44  -3.924  -5.615  -8.820
  304   HD22  LEU  44          HD22      LEU  44  -5.099  -6.923  -8.955
  305   HD23  LEU  44          HD23      LEU  44  -3.703  -7.094  -7.889
  306    H    LEU  45           HN       LEU  45  -3.875  -2.165  -4.886
  307    HA   LEU  45           HA       LEU  45  -1.815  -2.920  -2.931
  308    HB2  LEU  45           HB2      LEU  45  -0.736  -2.948  -4.984
  309    HB3  LEU  45           HB1      LEU  45  -1.643  -1.587  -5.592
  310    HG   LEU  45           HG       LEU  45  -0.378  -0.071  -4.178
  311   HD11  LEU  45          HD11      LEU  45   1.473  -0.839  -2.831
  312   HD12  LEU  45          HD12      LEU  45   1.152  -2.508  -3.299
  313   HD13  LEU  45          HD13      LEU  45  -0.018  -1.627  -2.310
  314   HD21  LEU  45          HD21      LEU  45   1.353  -1.964  -5.757
  315   HD22  LEU  45          HD22      LEU  45   1.795  -0.323  -5.279
  316   HD23  LEU  45          HD23      LEU  45   0.456  -0.590  -6.400
  317    H    ARG  46           HN       ARG  46  -2.294  -1.774  -1.115
  318    HA   ARG  46           HA       ARG  46  -3.135   1.045  -1.436
  319    HB2  ARG  46           HB2      ARG  46  -4.346  -0.903   0.509
  320    HB3  ARG  46           HB1      ARG  46  -4.908   0.721   0.128
  321    HG2  ARG  46           HG2      ARG  46  -5.510   0.030  -2.116
  322    HG3  ARG  46           HG1      ARG  46  -4.830  -1.569  -1.831
  323    HD2  ARG  46           HD2      ARG  46  -7.192  -0.365  -0.410
  324    HD3  ARG  46           HD1      ARG  46  -7.248  -1.623  -1.649
  325    HE   ARG  46           HE       ARG  46  -5.824  -2.059   0.893
  326   HH11  ARG  46          HH11      ARG  46  -8.150  -3.105  -1.515
  327   HH12  ARG  46          HH12      ARG  46  -8.594  -4.532  -0.638
  328   HH21  ARG  46          HH21      ARG  46  -6.440  -3.932   2.049
  329   HH22  ARG  46          HH22      ARG  46  -7.643  -4.998   1.387
  330    H    LYS  47           HN       LYS  47  -2.388   2.468   0.098
  331    HA   LYS  47           HA       LYS  47  -0.466   1.370   2.052
  332    HB2  LYS  47           HB2      LYS  47   0.292   2.893   0.067
  333    HB3  LYS  47           HB1      LYS  47  -0.440   4.194   0.992
  334    HG2  LYS  47           HG2      LYS  47   1.072   3.297   2.917
  335    HG3  LYS  47           HG1      LYS  47   1.986   2.572   1.594
  336    HD2  LYS  47           HD2      LYS  47   3.027   4.614   1.924
  337    HD3  LYS  47           HD1      LYS  47   1.960   4.918   0.560
  338    HE2  LYS  47           HE2      LYS  47   0.530   6.233   1.777
  339    HE3  LYS  47           HE1      LYS  47   0.922   5.444   3.303
  340    HZ1  LYS  47           HZ1      LYS  47   2.723   7.321   1.847
  341    HZ2  LYS  47           HZ2      LYS  47   3.024   6.611   3.362
  342    HZ3  LYS  47           HZ3      LYS  47   1.767   7.727   3.182
  343    H    LYS  48           HN       LYS  48  -0.967   1.669   4.159
  344    HA   LYS  48           HA       LYS  48  -2.815   3.864   4.828
  345    HB2  LYS  48           HB2      LYS  48  -3.733   1.676   5.370
  346    HB3  LYS  48           HB1      LYS  48  -2.295   1.274   6.300
  347    HG2  LYS  48           HG2      LYS  48  -2.813   3.005   7.908
  348    HG3  LYS  48           HG1      LYS  48  -4.221   3.492   6.957
  349    HD2  LYS  48           HD2      LYS  48  -4.882   2.095   8.840
  350    HD3  LYS  48           HD1      LYS  48  -5.215   1.283   7.312
  351    HE2  LYS  48           HE2      LYS  48  -3.195  -0.054   7.565
  352    HE3  LYS  48           HE1      LYS  48  -2.813   0.786   9.067
  353    HZ1  LYS  48           HZ1      LYS  48  -4.833  -0.097  10.048
  354    HZ2  LYS  48           HZ2      LYS  48  -3.856  -1.356   9.479
  355    HZ3  LYS  48           HZ3      LYS  48  -5.227  -0.892   8.600
  356    H    THR  49           HN       THR  49  -1.827   5.552   5.680
  357    HA   THR  49           HA       THR  49   0.758   5.423   6.895
  358    HB   THR  49           HB       THR  49   0.095   7.852   7.541
  359    HG1  THR  49           HG1      THR  49  -2.145   7.661   7.207
  360   HG21  THR  49          HG21      THR  49   0.574   8.638   5.259
  361   HG22  THR  49          HG22      THR  49   0.278   7.009   4.649
  362   HG23  THR  49          HG23      THR  49   1.635   7.312   5.732
  363    H    LEU  50           HN       LEU  50   0.838   4.250   8.744
  364    HA   LEU  50           HA       LEU  50  -1.044   4.487  10.885
  365    HB2  LEU  50           HB2      LEU  50   1.866   3.858  11.277
  366    HB3  LEU  50           HB1      LEU  50   0.480   3.211  12.134
  367    HG   LEU  50           HG       LEU  50   1.044   2.564   9.246
  368   HD11  LEU  50          HD11      LEU  50   2.955   1.912  10.618
  369   HD12  LEU  50          HD12      LEU  50   2.068   0.508  10.020
  370   HD13  LEU  50          HD13      LEU  50   1.877   1.023  11.696
  371   HD21  LEU  50          HD21      LEU  50  -0.399   0.651   9.703
  372   HD22  LEU  50          HD22      LEU  50  -1.231   2.176  10.012
  373   HD23  LEU  50          HD23      LEU  50  -0.624   1.213  11.360
  374    H    VAL  51           HN       VAL  51   2.256   5.568  10.430
  375    HA   VAL  51           HA       VAL  51   1.571   8.230  11.504
  376    HB   VAL  51           HB       VAL  51   4.218   6.797  11.728
  377   HG11  VAL  51          HG11      VAL  51   3.342   9.495  12.753
  378   HG12  VAL  51          HG12      VAL  51   4.539   9.172  11.497
  379   HG13  VAL  51          HG13      VAL  51   4.865   8.710  13.168
  380   HG21  VAL  51          HG21      VAL  51   2.578   5.838  13.243
  381   HG22  VAL  51          HG22      VAL  51   2.196   7.443  13.866
  382   HG23  VAL  51          HG23      VAL  51   3.792   6.743  14.149
  383    HA   PRO  52           HA       PRO  52   3.459   8.989   7.512
  384    HB2  PRO  52           HB2      PRO  52   1.991  11.081   6.860
  385    HB3  PRO  52           HB1      PRO  52   1.276   9.472   7.054
  386    HG2  PRO  52           HG2      PRO  52   1.071  11.839   8.835
  387    HG3  PRO  52           HG1      PRO  52  -0.077  10.513   8.592
  388    HD2  PRO  52           HD2      PRO  52   1.955  10.796  10.635
  389    HD3  PRO  52           HD1      PRO  52   0.742   9.509  10.450
  390    H    GLY  53           HN       GLY  53   5.212   9.595   9.437
  391    HA2  GLY  53           HA2      GLY  53   7.090  10.882   9.706
  392    HA3  GLY  53           HA1      GLY  53   6.525  11.868   8.366
  393    HA   PRO  54           HA       PRO  54   5.891  14.189  12.523
  394    HB2  PRO  54           HB2      PRO  54   8.663  15.135  12.075
  395    HB3  PRO  54           HB1      PRO  54   7.864  14.692  13.588
  396    HG2  PRO  54           HG2      PRO  54   9.731  13.117  12.519
  397    HG3  PRO  54           HG1      PRO  54   8.298  12.430  13.307
  398    HD2  PRO  54           HD2      PRO  54   8.860  12.788  10.382
  399    HD3  PRO  54           HD1      PRO  54   8.155  11.393  11.227
  400    HA   PRO  55           HA       PRO  55   4.856  17.544   9.798
  401    HB2  PRO  55           HB2      PRO  55   5.406  19.635  11.602
  402    HB3  PRO  55           HB1      PRO  55   3.845  18.852  11.340
  403    HG2  PRO  55           HG2      PRO  55   5.849  18.418  13.481
  404    HG3  PRO  55           HG1      PRO  55   4.087  18.231  13.528
  405    HD2  PRO  55           HD2      PRO  55   5.771  16.121  13.464
  406    HD3  PRO  55           HD1      PRO  55   4.170  16.081  12.699
  407    H    GLY  56           HN       GLY  56   6.293  17.815   8.217
  408    HA2  GLY  56           HA2      GLY  56   7.924  19.316   7.275
  409    HA3  GLY  56           HA1      GLY  56   8.747  19.326   8.827
  410    H    SER  57           HN       SER  57   7.538  16.419   7.285
  411    HA   SER  57           HA       SER  57  10.195  15.350   7.151
  412    HB2  SER  57           HB2      SER  57   7.503  14.213   6.389
  413    HB3  SER  57           HB1      SER  57   9.016  13.333   6.383
  414    HG   SER  57           HG       SER  57   7.784  14.528   8.641
  415    H    SER  58           HN       SER  58  10.521  13.950   5.055
  416    HA   SER  58           HA       SER  58   9.789  15.465   2.657
  417    HB2  SER  58           HB2      SER  58  12.573  14.431   3.267
  418    HB3  SER  58           HB1      SER  58  12.077  15.297   1.813
  419    HG   SER  58           HG       SER  58  12.900  16.293   4.147
  420    H    ARG  59           HN       ARG  59   8.982  14.117   1.168
  421    HA   ARG  59           HA       ARG  59   9.371  11.263   1.533
  422    HB2  ARG  59           HB2      ARG  59   7.707  11.285  -0.537
  423    HB3  ARG  59           HB1      ARG  59   7.146  11.493   1.123
  424    HG2  ARG  59           HG2      ARG  59   7.408  14.017   0.647
  425    HG3  ARG  59           HG1      ARG  59   7.411  13.527  -1.049
  426    HD2  ARG  59           HD2      ARG  59   5.256  12.461  -0.783
  427    HD3  ARG  59           HD1      ARG  59   5.267  12.808   0.948
  428    HE   ARG  59           HE       ARG  59   5.005  14.811  -1.203
  429   HH11  ARG  59          HH11      ARG  59   4.621  13.866   2.170
  430   HH12  ARG  59          HH12      ARG  59   3.746  15.311   2.578
  431   HH21  ARG  59          HH21      ARG  59   3.828  16.650  -0.670
  432   HH22  ARG  59          HH22      ARG  59   3.277  16.892   0.961
  433    HA   PRO  60           HA       PRO  60  13.007  11.527  -0.940
  434    HB2  PRO  60           HB2      PRO  60  13.127   8.761  -1.354
  435    HB3  PRO  60           HB1      PRO  60  13.867   9.650  -0.022
  436    HG2  PRO  60           HG2      PRO  60  11.273   8.183  -0.118
  437    HG3  PRO  60           HG1      PRO  60  12.456   8.284   1.200
  438    HD2  PRO  60           HD2      PRO  60  10.209   9.696   1.315
  439    HD3  PRO  60           HD1      PRO  60  11.747  10.425   1.827
  440    H    VAL  61           HN       VAL  61  13.797  11.045  -3.019
  441    HA   VAL  61           HA       VAL  61  11.671  10.779  -5.021
  442    HB   VAL  61           HB       VAL  61  14.540  11.625  -5.474
  443   HG11  VAL  61          HG11      VAL  61  13.687  12.587  -7.554
  444   HG12  VAL  61          HG12      VAL  61  12.073  11.991  -7.168
  445   HG13  VAL  61          HG13      VAL  61  13.382  10.850  -7.474
  446   HG21  VAL  61          HG21      VAL  61  13.795  13.930  -5.442
  447   HG22  VAL  61          HG22      VAL  61  13.439  13.157  -3.896
  448   HG23  VAL  61          HG23      VAL  61  12.150  13.417  -5.071
  449    H    LYS  62           HN       LYS  62  12.036   9.407  -6.858
  450    HA   LYS  62           HA       LYS  62  13.305   6.926  -6.201
  451    HB2  LYS  62           HB2      LYS  62  12.050   7.904  -8.789
  452    HB3  LYS  62           HB1      LYS  62  12.604   6.257  -8.502
  453    HG2  LYS  62           HG2      LYS  62  11.007   6.265  -6.504
  454    HG3  LYS  62           HG1      LYS  62  10.303   7.704  -7.242
  455    HD2  LYS  62           HD2      LYS  62   9.641   6.517  -9.165
  456    HD3  LYS  62           HD1      LYS  62  10.666   5.139  -8.756
  457    HE2  LYS  62           HE2      LYS  62   9.229   4.910  -6.662
  458    HE3  LYS  62           HE1      LYS  62   8.107   6.019  -7.449
  459    HZ1  LYS  62           HZ1      LYS  62   7.986   4.439  -9.320
  460    HZ2  LYS  62           HZ2      LYS  62   7.442   3.778  -7.865
  461    HZ3  LYS  62           HZ3      LYS  62   8.971   3.356  -8.451
  462    H    GLY  63           HN       GLY  63  15.284   6.383  -6.526
  463    HA2  GLY  63           HA2      GLY  63  17.233   6.460  -8.092
  464    HA3  GLY  63           HA1      GLY  63  17.003   8.207  -8.071
  465    H    GLN  64           HN       GLN  64  16.138   7.909  -5.191
  466    HA   GLN  64           HA       GLN  64  18.810   7.885  -4.001
  467    HB2  GLN  64           HB2      GLN  64  16.391   8.260  -2.311
  468    HB3  GLN  64           HB1      GLN  64  17.946   9.087  -2.247
  469    HG2  GLN  64           HG2      GLN  64  15.797   9.600  -4.290
  470    HG3  GLN  64           HG1      GLN  64  16.041  10.547  -2.830
  471   HE21  GLN  64          HE21      GLN  64  18.576   9.294  -4.962
  472   HE22  GLN  64          HE22      GLN  64  19.129  10.848  -5.478
  473    H    VAL  65           HN       VAL  65  19.480   6.273  -2.552
  474    HA   VAL  65           HA       VAL  65  17.684   3.999  -2.352
  475    HB   VAL  65           HB       VAL  65  19.454   2.745  -1.298
  476   HG11  VAL  65          HG11      VAL  65  19.410   2.794  -3.719
  477   HG12  VAL  65          HG12      VAL  65  21.064   2.657  -3.120
  478   HG13  VAL  65          HG13      VAL  65  20.470   4.204  -3.722
  479   HG21  VAL  65          HG21      VAL  65  21.037   5.297  -1.378
  480   HG22  VAL  65          HG22      VAL  65  21.728   3.705  -1.057
  481   HG23  VAL  65          HG23      VAL  65  20.525   4.383   0.043
  482    H    VAL  66           HN       VAL  66  16.563   3.509  -0.663
  483    HA   VAL  66           HA       VAL  66  16.770   5.239   1.697
  484    HB   VAL  66           HB       VAL  66  14.315   5.182   1.855
  485   HG11  VAL  66          HG11      VAL  66  13.829   6.670  -0.059
  486   HG12  VAL  66          HG12      VAL  66  15.367   6.200  -0.786
  487   HG13  VAL  66          HG13      VAL  66  15.342   7.078   0.740
  488   HG21  VAL  66          HG21      VAL  66  14.287   4.036  -0.930
  489   HG22  VAL  66          HG22      VAL  66  12.930   4.256   0.181
  490   HG23  VAL  66          HG23      VAL  66  14.148   3.021   0.505
  491    H    THR  67           HN       THR  67  16.335   4.335   3.680
  492    HA   THR  67           HA       THR  67  16.438   1.428   3.741
  493    HB   THR  67           HB       THR  67  16.639   1.658   6.190
  494    HG1  THR  67           HG1      THR  67  17.130   3.923   6.884
  495   HG21  THR  67          HG21      THR  67  18.863   2.574   6.272
  496   HG22  THR  67          HG22      THR  67  18.621   3.388   4.723
  497   HG23  THR  67          HG23      THR  67  18.663   1.625   4.799
  498    H    VAL  68           HN       VAL  68  14.541   0.401   3.610
  499    HA   VAL  68           HA       VAL  68  12.381   1.520   5.248
  500    HB   VAL  68           HB       VAL  68  10.858  -0.086   4.091
  501   HG11  VAL  68          HG11      VAL  68  11.018   2.250   3.401
  502   HG12  VAL  68          HG12      VAL  68  10.697   1.197   2.024
  503   HG13  VAL  68          HG13      VAL  68  12.320   1.839   2.285
  504   HG21  VAL  68          HG21      VAL  68  13.269  -0.549   2.333
  505   HG22  VAL  68          HG22      VAL  68  11.630  -1.096   1.980
  506   HG23  VAL  68          HG23      VAL  68  12.488  -1.729   3.386
  507    H    HIS  69           HN       HIS  69  11.524   0.314   6.902
  508    HA   HIS  69           HA       HIS  69  12.769  -2.310   7.368
  509    HB2  HIS  69           HB2      HIS  69  12.909  -0.845   9.336
  510    HB3  HIS  69           HB1      HIS  69  11.180  -0.527   9.253
  511    HD1  HIS  69           HD1      HIS  69  12.602  -1.825  11.798
  512    HD2  HIS  69           HD2      HIS  69  10.585  -3.881   8.805
  513    HE1  HIS  69           HE1      HIS  69  11.880  -4.033  12.804
  514    HE2  HIS  69           HE2      HIS  69  10.530  -5.147  11.047
  515    H    LEU  70           HN       LEU  70  11.573  -3.994   6.676
  516    HA   LEU  70           HA       LEU  70   8.691  -3.532   6.741
  517    HB2  LEU  70           HB2      LEU  70   8.295  -4.331   4.690
  518    HB3  LEU  70           HB1      LEU  70   9.914  -3.730   4.410
  519    HG   LEU  70           HG       LEU  70   9.314  -6.587   5.111
  520   HD11  LEU  70          HD11      LEU  70   9.659  -5.319   2.389
  521   HD12  LEU  70          HD12      LEU  70   8.180  -6.034   3.028
  522   HD13  LEU  70          HD13      LEU  70   9.580  -7.053   2.699
  523   HD21  LEU  70          HD21      LEU  70  11.733  -5.292   3.827
  524   HD22  LEU  70          HD22      LEU  70  11.545  -7.002   4.220
  525   HD23  LEU  70          HD23      LEU  70  11.621  -5.805   5.512
  526    H    GLN  71           HN       GLN  71   7.543  -4.880   7.768
  527    HA   GLN  71           HA       GLN  71   8.448  -7.658   8.061
  528    HB2  GLN  71           HB2      GLN  71   6.550  -6.614  10.063
  529    HB3  GLN  71           HB1      GLN  71   7.798  -7.833  10.249
  530    HG2  GLN  71           HG2      GLN  71   8.723  -6.238  11.531
  531    HG3  GLN  71           HG1      GLN  71   9.374  -5.735   9.975
  532   HE21  GLN  71          HE21      GLN  71   6.616  -4.881   9.199
  533   HE22  GLN  71          HE22      GLN  71   6.439  -3.337   9.948
  534    H    THR  72           HN       THR  72   7.194  -8.821   6.955
  535    HA   THR  72           HA       THR  72   4.767  -7.571   5.958
  536    HB   THR  72           HB       THR  72   6.527  -9.689   4.750
  537    HG1  THR  72           HG1      THR  72   7.549  -8.048   3.853
  538   HG21  THR  72          HG21      THR  72   4.228  -9.932   4.047
  539   HG22  THR  72          HG22      THR  72   5.198  -9.289   2.721
  540   HG23  THR  72          HG23      THR  72   4.149  -8.214   3.652
  541    H    SER  73           HN       SER  73   2.889  -8.422   6.348
  542    HA   SER  73           HA       SER  73   2.767 -11.099   7.537
  543    HB2  SER  73           HB2      SER  73   0.349  -9.460   7.723
  544    HB3  SER  73           HB1      SER  73   1.263 -10.259   9.003
  545    HG   SER  73           HG       SER  73   1.741  -7.719   7.830
  546    H    LEU  74           HN       LEU  74   1.315 -12.554   6.745
  547    HA   LEU  74           HA       LEU  74   0.447 -12.305   4.049
  548    HB2  LEU  74           HB2      LEU  74  -0.153 -14.292   6.228
  549    HB3  LEU  74           HB1      LEU  74  -0.719 -14.474   4.583
  550    HG   LEU  74           HG       LEU  74   2.047 -14.718   5.678
  551   HD11  LEU  74          HD11      LEU  74   0.745 -16.735   5.409
  552   HD12  LEU  74          HD12      LEU  74   2.067 -16.707   4.241
  553   HD13  LEU  74          HD13      LEU  74   0.425 -16.331   3.721
  554   HD21  LEU  74          HD21      LEU  74   1.383 -14.076   2.816
  555   HD22  LEU  74          HD22      LEU  74   2.958 -14.615   3.400
  556   HD23  LEU  74          HD23      LEU  74   2.297 -13.064   3.937
  557    H    GLU  75           HN       GLU  75  -1.852 -12.578   3.395
  558    HA   GLU  75           HA       GLU  75  -3.611 -10.725   4.463
  559    HB2  GLU  75           HB2      GLU  75  -5.393 -12.014   3.243
  560    HB3  GLU  75           HB1      GLU  75  -3.998 -11.578   2.267
  561    HG2  GLU  75           HG2      GLU  75  -3.112 -13.854   2.546
  562    HG3  GLU  75           HG1      GLU  75  -4.548 -14.280   3.477
  563    H    ASN  76           HN       ASN  76  -2.825 -13.880   5.522
  564    HA   ASN  76           HA       ASN  76  -5.144 -14.269   7.188
  565    HB2  ASN  76           HB2      ASN  76  -2.524 -15.784   7.127
  566    HB3  ASN  76           HB1      ASN  76  -4.002 -16.305   7.925
  567   HD21  ASN  76          HD21      ASN  76  -2.297 -16.047   4.947
  568   HD22  ASN  76          HD22      ASN  76  -3.439 -16.896   3.970
  569    H    GLY  77           HN       GLY  77  -2.350 -12.438   7.420
  570    HA2  GLY  77           HA2      GLY  77  -1.948 -10.991   9.257
  571    HA3  GLY  77           HA1      GLY  77  -2.740 -12.152  10.312
  572    H    THR  78           HN       THR  78  -0.852 -13.968   8.411
  573    HA   THR  78           HA       THR  78   1.052 -14.375  10.510
  574    HB   THR  78           HB       THR  78   0.908 -15.732   7.824
  575    HG1  THR  78           HG1      THR  78  -0.085 -16.962  10.131
  576   HG21  THR  78          HG21      THR  78   2.104 -17.547   8.931
  577   HG22  THR  78          HG22      THR  78   2.140 -16.627  10.433
  578   HG23  THR  78          HG23      THR  78   3.029 -16.049   9.025
  579    H    ARG  79           HN       ARG  79   2.735 -13.052  10.692
  580    HA   ARG  79           HA       ARG  79   3.882 -11.731   8.421
  581    HB2  ARG  79           HB2      ARG  79   4.696 -11.874  11.313
  582    HB3  ARG  79           HB1      ARG  79   5.632 -11.007  10.095
  583    HG2  ARG  79           HG2      ARG  79   3.213  -9.995   9.579
  584    HG3  ARG  79           HG1      ARG  79   3.019 -10.359  11.298
  585    HD2  ARG  79           HD2      ARG  79   4.836  -8.979  11.898
  586    HD3  ARG  79           HD1      ARG  79   5.381  -8.839  10.221
  587    HE   ARG  79           HE       ARG  79   2.888  -7.776  10.162
  588   HH11  ARG  79          HH11      ARG  79   5.690  -7.140  12.166
  589   HH12  ARG  79          HH12      ARG  79   5.337  -5.452  12.342
  590   HH21  ARG  79          HH21      ARG  79   2.438  -5.525  10.410
  591   HH22  ARG  79          HH22      ARG  79   3.524  -4.529  11.340
  592    H    VAL  80           HN       VAL  80   5.350 -12.375   7.134
  593    HA   VAL  80           HA       VAL  80   6.489 -15.028   7.612
  594    HB   VAL  80           HB       VAL  80   6.648 -15.169   5.154
  595   HG11  VAL  80          HG11      VAL  80   4.254 -15.421   4.742
  596   HG12  VAL  80          HG12      VAL  80   3.901 -14.496   6.203
  597   HG13  VAL  80          HG13      VAL  80   4.704 -16.064   6.321
  598   HG21  VAL  80          HG21      VAL  80   5.499 -13.522   3.760
  599   HG22  VAL  80          HG22      VAL  80   6.827 -12.782   4.655
  600   HG23  VAL  80          HG23      VAL  80   5.164 -12.543   5.190
  601    H    GLN  81           HN       GLN  81   7.380 -11.821   7.524
  602    HA   GLN  81           HA       GLN  81  10.173 -12.468   7.405
  603    HB2  GLN  81           HB2      GLN  81  10.692 -10.976   5.502
  604    HB3  GLN  81           HB1      GLN  81   9.713 -12.352   5.018
  605    HG2  GLN  81           HG2      GLN  81   7.720 -10.958   4.997
  606    HG3  GLN  81           HG1      GLN  81   8.680  -9.568   5.513
  607   HE21  GLN  81          HE21      GLN  81   7.812 -11.658   2.931
  608   HE22  GLN  81          HE22      GLN  81   8.559 -10.742   1.666
  609    H    GLU  82           HN       GLU  82  11.231 -11.135   8.750
  610    HA   GLU  82           HA       GLU  82  10.225  -8.381   9.007
  611    HB2  GLU  82           HB2      GLU  82   9.724  -9.580  11.091
  612    HB3  GLU  82           HB1      GLU  82  11.418 -10.042  11.236
  613    HG2  GLU  82           HG2      GLU  82  12.054  -7.692  11.411
  614    HG3  GLU  82           HG1      GLU  82  10.362  -7.222  11.253
  615    H    GLU  83           HN       GLU  83  11.612  -7.181   7.967
  616    HA   GLU  83           HA       GLU  83  14.464  -7.588   8.486
  617    HB2  GLU  83           HB2      GLU  83  14.313  -8.306   6.289
  618    HB3  GLU  83           HB1      GLU  83  12.995  -7.218   5.914
  619    HG2  GLU  83           HG2      GLU  83  14.392  -5.448   5.485
  620    HG3  GLU  83           HG1      GLU  83  15.728  -6.130   6.424
  621    HA   PRO  84           HA       PRO  84  13.682  -3.636  10.309
  622    HB2  PRO  84           HB2      PRO  84  16.125  -3.303  11.394
  623    HB3  PRO  84           HB1      PRO  84  14.971  -4.484  12.029
  624    HG2  PRO  84           HG2      PRO  84  17.216  -4.925  10.077
  625    HG3  PRO  84           HG1      PRO  84  16.875  -5.807  11.584
  626    HD2  PRO  84           HD2      PRO  84  16.072  -6.797   9.246
  627    HD3  PRO  84           HD1      PRO  84  15.012  -6.883  10.665
  628    H    GLU  85           HN       GLU  85  15.984  -4.266   7.810
  629    HA   GLU  85           HA       GLU  85  15.966  -1.515   7.038
  630    HB2  GLU  85           HB2      GLU  85  17.707  -1.546   8.820
  631    HB3  GLU  85           HB1      GLU  85  18.597  -2.744   7.897
  632    HG2  GLU  85           HG2      GLU  85  17.921  -0.152   6.608
  633    HG3  GLU  85           HG1      GLU  85  19.218  -0.205   7.800
  634    H    LEU  86           HN       LEU  86  15.521  -1.696   5.102
  635    HA   LEU  86           HA       LEU  86  17.156  -3.370   3.351
  636    HB2  LEU  86           HB2      LEU  86  15.003  -4.404   3.483
  637    HB3  LEU  86           HB1      LEU  86  14.186  -2.870   3.318
  638    HG   LEU  86           HG       LEU  86  14.949  -2.697   1.019
  639   HD11  LEU  86          HD11      LEU  86  17.033  -3.949   1.201
  640   HD12  LEU  86          HD12      LEU  86  16.021  -4.604  -0.086
  641   HD13  LEU  86          HD13      LEU  86  16.124  -5.438   1.465
  642   HD21  LEU  86          HD21      LEU  86  13.573  -5.291   1.684
  643   HD22  LEU  86          HD22      LEU  86  13.567  -4.518   0.098
  644   HD23  LEU  86          HD23      LEU  86  12.800  -3.719   1.472
  645    H    VAL  87           HN       VAL  87  18.491  -1.712   2.706
  646    HA   VAL  87           HA       VAL  87  17.311   0.742   1.688
  647    HB   VAL  87           HB       VAL  87  19.410   0.782   3.014
  648   HG11  VAL  87          HG11      VAL  87  21.529   0.158   1.951
  649   HG12  VAL  87          HG12      VAL  87  20.629  -0.539   0.603
  650   HG13  VAL  87          HG13      VAL  87  20.473  -1.231   2.217
  651   HG21  VAL  87          HG21      VAL  87  19.628   1.839   0.206
  652   HG22  VAL  87          HG22      VAL  87  20.609   2.365   1.576
  653   HG23  VAL  87          HG23      VAL  87  18.866   2.641   1.580
  654    H    PHE  88           HN       PHE  88  16.986   1.198  -0.418
  655    HA   PHE  88           HA       PHE  88  18.149  -0.437  -2.538
  656    HB2  PHE  88           HB2      PHE  88  16.027  -1.148  -3.451
  657    HB3  PHE  88           HB1      PHE  88  16.168  -1.718  -1.793
  658    HD1  PHE  88           HD2      PHE  88  14.910  -0.537   0.014
  659    HD2  PHE  88           HD1      PHE  88  14.270   0.288  -4.112
  660    HE1  PHE  88           HE2      PHE  88  12.754   0.503   0.563
  661    HE2  PHE  88           HE1      PHE  88  12.110   1.330  -3.574
  662    HZ   PHE  88           HZ       PHE  88  11.344   1.432  -1.246
  663    H    THR  89           HN       THR  89  17.737   0.413  -4.650
  664    HA   THR  89           HA       THR  89  17.539   3.267  -4.691
  665    HB   THR  89           HB       THR  89  17.535   1.409  -7.076
  666    HG1  THR  89           HG1      THR  89  19.597   1.058  -6.721
  667   HG21  THR  89          HG21      THR  89  18.614   3.317  -8.196
  668   HG22  THR  89          HG22      THR  89  18.457   4.268  -6.717
  669   HG23  THR  89          HG23      THR  89  17.014   3.740  -7.586
  670    H    LEU  90           HN       LEU  90  15.628   4.204  -4.438
  671    HA   LEU  90           HA       LEU  90  13.107   3.111  -4.922
  672    HB2  LEU  90           HB2      LEU  90  13.780   5.249  -3.647
  673    HB3  LEU  90           HB1      LEU  90  13.714   6.037  -5.190
  674    HG   LEU  90           HG       LEU  90  11.368   5.516  -5.431
  675   HD11  LEU  90          HD11      LEU  90  10.134   4.365  -3.695
  676   HD12  LEU  90          HD12      LEU  90  11.611   4.150  -2.755
  677   HD13  LEU  90          HD13      LEU  90  11.428   3.337  -4.310
  678   HD21  LEU  90          HD21      LEU  90  11.942   6.621  -2.679
  679   HD22  LEU  90          HD22      LEU  90  10.480   6.880  -3.631
  680   HD23  LEU  90          HD23      LEU  90  12.016   7.542  -4.181
  681    H    GLY  91           HN       GLY  91  12.027   2.680  -6.764
  682    HA2  GLY  91           HA2      GLY  91  11.116   3.199  -8.849
  683    HA3  GLY  91           HA1      GLY  91  12.277   4.507  -9.014
  684    H    ASP  92           HN       ASP  92  13.814   1.696  -8.036
  685    HA   ASP  92           HA       ASP  92  14.614   1.180 -10.814
  686    HB2  ASP  92           HB2      ASP  92  16.343   2.049  -9.078
  687    HB3  ASP  92           HB1      ASP  92  16.271   0.408  -8.433
  688    H    CYS  93           HN       CYS  93  12.578   0.091  -8.683
  689    HA   CYS  93           HA       CYS  93  11.527  -1.883  -8.265
  690    HB2  CYS  93           HB2      CYS  93  12.835  -2.752 -10.848
  691    HB3  CYS  93           HB1      CYS  93  11.415  -3.474 -10.094
  692    HG   CYS  93           HG       CYS  93   9.663  -1.940 -11.172
  693    H    ASP  94           HN       ASP  94  14.138  -1.492  -7.131
  694    HA   ASP  94           HA       ASP  94  15.644  -3.902  -7.395
  695    HB2  ASP  94           HB2      ASP  94  16.610  -1.654  -6.805
  696    HB3  ASP  94           HB1      ASP  94  15.834  -1.793  -5.232
  697    H    VAL  95           HN       VAL  95  12.802  -3.229  -6.067
  698    HA   VAL  95           HA       VAL  95  12.935  -5.312  -3.996
  699    HB   VAL  95           HB       VAL  95  11.323  -3.869  -2.659
  700   HG11  VAL  95          HG11      VAL  95  13.094  -2.540  -1.665
  701   HG12  VAL  95          HG12      VAL  95  14.096  -2.782  -3.095
  702   HG13  VAL  95          HG13      VAL  95  13.690  -4.153  -2.061
  703   HG21  VAL  95          HG21      VAL  95  12.341  -1.769  -4.573
  704   HG22  VAL  95          HG22      VAL  95  11.415  -1.447  -3.104
  705   HG23  VAL  95          HG23      VAL  95  10.680  -2.340  -4.436
  706    H    ILE  96           HN       ILE  96  10.209  -4.869  -3.204
  707    HA   ILE  96           HA       ILE  96   8.827  -6.034  -5.455
  708    HB   ILE  96           HB       ILE  96   6.899  -6.193  -3.899
  709   HG12  ILE  96          HG12      ILE  96   8.816  -5.055  -1.847
  710   HG13  ILE  96          HG11      ILE  96   7.439  -4.195  -2.531
  711   HG21  ILE  96          HG21      ILE  96   8.456  -8.037  -4.055
  712   HG22  ILE  96          HG22      ILE  96   7.897  -7.866  -2.389
  713   HG23  ILE  96          HG23      ILE  96   9.503  -7.293  -2.847
  714   HD11  ILE  96          HD11      ILE  96   6.921  -5.055  -0.334
  715   HD12  ILE  96          HD12      ILE  96   7.329  -6.691  -0.851
  716   HD13  ILE  96          HD13      ILE  96   5.936  -5.863  -1.551
  717    H    GLN  97           HN       GLN  97   7.312  -4.955  -6.633
  718    HA   GLN  97           HA       GLN  97   7.807  -2.235  -6.979
  719    HB2  GLN  97           HB2      GLN  97   6.787  -3.988  -8.617
  720    HB3  GLN  97           HB1      GLN  97   5.251  -3.433  -7.959
  721    HG2  GLN  97           HG2      GLN  97   5.617  -2.147  -9.887
  722    HG3  GLN  97           HG1      GLN  97   5.991  -1.091  -8.528
  723   HE21  GLN  97          HE21      GLN  97   8.205  -0.581  -8.093
  724   HE22  GLN  97          HE22      GLN  97   9.396  -0.743  -9.330
  725    H    ALA  98           HN       ALA  98   5.331  -3.874  -5.130
  726    HA   ALA  98           HA       ALA  98   3.596  -1.776  -4.552
  727    HB1  ALA  98           HB1      ALA  98   4.527  -3.994  -2.731
  728    HB2  ALA  98           HB2      ALA  98   3.170  -4.071  -3.855
  729    HB3  ALA  98           HB3      ALA  98   3.106  -2.984  -2.468
  730    H    LEU  99           HN       LEU  99   6.675  -2.645  -3.106
  731    HA   LEU  99           HA       LEU  99   6.573  -0.638  -1.070
  732    HB2  LEU  99           HB2      LEU  99   7.894  -2.659  -0.739
  733    HB3  LEU  99           HB1      LEU  99   8.891  -2.232  -2.123
  734    HG   LEU  99           HG       LEU  99   9.705  -0.247  -0.949
  735   HD11  LEU  99          HD11      LEU  99   9.200   0.111   1.400
  736   HD12  LEU  99          HD12      LEU  99   8.070  -1.244   1.378
  737   HD13  LEU  99          HD13      LEU  99   7.739   0.198   0.415
  738   HD21  LEU  99          HD21      LEU  99  10.943  -2.326  -0.751
  739   HD22  LEU  99          HD22      LEU  99   9.988  -2.774   0.663
  740   HD23  LEU  99          HD23      LEU  99  11.058  -1.371   0.725
  741    H    ASP 100           HN       ASP 100   8.015  -0.973  -4.220
  742    HA   ASP 100           HA       ASP 100   9.776   1.218  -4.130
  743    HB2  ASP 100           HB2      ASP 100   9.969  -0.634  -5.725
  744    HB3  ASP 100           HB1      ASP 100   8.468  -0.157  -6.489
  745    H    LEU 101           HN       LEU 101   6.407   0.900  -4.825
  746    HA   LEU 101           HA       LEU 101   6.144   3.646  -5.688
  747    HB2  LEU 101           HB2      LEU 101   4.034   1.565  -5.149
  748    HB3  LEU 101           HB1      LEU 101   3.809   3.083  -5.980
  749    HG   LEU 101           HG       LEU 101   5.472   0.769  -6.964
  750   HD11  LEU 101          HD11      LEU 101   3.753   0.591  -8.706
  751   HD12  LEU 101          HD12      LEU 101   2.815   1.850  -7.901
  752   HD13  LEU 101          HD13      LEU 101   3.099   0.306  -7.096
  753   HD21  LEU 101          HD21      LEU 101   6.422   2.885  -7.672
  754   HD22  LEU 101          HD22      LEU 101   4.848   3.415  -8.270
  755   HD23  LEU 101          HD23      LEU 101   5.675   2.058  -9.039
  756    H    SER 102           HN       SER 102   5.499   1.688  -2.840
  757    HA   SER 102           HA       SER 102   3.759   3.447  -1.520
  758    HB2  SER 102           HB2      SER 102   3.955   1.108  -0.861
  759    HB3  SER 102           HB1      SER 102   5.636   1.352  -0.388
  760    HG   SER 102           HG       SER 102   5.010   2.343   1.392
  761    H    VAL 103           HN       VAL 103   7.247   3.188  -1.607
  762    HA   VAL 103           HA       VAL 103   7.871   4.735   0.624
  763    HB   VAL 103           HB       VAL 103   9.398   4.232  -1.889
  764   HG11  VAL 103          HG11      VAL 103  10.481   5.392   0.687
  765   HG12  VAL 103          HG12      VAL 103  10.119   6.344  -0.752
  766   HG13  VAL 103          HG13      VAL 103  11.366   5.101  -0.813
  767   HG21  VAL 103          HG21      VAL 103   9.280   2.987   0.832
  768   HG22  VAL 103          HG22      VAL 103  10.717   2.831  -0.172
  769   HG23  VAL 103          HG23      VAL 103   9.168   2.220  -0.755
  770    HA   PRO 104           HA       PRO 104   8.315   8.618  -2.283
  771    HB2  PRO 104           HB2      PRO 104   6.863   8.434  -4.628
  772    HB3  PRO 104           HB1      PRO 104   8.608   8.183  -4.498
  773    HG2  PRO 104           HG2      PRO 104   6.407   6.166  -4.579
  774    HG3  PRO 104           HG1      PRO 104   7.998   6.122  -5.348
  775    HD2  PRO 104           HD2      PRO 104   7.502   4.718  -3.139
  776    HD3  PRO 104           HD1      PRO 104   9.072   5.488  -3.416
  777    H    LEU 105           HN       LEU 105   5.438   6.615  -2.196
  778    HA   LEU 105           HA       LEU 105   3.625   8.844  -1.940
  779    HB2  LEU 105           HB2      LEU 105   3.430   5.874  -1.647
  780    HB3  LEU 105           HB1      LEU 105   2.102   6.898  -1.107
  781    HG   LEU 105           HG       LEU 105   3.127   6.472  -3.896
  782   HD11  LEU 105          HD11      LEU 105   0.794   5.973  -4.351
  783   HD12  LEU 105          HD12      LEU 105   0.381   6.331  -2.674
  784   HD13  LEU 105          HD13      LEU 105   1.416   4.952  -3.055
  785   HD21  LEU 105          HD21      LEU 105   1.653   8.259  -4.661
  786   HD22  LEU 105          HD22      LEU 105   2.924   8.885  -3.612
  787   HD23  LEU 105          HD23      LEU 105   1.288   8.678  -2.988
  788    H    MET 106           HN       MET 106   5.781   7.306   0.144
  789    HA   MET 106           HA       MET 106   4.310   8.185   2.522
  790    HB2  MET 106           HB2      MET 106   4.969   6.276   3.472
  791    HB3  MET 106           HB1      MET 106   5.565   5.781   1.898
  792    HG2  MET 106           HG2      MET 106   7.732   6.976   2.564
  793    HG3  MET 106           HG1      MET 106   7.061   6.955   4.200
  794    HE1  MET 106           HE1      MET 106   6.417   4.712   5.492
  795    HE2  MET 106           HE2      MET 106   6.616   3.100   4.812
  796    HE3  MET 106           HE3      MET 106   5.424   4.205   4.126
  797    H    ASP 107           HN       ASP 107   5.475   9.308   4.213
  798    HA   ASP 107           HA       ASP 107   7.572  11.046   3.108
  799    HB2  ASP 107           HB2      ASP 107   5.644  11.293   5.390
  800    HB3  ASP 107           HB1      ASP 107   7.121  12.250   5.399
  801    H    VAL 108           HN       VAL 108   9.452  11.584   4.462
  802    HA   VAL 108           HA       VAL 108  10.690   9.222   5.390
  803    HB   VAL 108           HB       VAL 108  11.817  11.375   4.457
  804   HG11  VAL 108          HG11      VAL 108  12.483  13.037   5.884
  805   HG12  VAL 108          HG12      VAL 108  12.307  12.024   7.313
  806   HG13  VAL 108          HG13      VAL 108  10.874  12.678   6.525
  807   HG21  VAL 108          HG21      VAL 108  12.988   9.793   6.732
  808   HG22  VAL 108          HG22      VAL 108  13.912  10.785   5.604
  809   HG23  VAL 108          HG23      VAL 108  13.034   9.372   5.018
  810    H    GLY 109           HN       GLY 109  10.693   8.304   7.256
  811    HA2  GLY 109           HA2      GLY 109  10.924   8.273   9.615
  812    HA3  GLY 109           HA1      GLY 109  10.209   9.878   9.675
  813    H    GLU 110           HN       GLU 110   8.434   8.016   7.553
  814    HA   GLU 110           HA       GLU 110   6.427   7.654   9.636
  815    HB2  GLU 110           HB2      GLU 110   4.763   7.791   8.059
  816    HB3  GLU 110           HB1      GLU 110   5.961   8.914   7.429
  817    HG2  GLU 110           HG2      GLU 110   6.584   7.420   5.720
  818    HG3  GLU 110           HG1      GLU 110   5.739   6.073   6.487
  819    H    THR 111           HN       THR 111   4.990   5.803   9.451
  820    HA   THR 111           HA       THR 111   6.263   3.424   8.367
  821    HB   THR 111           HB       THR 111   4.886   3.522  11.061
  822    HG1  THR 111           HG1      THR 111   6.981   4.459  11.155
  823   HG21  THR 111          HG21      THR 111   5.700   1.212  11.273
  824   HG22  THR 111          HG22      THR 111   6.338   1.296   9.631
  825   HG23  THR 111          HG23      THR 111   4.599   1.393   9.908
  826    H    ALA 112           HN       ALA 112   4.968   2.550   6.942
  827    HA   ALA 112           HA       ALA 112   2.086   3.063   7.209
  828    HB1  ALA 112           HB1      ALA 112   3.669   2.849   4.657
  829    HB2  ALA 112           HB2      ALA 112   3.104   4.352   5.387
  830    HB3  ALA 112           HB3      ALA 112   1.939   3.166   4.796
  831    H    MET 113           HN       MET 113   0.738   1.426   6.901
  832    HA   MET 113           HA       MET 113   1.910  -1.233   6.499
  833    HB2  MET 113           HB2      MET 113   0.561  -1.222   8.456
  834    HB3  MET 113           HB1      MET 113  -0.686  -0.246   7.690
  835    HG2  MET 113           HG2      MET 113  -1.256  -2.120   6.239
  836    HG3  MET 113           HG1      MET 113  -0.026  -3.103   7.025
  837    HE1  MET 113           HE1      MET 113  -0.105  -2.905   9.935
  838    HE2  MET 113           HE2      MET 113  -0.351  -4.433   9.086
  839    HE3  MET 113           HE3      MET 113  -1.422  -3.979  10.413
  840    H    VAL 114           HN       VAL 114   1.800  -1.986   4.493
  841    HA   VAL 114           HA       VAL 114  -0.252  -0.828   2.711
  842    HB   VAL 114           HB       VAL 114   2.346  -1.986   1.800
  843   HG11  VAL 114          HG11      VAL 114   1.995  -0.588  -0.172
  844   HG12  VAL 114          HG12      VAL 114   0.476  -0.012   0.521
  845   HG13  VAL 114          HG13      VAL 114   0.663  -1.715   0.092
  846   HG21  VAL 114          HG21      VAL 114   3.293   0.260   1.746
  847   HG22  VAL 114          HG22      VAL 114   2.902  -0.262   3.385
  848   HG23  VAL 114          HG23      VAL 114   1.844   0.871   2.544
  849    H    THR 115           HN       THR 115  -1.624  -2.240   1.859
  850    HA   THR 115           HA       THR 115  -0.787  -5.042   1.881
  851    HB   THR 115           HB       THR 115  -3.632  -4.022   1.768
  852    HG1  THR 115           HG1      THR 115  -1.929  -4.876   3.847
  853   HG21  THR 115          HG21      THR 115  -2.558  -6.789   2.255
  854   HG22  THR 115          HG22      THR 115  -3.130  -6.218   0.683
  855   HG23  THR 115          HG23      THR 115  -4.246  -6.316   2.047
  856    H    ALA 116           HN       ALA 116  -0.124  -5.709   0.111
  857    HA   ALA 116           HA       ALA 116  -1.215  -4.676  -2.437
  858    HB1  ALA 116           HB1      ALA 116   0.986  -4.942  -3.397
  859    HB2  ALA 116           HB2      ALA 116   1.606  -5.546  -1.861
  860    HB3  ALA 116           HB3      ALA 116   1.067  -3.873  -1.996
  861    H    ASP 117           HN       ASP 117  -1.832  -6.176  -3.889
  862    HA   ASP 117           HA       ASP 117  -2.114  -8.871  -3.357
  863    HB2  ASP 117           HB2      ASP 117  -3.006  -7.544  -5.380
  864    HB3  ASP 117           HB1      ASP 117  -1.433  -7.823  -6.082
  865    H    SER 118           HN       SER 118  -0.857 -10.687  -3.792
  866    HA   SER 118           HA       SER 118   1.851 -10.514  -3.217
  867    HB2  SER 118           HB2      SER 118   0.229 -12.557  -3.158
  868    HB3  SER 118           HB1      SER 118   0.746 -12.797  -4.829
  869    HG   SER 118           HG       SER 118   1.972 -13.905  -3.084
  870    H    LYS 119           HN       LYS 119   0.178 -10.313  -6.257
  871    HA   LYS 119           HA       LYS 119   2.247 -10.728  -8.060
  872    HB2  LYS 119           HB2      LYS 119   0.984  -9.149  -9.534
  873    HB3  LYS 119           HB1      LYS 119   0.014 -10.454  -8.853
  874    HG2  LYS 119           HG2      LYS 119  -0.922  -8.939  -7.237
  875    HG3  LYS 119           HG1      LYS 119   0.171  -7.653  -7.767
  876    HD2  LYS 119           HD2      LYS 119  -1.992  -7.288  -8.723
  877    HD3  LYS 119           HD1      LYS 119  -0.873  -7.749 -10.006
  878    HE2  LYS 119           HE2      LYS 119  -1.735 -10.120  -9.672
  879    HE3  LYS 119           HE1      LYS 119  -3.025  -9.393  -8.713
  880    HZ1  LYS 119           HZ1      LYS 119  -3.866  -9.585 -10.889
  881    HZ2  LYS 119           HZ2      LYS 119  -2.445  -8.985 -11.591
  882    HZ3  LYS 119           HZ3      LYS 119  -3.460  -7.945 -10.721
  883    H    TYR 120           HN       TYR 120   1.595  -7.896  -6.016
  884    HA   TYR 120           HA       TYR 120   3.868  -6.497  -7.238
  885    HB2  TYR 120           HB2      TYR 120   1.960  -5.594  -5.066
  886    HB3  TYR 120           HB1      TYR 120   3.211  -4.598  -5.807
  887    HD1  TYR 120           HD1      TYR 120   3.015  -3.952  -8.169
  888    HD2  TYR 120           HD2      TYR 120  -0.106  -5.982  -6.128
  889    HE1  TYR 120           HE1      TYR 120   1.435  -3.197  -9.889
  890    HE2  TYR 120           HE2      TYR 120  -1.716  -5.243  -7.844
  891    HH   TYR 120           HH       TYR 120  -1.875  -3.300  -9.486
  892    H    CYS 121           HN       CYS 121   3.618  -8.890  -5.252
  893    HA   CYS 121           HA       CYS 121   5.690  -7.970  -3.384
  894    HB2  CYS 121           HB2      CYS 121   3.430  -9.888  -2.809
  895    HB3  CYS 121           HB1      CYS 121   4.687  -9.415  -1.675
  896    HG   CYS 121           HG       CYS 121   1.865  -7.843  -2.499
  897    H    TYR 122           HN       TYR 122   4.403 -11.274  -3.504
  898    HA   TYR 122           HA       TYR 122   6.650 -12.121  -5.176
  899    HB2  TYR 122           HB2      TYR 122   6.118 -13.600  -2.597
  900    HB3  TYR 122           HB1      TYR 122   7.507 -13.703  -3.662
  901    HD1  TYR 122           HD2      TYR 122   9.270 -12.008  -3.611
  902    HD2  TYR 122           HD1      TYR 122   5.952 -11.829  -0.950
  903    HE1  TYR 122           HE2      TYR 122  10.472 -10.391  -2.231
  904    HE2  TYR 122           HE1      TYR 122   7.147 -10.186   0.430
  905    HH   TYR 122           HH       TYR 122   9.517  -9.523   0.867
  906    H    GLY 123           HN       GLY 123   3.800 -12.038  -5.759
  907    HA2  GLY 123           HA2      GLY 123   2.361 -14.334  -5.418
  908    HA3  GLY 123           HA1      GLY 123   2.325 -13.383  -6.893
  909    HA   PRO 124           HA       PRO 124   4.236 -16.864  -8.855
  910    HB2  PRO 124           HB2      PRO 124   5.262 -15.762 -11.065
  911    HB3  PRO 124           HB1      PRO 124   3.515 -15.808 -10.796
  912    HG2  PRO 124           HG2      PRO 124   5.421 -13.534 -10.487
  913    HG3  PRO 124           HG1      PRO 124   3.754 -13.530 -11.086
  914    HD2  PRO 124           HD2      PRO 124   4.555 -12.836  -8.503
  915    HD3  PRO 124           HD1      PRO 124   2.905 -13.253  -8.993
  916    H    GLN 125           HN       GLN 125   5.883 -14.809  -7.071
  917    HA   GLN 125           HA       GLN 125   8.560 -15.336  -8.204
  918    HB2  GLN 125           HB2      GLN 125   7.985 -13.394  -5.988
  919    HB3  GLN 125           HB1      GLN 125   9.324 -13.395  -7.125
  920    HG2  GLN 125           HG2      GLN 125   7.968 -12.551  -8.864
  921    HG3  GLN 125           HG1      GLN 125   6.486 -12.879  -7.961
  922   HE21  GLN 125          HE21      GLN 125   5.715 -10.803  -7.928
  923   HE22  GLN 125          HE22      GLN 125   6.469  -9.535  -7.034
  924    H    GLY 126           HN       GLY 126   6.711 -15.265  -5.210
  925    HA2  GLY 126           HA2      GLY 126   6.950 -16.420  -3.256
  926    HA3  GLY 126           HA1      GLY 126   8.277 -17.326  -3.981
  927    H    SER 127           HN       SER 127   7.912 -15.944  -1.377
  928    HA   SER 127           HA       SER 127   9.830 -13.833  -1.502
  929    HB2  SER 127           HB2      SER 127   8.002 -13.305  -0.108
  930    HB3  SER 127           HB1      SER 127   8.028 -14.880   0.655
  931    HG   SER 127           HG       SER 127   9.258 -12.618   1.407
  932    H    ARG 128           HN       ARG 128  11.624 -13.716   0.089
  933    HA   ARG 128           HA       ARG 128  13.426 -15.728  -0.606
  934    HB2  ARG 128           HB2      ARG 128  15.053 -14.545   0.692
  935    HB3  ARG 128           HB1      ARG 128  14.006 -13.354  -0.067
  936    HG2  ARG 128           HG2      ARG 128  12.857 -12.961   1.994
  937    HG3  ARG 128           HG1      ARG 128  13.710 -14.289   2.780
  938    HD2  ARG 128           HD2      ARG 128  14.872 -12.427   3.523
  939    HD3  ARG 128           HD1      ARG 128  15.845 -12.976   2.161
  940    HE   ARG 128           HE       ARG 128  14.400 -11.181   0.920
  941   HH11  ARG 128          HH11      ARG 128  15.840 -11.011   4.086
  942   HH12  ARG 128          HH12      ARG 128  15.928  -9.269   4.115
  943   HH21  ARG 128          HH21      ARG 128  14.500  -8.861   0.941
  944   HH22  ARG 128          HH22      ARG 128  15.135  -8.047   2.346
  945    H    SER 129           HN       SER 129  11.615 -15.231   2.388
  946    HA   SER 129           HA       SER 129  12.868 -17.582   3.541
  947    HB2  SER 129           HB2      SER 129  10.715 -15.870   4.799
  948    HB3  SER 129           HB1      SER 129  11.804 -16.999   5.609
  949    HG   SER 129           HG       SER 129  13.463 -15.610   5.373
  950    HA   PRO 130           HA       PRO 130   8.670 -19.363   2.472
  951    HB2  PRO 130           HB2      PRO 130   6.432 -17.754   2.672
  952    HB3  PRO 130           HB1      PRO 130   7.138 -18.628   4.023
  953    HG2  PRO 130           HG2      PRO 130   6.988 -15.818   3.710
  954    HG3  PRO 130           HG1      PRO 130   7.887 -16.699   4.955
  955    HD2  PRO 130           HD2      PRO 130   8.845 -15.599   2.342
  956    HD3  PRO 130           HD1      PRO 130   9.671 -15.648   3.909
  957    H    TYR 131           HN       TYR 131   8.577 -19.754   0.257
  958    HA   TYR 131           HA       TYR 131   8.000 -17.923  -1.736
  959    HB2  TYR 131           HB2      TYR 131   8.639 -20.152  -2.368
  960    HB3  TYR 131           HB1      TYR 131   7.259 -20.848  -1.519
  961    HD1  TYR 131           HD2      TYR 131   8.302 -18.939  -4.503
  962    HD2  TYR 131           HD1      TYR 131   5.090 -20.937  -2.549
  963    HE1  TYR 131           HE2      TYR 131   7.007 -18.885  -6.591
  964    HE2  TYR 131           HE1      TYR 131   3.789 -20.887  -4.634
  965    HH   TYR 131           HH       TYR 131   3.645 -19.791  -6.694
  966    H    ILE 132           HN       ILE 132   6.515 -16.428  -1.257
  967    HA   ILE 132           HA       ILE 132   4.089 -16.911   0.078
  968    HB   ILE 132           HB       ILE 132   4.739 -14.617  -1.775
  969   HG12  ILE 132          HG12      ILE 132   6.454 -14.571  -0.150
  970   HG13  ILE 132          HG11      ILE 132   5.272 -13.369   0.346
  971   HG21  ILE 132          HG21      ILE 132   2.383 -14.812  -1.243
  972   HG22  ILE 132          HG22      ILE 132   3.075 -13.403  -0.437
  973   HG23  ILE 132          HG23      ILE 132   2.762 -14.882   0.479
  974   HD11  ILE 132          HD11      ILE 132   6.178 -14.653   2.201
  975   HD12  ILE 132          HD12      ILE 132   5.504 -16.128   1.503
  976   HD13  ILE 132          HD13      ILE 132   4.428 -14.838   2.045
  977    HA   PRO 133           HA       PRO 133   1.777 -18.875  -3.199
  978    HB2  PRO 133           HB2      PRO 133  -0.493 -17.609  -1.747
  979    HB3  PRO 133           HB1      PRO 133  -0.276 -19.289  -2.251
  980    HG2  PRO 133           HG2      PRO 133   0.025 -18.581   0.298
  981    HG3  PRO 133           HG1      PRO 133   1.085 -19.792  -0.444
  982    HD2  PRO 133           HD2      PRO 133   1.640 -16.938   0.223
  983    HD3  PRO 133           HD1      PRO 133   2.721 -18.346   0.291
  984    HA   PRO 134           HA       PRO 134   1.199 -15.512  -6.060
  985    HB2  PRO 134           HB2      PRO 134  -0.697 -17.376  -7.369
  986    HB3  PRO 134           HB1      PRO 134   0.703 -16.522  -8.043
  987    HG2  PRO 134           HG2      PRO 134   0.794 -19.148  -7.530
  988    HG3  PRO 134           HG1      PRO 134   2.205 -18.109  -7.248
  989    HD2  PRO 134           HD2      PRO 134   0.260 -19.245  -5.281
  990    HD3  PRO 134           HD1      PRO 134   2.015 -19.016  -5.128
  991    H    HIS 135           HN       HIS 135  -0.104 -13.870  -6.054
  992    HA   HIS 135           HA       HIS 135  -1.914 -12.535  -5.857
  993    HB2  HIS 135           HB2      HIS 135  -3.353 -15.152  -6.173
  994    HB3  HIS 135           HB1      HIS 135  -4.239 -13.693  -5.755
  995    HD1  HIS 135           HD1      HIS 135  -3.519 -15.627  -8.558
  996    HD2  HIS 135           HD2      HIS 135  -3.457 -11.540  -7.805
  997    HE1  HIS 135           HE1      HIS 135  -3.718 -14.524 -10.806
  998    HE2  HIS 135           HE2      HIS 135  -3.937 -12.070 -10.292
  999    H    ALA 136           HN       ALA 136  -0.802 -14.433  -3.474
 1000    HA   ALA 136           HA       ALA 136  -2.839 -14.134  -1.499
 1001    HB1  ALA 136           HB1      ALA 136  -1.058 -15.773  -1.223
 1002    HB2  ALA 136           HB2      ALA 136  -1.076 -14.638   0.127
 1003    HB3  ALA 136           HB3      ALA 136   0.137 -14.480  -1.145
 1004    H    ALA 137           HN       ALA 137  -3.422 -12.332  -0.416
 1005    HA   ALA 137           HA       ALA 137  -2.229  -9.875  -1.313
 1006    HB1  ALA 137           HB1      ALA 137  -3.972  -8.766  -0.014
 1007    HB2  ALA 137           HB2      ALA 137  -4.397 -10.291   0.759
 1008    HB3  ALA 137           HB3      ALA 137  -4.659 -10.076  -0.970
 1009    H    LEU 138           HN       LEU 138  -0.418  -9.133  -0.481
 1010    HA   LEU 138           HA       LEU 138   0.431 -10.026   2.128
 1011    HB2  LEU 138           HB2      LEU 138   1.700  -9.392  -0.308
 1012    HB3  LEU 138           HB1      LEU 138   2.293  -8.260   0.897
 1013    HG   LEU 138           HG       LEU 138   3.041 -10.056   2.305
 1014   HD11  LEU 138          HD11      LEU 138   1.238 -11.614   1.901
 1015   HD12  LEU 138          HD12      LEU 138   2.806 -12.386   1.658
 1016   HD13  LEU 138          HD13      LEU 138   1.836 -11.902   0.266
 1017   HD21  LEU 138          HD21      LEU 138   4.708 -11.105   0.873
 1018   HD22  LEU 138          HD22      LEU 138   4.556  -9.377   0.548
 1019   HD23  LEU 138          HD23      LEU 138   3.828 -10.547  -0.552
 1020    H    CYS 139           HN       CYS 139   0.464  -8.785   3.900
 1021    HA   CYS 139           HA       CYS 139   0.004  -5.903   3.545
 1022    HB2  CYS 139           HB2      CYS 139  -1.944  -6.822   4.543
 1023    HB3  CYS 139           HB1      CYS 139  -1.012  -7.785   5.673
 1024    HG   CYS 139           HG       CYS 139  -2.180  -4.711   5.977
 1025    H    LEU 140           HN       LEU 140   1.881  -5.000   3.742
 1026    HA   LEU 140           HA       LEU 140   3.781  -6.027   5.737
 1027    HB2  LEU 140           HB2      LEU 140   5.506  -5.057   4.214
 1028    HB3  LEU 140           HB1      LEU 140   4.653  -6.458   3.593
 1029    HG   LEU 140           HG       LEU 140   3.198  -4.263   2.668
 1030   HD11  LEU 140          HD11      LEU 140   5.055  -2.814   3.321
 1031   HD12  LEU 140          HD12      LEU 140   4.875  -2.882   1.565
 1032   HD13  LEU 140          HD13      LEU 140   6.159  -3.797   2.358
 1033   HD21  LEU 140          HD21      LEU 140   4.029  -4.960   0.483
 1034   HD22  LEU 140          HD22      LEU 140   3.614  -6.357   1.475
 1035   HD23  LEU 140          HD23      LEU 140   5.303  -5.901   1.259
 1036    H    GLU 141           HN       GLU 141   4.724  -4.665   7.131
 1037    HA   GLU 141           HA       GLU 141   3.805  -1.877   7.078
 1038    HB2  GLU 141           HB2      GLU 141   3.240  -3.088   9.085
 1039    HB3  GLU 141           HB1      GLU 141   4.894  -3.642   9.271
 1040    HG2  GLU 141           HG2      GLU 141   5.614  -1.360   9.738
 1041    HG3  GLU 141           HG1      GLU 141   3.946  -0.802   9.540
 1042    H    VAL 142           HN       VAL 142   5.215  -0.425   6.329
 1043    HA   VAL 142           HA       VAL 142   8.067  -1.117   6.436
 1044    HB   VAL 142           HB       VAL 142   8.291   0.401   4.405
 1045   HG11  VAL 142          HG11      VAL 142   8.519  -2.008   4.278
 1046   HG12  VAL 142          HG12      VAL 142   7.636  -1.414   2.871
 1047   HG13  VAL 142          HG13      VAL 142   6.768  -2.195   4.194
 1048   HG21  VAL 142          HG21      VAL 142   5.309  -0.041   4.369
 1049   HG22  VAL 142          HG22      VAL 142   6.251   0.529   2.991
 1050   HG23  VAL 142          HG23      VAL 142   6.154   1.502   4.459
 1051    H    THR 143           HN       THR 143   9.226   0.079   7.707
 1052    HA   THR 143           HA       THR 143   8.471   2.835   8.303
 1053    HB   THR 143           HB       THR 143  10.886   1.386   9.410
 1054    HG1  THR 143           HG1      THR 143   8.247   1.455  10.537
 1055   HG21  THR 143          HG21      THR 143   9.129   3.624  10.457
 1056   HG22  THR 143          HG22      THR 143  10.738   3.810   9.755
 1057   HG23  THR 143          HG23      THR 143  10.536   2.945  11.281
 1058    H    LEU 144           HN       LEU 144   9.158   4.335   6.937
 1059    HA   LEU 144           HA       LEU 144  11.694   4.082   5.533
 1060    HB2  LEU 144           HB2      LEU 144   9.726   5.109   4.438
 1061    HB3  LEU 144           HB1      LEU 144   9.722   6.374   5.656
 1062    HG   LEU 144           HG       LEU 144  11.929   7.140   4.857
 1063   HD11  LEU 144          HD11      LEU 144  12.844   6.233   2.773
 1064   HD12  LEU 144          HD12      LEU 144  11.582   5.001   2.758
 1065   HD13  LEU 144          HD13      LEU 144  12.789   5.012   4.044
 1066   HD21  LEU 144          HD21      LEU 144  11.179   8.059   2.731
 1067   HD22  LEU 144          HD22      LEU 144   9.890   8.115   3.932
 1068   HD23  LEU 144          HD23      LEU 144   9.868   6.882   2.674
 1069    H    LYS 145           HN       LYS 145  13.417   4.320   6.757
 1070    HA   LYS 145           HA       LYS 145  13.240   6.156   9.043
 1071    HB2  LYS 145           HB2      LYS 145  15.237   3.932   8.643
 1072    HB3  LYS 145           HB1      LYS 145  14.852   4.782  10.136
 1073    HG2  LYS 145           HG2      LYS 145  12.728   3.792  10.270
 1074    HG3  LYS 145           HG1      LYS 145  12.849   3.165   8.627
 1075    HD2  LYS 145           HD2      LYS 145  14.547   2.299  10.962
 1076    HD3  LYS 145           HD1      LYS 145  13.157   1.415  10.319
 1077    HE2  LYS 145           HE2      LYS 145  15.831   1.902   9.045
 1078    HE3  LYS 145           HE1      LYS 145  14.983   0.382   9.349
 1079    HZ1  LYS 145           HZ1      LYS 145  14.871   0.878   7.047
 1080    HZ2  LYS 145           HZ2      LYS 145  14.273   2.432   7.343
 1081    HZ3  LYS 145           HZ3      LYS 145  13.324   1.084   7.700
 1082    H    THR 146           HN       THR 146  14.807   5.615   6.068
 1083    HA   THR 146           HA       THR 146  16.419   7.971   6.406
 1084    HB   THR 146           HB       THR 146  17.784   5.356   5.751
 1085    HG1  THR 146           HG1      THR 146  17.269   6.573   8.207
 1086   HG21  THR 146          HG21      THR 146  19.851   6.631   6.080
 1087   HG22  THR 146          HG22      THR 146  18.906   8.082   6.417
 1088   HG23  THR 146          HG23      THR 146  18.855   7.350   4.814
 1089    H    ALA 147           HN       ALA 147  17.093   8.846   4.444
 1090    HA   ALA 147           HA       ALA 147  16.700   7.331   1.986
 1091    HB1  ALA 147           HB1      ALA 147  14.567   8.510   2.334
 1092    HB2  ALA 147           HB2      ALA 147  15.435   9.153   0.940
 1093    HB3  ALA 147           HB3      ALA 147  15.438  10.037   2.465
 1094    H    VAL 148           HN       VAL 148  18.408   7.723   0.613
 1095    HA   VAL 148           HA       VAL 148  19.885  10.216   1.090
 1096    HB   VAL 148           HB       VAL 148  22.036   9.135   1.026
 1097   HG11  VAL 148          HG11      VAL 148  20.185   7.909   3.080
 1098   HG12  VAL 148          HG12      VAL 148  21.025   9.459   3.206
 1099   HG13  VAL 148          HG13      VAL 148  21.947   7.955   3.198
 1100   HG21  VAL 148          HG21      VAL 148  22.274   6.701   1.146
 1101   HG22  VAL 148          HG22      VAL 148  21.509   7.212  -0.358
 1102   HG23  VAL 148          HG23      VAL 148  20.529   6.524   0.937
 1103    H    ASP 149           HN       ASP 149  20.607  11.216  -0.630
 1104    HA   ASP 149           HA       ASP 149  19.820  10.251  -3.199
 1105    HB2  ASP 149           HB2      ASP 149  20.734  12.462  -3.937
 1106    HB3  ASP 149           HB1      ASP 149  19.471  12.575  -2.727
 1107    H    LEU 150           HN       LEU 150  21.077   9.087  -4.514
 1108    HA   LEU 150           HA       LEU 150  23.918   9.613  -4.677
 1109    HB2  LEU 150           HB2      LEU 150  24.679   7.528  -4.042
 1110    HB3  LEU 150           HB1      LEU 150  23.386   7.822  -2.896
 1111    HG   LEU 150           HG       LEU 150  23.168   6.076  -5.353
 1112   HD11  LEU 150          HD11      LEU 150  23.079   4.226  -3.743
 1113   HD12  LEU 150          HD12      LEU 150  23.415   5.363  -2.435
 1114   HD13  LEU 150          HD13      LEU 150  24.620   5.079  -3.693
 1115   HD21  LEU 150          HD21      LEU 150  21.227   6.577  -3.100
 1116   HD22  LEU 150          HD22      LEU 150  21.038   5.360  -4.362
 1117   HD23  LEU 150          HD23      LEU 150  21.033   7.073  -4.781
 1118    H    GLU 151           HN       GLU 151  21.282   9.549  -6.291
 1119    HA   GLU 151           HA       GLU 151  21.196   7.441  -8.089
 1120    HB2  GLU 151           HB2      GLU 151  19.606   9.519  -7.636
 1121    HB3  GLU 151           HB1      GLU 151  20.449  10.174  -9.031
 1122    HG2  GLU 151           HG2      GLU 151  18.817   7.631  -8.922
 1123    HG3  GLU 151           HG1      GLU 151  18.383   9.149  -9.709
 1124    H    HIS 152           HN       HIS 152  22.231  10.716  -9.082
 1125    HA   HIS 152           HA       HIS 152  24.313   9.400 -10.686
 1126    HB2  HIS 152           HB2      HIS 152  22.278  11.383 -11.488
 1127    HB3  HIS 152           HB1      HIS 152  23.900  11.640 -12.126
 1128    HD1  HIS 152           HD1      HIS 152  22.475  11.083 -14.431
 1129    HD2  HIS 152           HD2      HIS 152  23.277   7.933 -11.841
 1130    HE1  HIS 152           HE1      HIS 152  22.257   8.993 -15.813
 1131    HE2  HIS 152           HE2      HIS 152  22.786   7.104 -14.230
 1132    H    HIS 153           HN       HIS 153  26.020   9.720  -9.435
 1133    HA   HIS 153           HA       HIS 153  26.902  12.042  -8.209
 1134    HB2  HIS 153           HB2      HIS 153  29.261  11.093  -8.791
 1135    HB3  HIS 153           HB1      HIS 153  28.212  10.170  -7.725
 1136    HD1  HIS 153           HD1      HIS 153  30.135   9.898 -10.838
 1137    HD2  HIS 153           HD2      HIS 153  26.952   7.909  -9.042
 1138    HE1  HIS 153           HE1      HIS 153  29.950   7.690 -12.030
 1139    HE2  HIS 153           HE2      HIS 153  28.075   6.456 -10.859
 1140    H    HIS 154           HN       HIS 154  27.443  13.979  -8.936
 1141    HA   HIS 154           HA       HIS 154  27.187  14.521 -11.742
 1142    HB2  HIS 154           HB2      HIS 154  27.500  16.197  -9.287
 1143    HB3  HIS 154           HB1      HIS 154  27.801  16.926 -10.858
 1144    HD1  HIS 154           HD1      HIS 154  25.826  17.928 -11.938
 1145    HD2  HIS 154           HD2      HIS 154  24.764  14.979  -9.205
 1146    HE1  HIS 154           HE1      HIS 154  23.313  17.929 -11.884
 1147    HE2  HIS 154           HE2      HIS 154  22.689  16.233 -10.129
 1148    H    HIS 155           HN       HIS 155  29.305  12.960 -11.757
 1149    HA   HIS 155           HA       HIS 155  31.424  12.763 -12.555
 1150    HB2  HIS 155           HB2      HIS 155  30.801  15.578 -13.451
 1151    HB3  HIS 155           HB1      HIS 155  32.276  14.737 -13.909
 1152    HD1  HIS 155           HD1      HIS 155  32.021  14.072 -16.270
 1153    HD2  HIS 155           HD2      HIS 155  28.509  13.501 -14.117
 1154    HE1  HIS 155           HE1      HIS 155  30.420  12.971 -17.860
 1155    HE2  HIS 155           HE2      HIS 155  28.244  12.835 -16.601
 1156    H    HIS 156           HN       HIS 156  31.101  13.611  -9.800
 1157    HA   HIS 156           HA       HIS 156  33.737  14.831  -9.415
 1158    HB2  HIS 156           HB2      HIS 156  31.140  15.703  -8.177
 1159    HB3  HIS 156           HB1      HIS 156  32.662  15.950  -7.328
 1160    HD1  HIS 156           HD1      HIS 156  30.844  18.292  -8.313
 1161    HD2  HIS 156           HD2      HIS 156  34.187  16.829 -10.308
 1162    HE1  HIS 156           HE1      HIS 156  31.661  20.180  -9.755
 1163    HE2  HIS 156           HE2      HIS 156  33.846  19.363 -10.691
 1164    H    HIS 157           HN       HIS 157  34.750  14.315  -7.441
 1165    HA   HIS 157           HA       HIS 157  33.455  12.279  -5.782
 1166    HB2  HIS 157           HB2      HIS 157  36.169  12.110  -7.061
 1167    HB3  HIS 157           HB1      HIS 157  35.853  11.297  -5.529
 1168    HD1  HIS 157           HD1      HIS 157  35.819  10.666  -9.029
 1169    HD2  HIS 157           HD2      HIS 157  33.433   9.528  -5.821
 1170    HE1  HIS 157           HE1      HIS 157  34.615   8.594  -9.779
 1171    HE2  HIS 157           HE2      HIS 157  33.420   7.776  -7.715
  Start of MODEL   19
    1    H1   MET   1           HT1      MET   1 -26.632  11.966  24.023
    2    H2   MET   1           HT2      MET   1 -26.312  13.347  23.106
    3    H3   MET   1           HT3      MET   1 -25.100  12.692  24.100
    4    HA   MET   1           HA       MET   1 -25.025  10.702  22.749
    5    HB2  MET   1           HB2      MET   1 -26.937  12.208  20.944
    6    HB3  MET   1           HB1      MET   1 -26.219  10.640  20.617
    7    HG2  MET   1           HG2      MET   1 -28.220  11.299  22.759
    8    HG3  MET   1           HG1      MET   1 -28.501  10.357  21.299
    9    HE1  MET   1           HE1      MET   1 -28.837   7.574  23.972
   10    HE2  MET   1           HE2      MET   1 -29.491   8.240  22.475
   11    HE3  MET   1           HE3      MET   1 -29.488   9.215  23.946
   12    H    GLY   2           HN       GLY   2 -23.186  10.724  21.514
   13    HA2  GLY   2           HA2      GLY   2 -22.536  13.168  20.026
   14    HA3  GLY   2           HA1      GLY   2 -21.445  12.689  21.320
   15    H    GLN   3           HN       GLN   3 -23.090  10.337  19.350
   16    HA   GLN   3           HA       GLN   3 -20.486   9.483  18.305
   17    HB2  GLN   3           HB2      GLN   3 -23.153   8.062  18.439
   18    HB3  GLN   3           HB1      GLN   3 -21.716   7.391  17.681
   19    HG2  GLN   3           HG2      GLN   3 -21.840   8.210  20.571
   20    HG3  GLN   3           HG1      GLN   3 -22.192   6.581  20.000
   21   HE21  GLN   3          HE21      GLN   3 -20.499   5.705  21.176
   22   HE22  GLN   3          HE22      GLN   3 -18.848   5.914  20.700
   23    HA   PRO   4           HA       PRO   4 -21.263  10.955  14.174
   24    HB2  PRO   4           HB2      PRO   4 -20.091   8.320  13.414
   25    HB3  PRO   4           HB1      PRO   4 -19.685   9.944  12.841
   26    HG2  PRO   4           HG2      PRO   4 -18.114   8.697  14.592
   27    HG3  PRO   4           HG1      PRO   4 -18.424  10.439  14.728
   28    HD2  PRO   4           HD2      PRO   4 -19.529   8.183  16.345
   29    HD3  PRO   4           HD1      PRO   4 -19.106   9.833  16.846
   30    HA   PRO   5           HA       PRO   5 -24.371   7.549  12.969
   31    HB2  PRO   5           HB2      PRO   5 -24.154   5.218  14.634
   32    HB3  PRO   5           HB1      PRO   5 -23.864   5.340  12.901
   33    HG2  PRO   5           HG2      PRO   5 -21.913   4.816  14.773
   34    HG3  PRO   5           HG1      PRO   5 -21.610   5.503  13.165
   35    HD2  PRO   5           HD2      PRO   5 -21.799   6.882  15.815
   36    HD3  PRO   5           HD1      PRO   5 -20.697   7.189  14.455
   37    H    ALA   6           HN       ALA   6 -26.260   8.309  13.766
   38    HA   ALA   6           HA       ALA   6 -26.590   8.472  16.674
   39    HB1  ALA   6           HB1      ALA   6 -28.376  10.068  16.209
   40    HB2  ALA   6           HB2      ALA   6 -28.183   9.795  14.477
   41    HB3  ALA   6           HB3      ALA   6 -26.882  10.543  15.402
   42    H    GLU   7           HN       GLU   7 -27.703   6.780  13.922
   43    HA   GLU   7           HA       GLU   7 -29.460   5.149  15.512
   44    HB2  GLU   7           HB2      GLU   7 -30.994   6.950  14.970
   45    HB3  GLU   7           HB1      GLU   7 -30.526   6.890  13.277
   46    HG2  GLU   7           HG2      GLU   7 -32.696   5.884  13.617
   47    HG3  GLU   7           HG1      GLU   7 -31.529   4.684  13.065
   48    H    GLU   8           HN       GLU   8 -29.613   3.120  14.661
   49    HA   GLU   8           HA       GLU   8 -28.029   2.540  12.305
   50    HB2  GLU   8           HB2      GLU   8 -29.559   0.715  14.176
   51    HB3  GLU   8           HB1      GLU   8 -28.557   0.162  12.839
   52    HG2  GLU   8           HG2      GLU   8 -26.607   1.241  13.905
   53    HG3  GLU   8           HG1      GLU   8 -27.638   1.688  15.262
   54    H    ALA   9           HN       ALA   9 -31.382   2.343  13.366
   55    HA   ALA   9           HA       ALA   9 -33.368   2.248  12.264
   56    HB1  ALA   9           HB1      ALA   9 -31.814   3.672  10.101
   57    HB2  ALA   9           HB2      ALA   9 -32.524   4.444  11.520
   58    HB3  ALA   9           HB3      ALA   9 -33.566   3.684  10.316
   59    H    GLU  10           HN       GLU  10 -31.900  -0.123  12.003
   60    HA   GLU  10           HA       GLU  10 -31.983  -0.901   9.203
   61    HB2  GLU  10           HB2      GLU  10 -31.260  -2.569  11.614
   62    HB3  GLU  10           HB1      GLU  10 -30.997  -2.999   9.930
   63    HG2  GLU  10           HG2      GLU  10 -29.475  -1.047   9.741
   64    HG3  GLU  10           HG1      GLU  10 -29.662  -0.800  11.477
   65    H    GLN  11           HN       GLN  11 -33.067  -2.625  12.104
   66    HA   GLN  11           HA       GLN  11 -34.698  -4.162  12.402
   67    HB2  GLN  11           HB2      GLN  11 -36.171  -2.055  10.833
   68    HB3  GLN  11           HB1      GLN  11 -36.975  -3.511  11.394
   69    HG2  GLN  11           HG2      GLN  11 -37.412  -1.775  12.958
   70    HG3  GLN  11           HG1      GLN  11 -36.314  -2.921  13.718
   71   HE21  GLN  11          HE21      GLN  11 -34.215  -2.266  14.230
   72   HE22  GLN  11          HE22      GLN  11 -33.728  -0.597  14.164
   73    HA   PRO  12           HA       PRO  12 -33.676  -6.124   8.409
   74    HB2  PRO  12           HB2      PRO  12 -32.606  -8.364   9.404
   75    HB3  PRO  12           HB1      PRO  12 -31.721  -6.834   9.402
   76    HG2  PRO  12           HG2      PRO  12 -33.217  -8.154  11.638
   77    HG3  PRO  12           HG1      PRO  12 -31.626  -7.367  11.667
   78    HD2  PRO  12           HD2      PRO  12 -33.934  -6.154  12.493
   79    HD3  PRO  12           HD1      PRO  12 -32.534  -5.271  11.851
   80    H    GLY  13           HN       GLY  13 -33.994  -8.581   7.746
   81    HA2  GLY  13           HA2      GLY  13 -35.791 -10.331   8.742
   82    HA3  GLY  13           HA1      GLY  13 -36.833  -9.075   8.087
   83    H    ALA  14           HN       ALA  14 -34.440  -8.753   6.095
   84    HA   ALA  14           HA       ALA  14 -33.936  -9.348   3.981
   85    HB1  ALA  14           HB1      ALA  14 -33.897 -11.693   3.348
   86    HB2  ALA  14           HB2      ALA  14 -34.862 -12.109   4.765
   87    HB3  ALA  14           HB3      ALA  14 -33.227 -11.479   4.968
   88    H    LEU  15           HN       LEU  15 -36.619 -11.645   4.238
   89    HA   LEU  15           HA       LEU  15 -38.555  -9.979   3.025
   90    HB2  LEU  15           HB2      LEU  15 -37.094 -10.226   1.062
   91    HB3  LEU  15           HB1      LEU  15 -37.202 -11.970   1.194
   92    HG   LEU  15           HG       LEU  15 -39.656 -11.792   0.762
   93   HD11  LEU  15          HD11      LEU  15 -38.980  -8.914   0.172
   94   HD12  LEU  15          HD12      LEU  15 -39.999  -9.502   1.487
   95   HD13  LEU  15          HD13      LEU  15 -40.514  -9.708  -0.188
   96   HD21  LEU  15          HD21      LEU  15 -38.080 -12.350  -1.012
   97   HD22  LEU  15          HD22      LEU  15 -37.838 -10.636  -1.350
   98   HD23  LEU  15          HD23      LEU  15 -39.413 -11.379  -1.635
   99    H    ALA  16           HN       ALA  16 -37.633 -13.382   2.580
  100    HA   ALA  16           HA       ALA  16 -39.454 -14.591   4.289
  101    HB1  ALA  16           HB1      ALA  16 -41.213 -13.500   2.941
  102    HB2  ALA  16           HB2      ALA  16 -41.281 -15.256   2.782
  103    HB3  ALA  16           HB3      ALA  16 -40.577 -14.281   1.493
  104    H    ARG  17           HN       ARG  17 -38.734 -14.967   0.835
  105    HA   ARG  17           HA       ARG  17 -37.193 -17.382   1.497
  106    HB2  ARG  17           HB2      ARG  17 -37.755 -18.230  -0.749
  107    HB3  ARG  17           HB1      ARG  17 -39.185 -17.973   0.243
  108    HG2  ARG  17           HG2      ARG  17 -39.495 -15.783  -0.924
  109    HG3  ARG  17           HG1      ARG  17 -38.186 -16.251  -2.013
  110    HD2  ARG  17           HD2      ARG  17 -40.331 -16.773  -3.017
  111    HD3  ARG  17           HD1      ARG  17 -39.456 -18.256  -2.648
  112    HE   ARG  17           HE       ARG  17 -41.080 -17.737  -0.458
  113   HH11  ARG  17          HH11      ARG  17 -41.505 -18.403  -3.876
  114   HH12  ARG  17          HH12      ARG  17 -43.056 -19.160  -3.666
  115   HH21  ARG  17          HH21      ARG  17 -43.130 -18.706  -0.185
  116   HH22  ARG  17          HH22      ARG  17 -43.980 -19.338  -1.566
  117    H    GLU  18           HN       GLU  18 -37.096 -14.260   0.329
  118    HA   GLU  18           HA       GLU  18 -35.567 -12.927  -0.634
  119    HB2  GLU  18           HB2      GLU  18 -34.081 -13.963   1.070
  120    HB3  GLU  18           HB1      GLU  18 -33.614 -15.167  -0.120
  121    HG2  GLU  18           HG2      GLU  18 -32.633 -13.470  -1.521
  122    HG3  GLU  18           HG1      GLU  18 -33.194 -12.207  -0.426
  123    H    PHE  19           HN       PHE  19 -34.018 -15.910  -1.786
  124    HA   PHE  19           HA       PHE  19 -35.103 -15.460  -4.446
  125    HB2  PHE  19           HB2      PHE  19 -32.916 -14.114  -4.067
  126    HB3  PHE  19           HB1      PHE  19 -32.118 -15.680  -4.152
  127    HD1  PHE  19           HD1      PHE  19 -35.022 -14.439  -6.108
  128    HD2  PHE  19           HD2      PHE  19 -30.927 -15.599  -6.150
  129    HE1  PHE  19           HE1      PHE  19 -35.006 -14.275  -8.562
  130    HE2  PHE  19           HE2      PHE  19 -30.903 -15.430  -8.609
  131    HZ   PHE  19           HZ       PHE  19 -32.943 -14.768  -9.813
  132    H    LEU  20           HN       LEU  20 -34.991 -17.308  -5.778
  133    HA   LEU  20           HA       LEU  20 -34.703 -19.739  -4.178
  134    HB2  LEU  20           HB2      LEU  20 -36.227 -20.795  -5.706
  135    HB3  LEU  20           HB1      LEU  20 -36.908 -19.280  -5.163
  136    HG   LEU  20           HG       LEU  20 -35.518 -19.559  -7.821
  137   HD11  LEU  20          HD11      LEU  20 -38.457 -19.843  -7.206
  138   HD12  LEU  20          HD12      LEU  20 -37.381 -21.124  -7.758
  139   HD13  LEU  20          HD13      LEU  20 -37.744 -19.763  -8.817
  140   HD21  LEU  20          HD21      LEU  20 -36.788 -17.548  -8.378
  141   HD22  LEU  20          HD22      LEU  20 -35.751 -17.279  -6.977
  142   HD23  LEU  20          HD23      LEU  20 -37.482 -17.531  -6.759
  143    H    ALA  21           HN       ALA  21 -32.649 -18.185  -6.005
  144    HA   ALA  21           HA       ALA  21 -31.893 -20.402  -7.746
  145    HB1  ALA  21           HB1      ALA  21 -31.798 -18.164  -8.724
  146    HB2  ALA  21           HB2      ALA  21 -30.184 -18.880  -8.647
  147    HB3  ALA  21           HB3      ALA  21 -30.664 -17.655  -7.472
  148    H    ALA  22           HN       ALA  22 -31.279 -21.896  -6.192
  149    HA   ALA  22           HA       ALA  22 -28.991 -21.233  -4.490
  150    HB1  ALA  22           HB1      ALA  22 -30.737 -23.701  -4.535
  151    HB2  ALA  22           HB2      ALA  22 -30.872 -22.353  -3.408
  152    HB3  ALA  22           HB3      ALA  22 -29.440 -23.383  -3.381
  153    H    MET  23           HN       MET  23 -29.677 -22.584  -7.482
  154    HA   MET  23           HA       MET  23 -27.480 -24.497  -7.465
  155    HB2  MET  23           HB2      MET  23 -29.391 -23.737  -9.678
  156    HB3  MET  23           HB1      MET  23 -28.248 -25.071  -9.721
  157    HG2  MET  23           HG2      MET  23 -29.434 -26.250  -8.034
  158    HG3  MET  23           HG1      MET  23 -30.449 -24.854  -7.682
  159    HE1  MET  23           HE1      MET  23 -31.696 -27.722  -8.132
  160    HE2  MET  23           HE2      MET  23 -33.064 -27.305  -9.165
  161    HE3  MET  23           HE3      MET  23 -32.626 -26.257  -7.816
  162    H    GLU  24           HN       GLU  24 -27.712 -21.271  -7.789
  163    HA   GLU  24           HA       GLU  24 -25.497 -21.122  -9.727
  164    HB2  GLU  24           HB2      GLU  24 -27.576 -19.887 -10.376
  165    HB3  GLU  24           HB1      GLU  24 -27.400 -18.907  -8.929
  166    HG2  GLU  24           HG2      GLU  24 -26.525 -17.610 -10.665
  167    HG3  GLU  24           HG1      GLU  24 -25.118 -18.255  -9.820
  168    HA   PRO  25           HA       PRO  25 -23.622 -19.942  -5.785
  169    HB2  PRO  25           HB2      PRO  25 -21.274 -21.313  -6.267
  170    HB3  PRO  25           HB1      PRO  25 -22.709 -22.004  -5.511
  171    HG2  PRO  25           HG2      PRO  25 -21.584 -22.623  -8.078
  172    HG3  PRO  25           HG1      PRO  25 -22.999 -23.346  -7.298
  173    HD2  PRO  25           HD2      PRO  25 -22.861 -21.262  -9.381
  174    HD3  PRO  25           HD1      PRO  25 -24.206 -22.334  -8.944
  175    H    GLU  26           HN       GLU  26 -23.057 -17.832  -5.890
  176    HA   GLU  26           HA       GLU  26 -20.781 -17.082  -7.575
  177    HB2  GLU  26           HB2      GLU  26 -22.769 -15.420  -6.018
  178    HB3  GLU  26           HB1      GLU  26 -21.355 -14.739  -6.806
  179    HG2  GLU  26           HG2      GLU  26 -22.247 -15.765  -8.952
  180    HG3  GLU  26           HG1      GLU  26 -23.750 -16.030  -8.070
  181    HA   PRO  27           HA       PRO  27 -17.892 -17.168  -4.241
  182    HB2  PRO  27           HB2      PRO  27 -16.499 -14.830  -4.761
  183    HB3  PRO  27           HB1      PRO  27 -16.196 -16.383  -5.546
  184    HG2  PRO  27           HG2      PRO  27 -17.768 -14.037  -6.519
  185    HG3  PRO  27           HG1      PRO  27 -16.689 -15.120  -7.421
  186    HD2  PRO  27           HD2      PRO  27 -19.359 -15.348  -7.573
  187    HD3  PRO  27           HD1      PRO  27 -18.301 -16.772  -7.607
  188    H    ALA  28           HN       ALA  28 -18.228 -16.681  -2.186
  189    HA   ALA  28           HA       ALA  28 -20.073 -14.754  -1.317
  190    HB1  ALA  28           HB1      ALA  28 -19.321 -15.314   0.945
  191    HB2  ALA  28           HB2      ALA  28 -17.937 -16.176   0.271
  192    HB3  ALA  28           HB3      ALA  28 -19.573 -16.765  -0.027
  193    HA   PRO  29           HA       PRO  29 -17.740 -10.970  -1.425
  194    HB2  PRO  29           HB2      PRO  29 -19.106  -9.811   0.707
  195    HB3  PRO  29           HB1      PRO  29 -19.570  -9.705  -0.993
  196    HG2  PRO  29           HG2      PRO  29 -20.592 -11.505   1.155
  197    HG3  PRO  29           HG1      PRO  29 -21.463 -10.756  -0.193
  198    HD2  PRO  29           HD2      PRO  29 -20.797 -13.345  -0.220
  199    HD3  PRO  29           HD1      PRO  29 -20.756 -12.367  -1.703
  200    H    ALA  30           HN       ALA  30 -15.981 -10.181  -0.450
  201    HA   ALA  30           HA       ALA  30 -15.587 -10.616   2.417
  202    HB1  ALA  30           HB1      ALA  30 -13.283 -11.351   2.112
  203    HB2  ALA  30           HB2      ALA  30 -13.476 -11.273   0.360
  204    HB3  ALA  30           HB3      ALA  30 -14.396 -12.453   1.296
  205    HA   PRO  31           HA       PRO  31 -14.375  -6.348   0.927
  206    HB2  PRO  31           HB2      PRO  31 -16.275  -4.907   2.140
  207    HB3  PRO  31           HB1      PRO  31 -16.599  -5.731   0.608
  208    HG2  PRO  31           HG2      PRO  31 -17.285  -6.589   3.402
  209    HG3  PRO  31           HG1      PRO  31 -18.308  -6.601   1.952
  210    HD2  PRO  31           HD2      PRO  31 -17.004  -8.811   2.882
  211    HD3  PRO  31           HD1      PRO  31 -17.383  -8.554   1.171
  212    H    ALA  32           HN       ALA  32 -13.629  -4.536   2.256
  213    HA   ALA  32           HA       ALA  32 -13.053  -5.335   5.034
  214    HB1  ALA  32           HB1      ALA  32 -11.055  -5.111   3.635
  215    HB2  ALA  32           HB2      ALA  32 -11.085  -3.898   4.914
  216    HB3  ALA  32           HB3      ALA  32 -11.502  -3.446   3.261
  217    HA   PRO  33           HA       PRO  33 -15.568  -1.945   6.441
  218    HB2  PRO  33           HB2      PRO  33 -13.777  -1.789   8.777
  219    HB3  PRO  33           HB1      PRO  33 -15.501  -2.166   8.705
  220    HG2  PRO  33           HG2      PRO  33 -13.684  -4.055   9.250
  221    HG3  PRO  33           HG1      PRO  33 -15.124  -4.410   8.280
  222    HD2  PRO  33           HD2      PRO  33 -12.309  -3.906   7.379
  223    HD3  PRO  33           HD1      PRO  33 -13.467  -5.133   6.821
  224    H    GLU  34           HN       GLU  34 -12.090  -1.632   6.264
  225    HA   GLU  34           HA       GLU  34 -12.427   1.174   5.586
  226    HB2  GLU  34           HB2      GLU  34 -11.883   1.278   7.958
  227    HB3  GLU  34           HB1      GLU  34 -10.515   0.199   7.724
  228    HG2  GLU  34           HG2      GLU  34  -9.753   2.478   7.960
  229    HG3  GLU  34           HG1      GLU  34  -9.420   1.891   6.333
  230    H    GLU  35           HN       GLU  35 -11.725   1.096   3.582
  231    HA   GLU  35           HA       GLU  35  -9.326  -0.480   2.992
  232    HB2  GLU  35           HB2      GLU  35 -11.412   0.543   1.060
  233    HB3  GLU  35           HB1      GLU  35 -10.080  -0.546   0.687
  234    HG2  GLU  35           HG2      GLU  35 -11.092  -2.102   2.438
  235    HG3  GLU  35           HG1      GLU  35 -12.527  -1.086   2.331
  236    H    TRP  36           HN       TRP  36  -7.545   0.593   2.839
  237    HA   TRP  36           HA       TRP  36  -7.468   3.408   3.109
  238    HB2  TRP  36           HB2      TRP  36  -5.020   1.951   2.249
  239    HB3  TRP  36           HB1      TRP  36  -5.221   3.177   3.493
  240    HD1  TRP  36           HD1      TRP  36  -7.304   1.746   5.396
  241    HE1  TRP  36           HE1      TRP  36  -6.599  -0.347   6.715
  242    HE3  TRP  36           HE3      TRP  36  -3.322   0.283   2.523
  243    HZ2  TRP  36           HZ2      TRP  36  -4.598  -2.350   6.559
  244    HZ3  TRP  36           HZ3      TRP  36  -2.087  -1.713   3.182
  245    HH2  TRP  36           HH2      TRP  36  -2.699  -3.014   5.138
  246    H    LEU  37           HN       LEU  37  -5.305   4.222   1.668
  247    HA   LEU  37           HA       LEU  37  -6.542   5.045  -0.739
  248    HB2  LEU  37           HB2      LEU  37  -4.995   6.467   0.511
  249    HB3  LEU  37           HB1      LEU  37  -3.691   5.337   0.214
  250    HG   LEU  37           HG       LEU  37  -3.852   5.800  -2.210
  251   HD11  LEU  37          HD11      LEU  37  -5.179   7.673  -3.010
  252   HD12  LEU  37          HD12      LEU  37  -5.835   7.919  -1.393
  253   HD13  LEU  37          HD13      LEU  37  -6.213   6.445  -2.284
  254   HD21  LEU  37          HD21      LEU  37  -3.494   8.271  -0.515
  255   HD22  LEU  37          HD22      LEU  37  -2.867   8.020  -2.145
  256   HD23  LEU  37          HD23      LEU  37  -2.270   7.039  -0.808
  257    H    ASP  38           HN       ASP  38  -6.815   3.727  -2.367
  258    HA   ASP  38           HA       ASP  38  -5.154   1.586  -3.124
  259    HB2  ASP  38           HB2      ASP  38  -6.420   1.954  -5.379
  260    HB3  ASP  38           HB1      ASP  38  -7.318   1.424  -3.959
  261    H    ILE  39           HN       ILE  39  -3.097   1.919  -3.491
  262    HA   ILE  39           HA       ILE  39  -1.852   4.263  -4.254
  263    HB   ILE  39           HB       ILE  39  -0.924   1.413  -4.583
  264   HG12  ILE  39          HG12      ILE  39  -0.525   3.521  -2.457
  265   HG13  ILE  39          HG11      ILE  39  -1.287   1.946  -2.288
  266   HG21  ILE  39          HG21      ILE  39   0.333   2.770  -6.122
  267   HG22  ILE  39          HG22      ILE  39   1.359   2.343  -4.752
  268   HG23  ILE  39          HG23      ILE  39   0.661   3.961  -4.864
  269   HD11  ILE  39          HD11      ILE  39   0.926   2.001  -1.275
  270   HD12  ILE  39          HD12      ILE  39   1.633   2.413  -2.837
  271   HD13  ILE  39          HD13      ILE  39   0.851   0.849  -2.607
  272    H    LEU  40           HN       LEU  40  -2.841   1.558  -6.307
  273    HA   LEU  40           HA       LEU  40  -2.201   3.193  -8.662
  274    HB2  LEU  40           HB2      LEU  40  -2.555   0.198  -8.454
  275    HB3  LEU  40           HB1      LEU  40  -2.187   1.078  -9.928
  276    HG   LEU  40           HG       LEU  40  -0.400   0.865  -7.501
  277   HD11  LEU  40          HD11      LEU  40  -0.143  -0.321 -10.261
  278   HD12  LEU  40          HD12      LEU  40  -0.532  -1.205  -8.785
  279   HD13  LEU  40          HD13      LEU  40   1.048  -0.440  -8.965
  280   HD21  LEU  40          HD21      LEU  40  -0.172   3.023  -8.628
  281   HD22  LEU  40          HD22      LEU  40   0.076   2.196 -10.165
  282   HD23  LEU  40          HD23      LEU  40   1.259   2.022  -8.867
  283    H    GLY  41           HN       GLY  41  -4.666   2.931  -6.815
  284    HA2  GLY  41           HA2      GLY  41  -6.919   3.225  -7.082
  285    HA3  GLY  41           HA1      GLY  41  -6.628   3.367  -8.803
  286    H    ASN  42           HN       ASN  42  -5.298   0.517  -7.928
  287    HA   ASN  42           HA       ASN  42  -7.466  -0.946  -9.104
  288    HB2  ASN  42           HB2      ASN  42  -5.993  -2.853  -9.161
  289    HB3  ASN  42           HB1      ASN  42  -5.116  -1.429  -9.696
  290   HD21  ASN  42          HD21      ASN  42  -4.719  -0.466  -6.931
  291   HD22  ASN  42          HD22      ASN  42  -3.480  -1.467  -6.277
  292    H    GLY  43           HN       GLY  43  -6.189  -0.542  -5.873
  293    HA2  GLY  43           HA2      GLY  43  -7.507  -0.860  -3.944
  294    HA3  GLY  43           HA1      GLY  43  -8.549  -1.937  -4.858
  295    H    LEU  44           HN       LEU  44  -5.850  -3.126  -5.830
  296    HA   LEU  44           HA       LEU  44  -5.777  -5.275  -3.912
  297    HB2  LEU  44           HB2      LEU  44  -4.167  -4.673  -6.400
  298    HB3  LEU  44           HB1      LEU  44  -3.895  -6.091  -5.413
  299    HG   LEU  44           HG       LEU  44  -5.203  -6.527  -7.467
  300   HD11  LEU  44          HD11      LEU  44  -6.943  -7.877  -6.391
  301   HD12  LEU  44          HD12      LEU  44  -6.667  -7.013  -4.881
  302   HD13  LEU  44          HD13      LEU  44  -5.394  -8.022  -5.565
  303   HD21  LEU  44          HD21      LEU  44  -7.525  -5.827  -7.615
  304   HD22  LEU  44          HD22      LEU  44  -6.450  -4.426  -7.567
  305   HD23  LEU  44          HD23      LEU  44  -7.347  -4.899  -6.126
  306    H    LEU  45           HN       LEU  45  -3.978  -2.484  -4.759
  307    HA   LEU  45           HA       LEU  45  -1.968  -3.033  -2.687
  308    HB2  LEU  45           HB2      LEU  45  -0.817  -3.111  -4.717
  309    HB3  LEU  45           HB1      LEU  45  -1.759  -1.817  -5.415
  310    HG   LEU  45           HG       LEU  45  -0.589  -0.186  -3.993
  311   HD11  LEU  45          HD11      LEU  45   1.314  -0.857  -2.648
  312   HD12  LEU  45          HD12      LEU  45   1.043  -2.545  -3.077
  313   HD13  LEU  45          HD13      LEU  45  -0.147  -1.683  -2.100
  314   HD21  LEU  45          HD21      LEU  45   1.624  -0.370  -5.051
  315   HD22  LEU  45          HD22      LEU  45   0.306  -0.644  -6.189
  316   HD23  LEU  45          HD23      LEU  45   1.225  -2.010  -5.561
  317    H    ARG  46           HN       ARG  46  -2.268  -1.752  -0.961
  318    HA   ARG  46           HA       ARG  46  -3.135   1.032  -1.353
  319    HB2  ARG  46           HB2      ARG  46  -4.406  -0.852   0.627
  320    HB3  ARG  46           HB1      ARG  46  -4.864   0.820   0.320
  321    HG2  ARG  46           HG2      ARG  46  -5.546   0.205  -1.951
  322    HG3  ARG  46           HG1      ARG  46  -5.084  -1.466  -1.630
  323    HD2  ARG  46           HD2      ARG  46  -7.164   0.068  -0.088
  324    HD3  ARG  46           HD1      ARG  46  -7.512  -1.056  -1.400
  325    HE   ARG  46           HE       ARG  46  -5.979  -2.083   0.861
  326   HH11  ARG  46          HH11      ARG  46  -9.002  -1.900  -0.866
  327   HH12  ARG  46          HH12      ARG  46  -9.772  -3.169   0.035
  328   HH21  ARG  46          HH21      ARG  46  -6.941  -3.811   2.048
  329   HH22  ARG  46          HH22      ARG  46  -8.554  -4.310   1.644
  330    H    LYS  47           HN       LYS  47  -2.357   2.463   0.161
  331    HA   LYS  47           HA       LYS  47  -0.401   1.385   2.093
  332    HB2  LYS  47           HB2      LYS  47   0.166   3.058   0.106
  333    HB3  LYS  47           HB1      LYS  47  -0.470   4.257   1.222
  334    HG2  LYS  47           HG2      LYS  47   1.203   3.245   2.908
  335    HG3  LYS  47           HG1      LYS  47   1.964   2.540   1.481
  336    HD2  LYS  47           HD2      LYS  47   3.098   4.549   1.865
  337    HD3  LYS  47           HD1      LYS  47   2.009   4.868   0.519
  338    HE2  LYS  47           HE2      LYS  47   0.672   6.263   1.731
  339    HE3  LYS  47           HE1      LYS  47   0.983   5.419   3.247
  340    HZ1  LYS  47           HZ1      LYS  47   1.949   7.692   3.110
  341    HZ2  LYS  47           HZ2      LYS  47   2.986   7.146   1.891
  342    HZ3  LYS  47           HZ3      LYS  47   3.086   6.487   3.454
  343    H    LYS  48           HN       LYS  48  -0.885   1.581   4.197
  344    HA   LYS  48           HA       LYS  48  -2.867   3.607   5.013
  345    HB2  LYS  48           HB2      LYS  48  -3.489   1.332   5.625
  346    HB3  LYS  48           HB1      LYS  48  -1.938   1.089   6.414
  347    HG2  LYS  48           HG2      LYS  48  -2.538   2.850   8.046
  348    HG3  LYS  48           HG1      LYS  48  -4.121   2.984   7.281
  349    HD2  LYS  48           HD2      LYS  48  -4.169   1.573   9.305
  350    HD3  LYS  48           HD1      LYS  48  -4.629   0.681   7.852
  351    HE2  LYS  48           HE2      LYS  48  -2.469  -0.342   7.729
  352    HE3  LYS  48           HE1      LYS  48  -1.858   0.674   9.034
  353    HZ1  LYS  48           HZ1      LYS  48  -2.391  -1.575   9.772
  354    HZ2  LYS  48           HZ2      LYS  48  -4.010  -1.357   9.316
  355    HZ3  LYS  48           HZ3      LYS  48  -3.345  -0.416  10.565
  356    H    THR  49           HN       THR  49  -1.965   5.403   5.765
  357    HA   THR  49           HA       THR  49   0.707   5.452   6.806
  358    HB   THR  49           HB       THR  49  -0.020   7.869   7.423
  359    HG1  THR  49           HG1      THR  49  -2.071   8.243   7.084
  360   HG21  THR  49          HG21      THR  49   0.374   8.623   5.153
  361   HG22  THR  49          HG22      THR  49  -0.019   7.023   4.526
  362   HG23  THR  49          HG23      THR  49   1.424   7.253   5.514
  363    H    LEU  50           HN       LEU  50   0.847   4.242   8.682
  364    HA   LEU  50           HA       LEU  50  -0.874   4.519  10.925
  365    HB2  LEU  50           HB2      LEU  50   2.104   4.038  11.078
  366    HB3  LEU  50           HB1      LEU  50   0.861   3.476  12.181
  367    HG   LEU  50           HG       LEU  50   1.091   2.516   9.336
  368   HD11  LEU  50          HD11      LEU  50   3.127   1.968  10.549
  369   HD12  LEU  50          HD12      LEU  50   2.157   0.521  10.267
  370   HD13  LEU  50          HD13      LEU  50   2.173   1.273  11.861
  371   HD21  LEU  50          HD21      LEU  50  -1.106   2.272  10.358
  372   HD22  LEU  50          HD22      LEU  50  -0.381   1.462  11.745
  373   HD23  LEU  50          HD23      LEU  50  -0.329   0.700  10.157
  374    H    VAL  51           HN       VAL  51   2.241   5.875  10.098
  375    HA   VAL  51           HA       VAL  51   1.421   8.517  11.082
  376    HB   VAL  51           HB       VAL  51   4.113   7.216  11.517
  377   HG11  VAL  51          HG11      VAL  51   4.388   9.552  10.942
  378   HG12  VAL  51          HG12      VAL  51   4.758   9.300  12.650
  379   HG13  VAL  51          HG13      VAL  51   3.215  10.016  12.177
  380   HG21  VAL  51          HG21      VAL  51   2.468   6.466  13.134
  381   HG22  VAL  51          HG22      VAL  51   2.051   8.137  13.507
  382   HG23  VAL  51          HG23      VAL  51   3.653   7.518  13.912
  383    HA   PRO  52           HA       PRO  52   3.507   9.152   7.146
  384    HB2  PRO  52           HB2      PRO  52   2.088  11.224   6.339
  385    HB3  PRO  52           HB1      PRO  52   1.343   9.638   6.596
  386    HG2  PRO  52           HG2      PRO  52   1.107  12.097   8.235
  387    HG3  PRO  52           HG1      PRO  52  -0.041  10.764   8.043
  388    HD2  PRO  52           HD2      PRO  52   1.967  11.145  10.112
  389    HD3  PRO  52           HD1      PRO  52   0.718   9.885   9.997
  390    H    GLY  53           HN       GLY  53   5.304   9.765   8.914
  391    HA2  GLY  53           HA2      GLY  53   7.189  11.052   9.102
  392    HA3  GLY  53           HA1      GLY  53   6.470  12.187   7.969
  393    HA   PRO  54           HA       PRO  54   6.101  13.762  12.533
  394    HB2  PRO  54           HB2      PRO  54   8.826  14.822  12.039
  395    HB3  PRO  54           HB1      PRO  54   8.129  14.178  13.529
  396    HG2  PRO  54           HG2      PRO  54   9.942  12.792  12.126
  397    HG3  PRO  54           HG1      PRO  54   8.600  11.989  12.961
  398    HD2  PRO  54           HD2      PRO  54   8.935  12.596  10.053
  399    HD3  PRO  54           HD1      PRO  54   8.223  11.169  10.837
  400    HA   PRO  55           HA       PRO  55   4.637  17.297  10.311
  401    HB2  PRO  55           HB2      PRO  55   5.574  18.813  12.710
  402    HB3  PRO  55           HB1      PRO  55   4.021  18.885  11.871
  403    HG2  PRO  55           HG2      PRO  55   4.242  17.563  14.160
  404    HG3  PRO  55           HG1      PRO  55   3.252  16.925  12.832
  405    HD2  PRO  55           HD2      PRO  55   5.934  16.043  13.792
  406    HD3  PRO  55           HD1      PRO  55   4.613  15.085  13.092
  407    H    GLY  56           HN       GLY  56   6.079  17.518   8.647
  408    HA2  GLY  56           HA2      GLY  56   7.532  19.118   7.584
  409    HA3  GLY  56           HA1      GLY  56   8.362  19.314   9.123
  410    H    SER  57           HN       SER  57   7.518  16.599   6.951
  411    HA   SER  57           HA       SER  57  10.342  15.796   7.045
  412    HB2  SER  57           HB2      SER  57   7.978  13.969   6.490
  413    HB3  SER  57           HB1      SER  57   9.652  13.500   6.718
  414    HG   SER  57           HG       SER  57   8.065  14.770   8.702
  415    H    SER  58           HN       SER  58  10.452  14.140   4.885
  416    HA   SER  58           HA       SER  58   9.479  15.771   2.637
  417    HB2  SER  58           HB2      SER  58  11.928  16.154   3.142
  418    HB3  SER  58           HB1      SER  58  12.204  14.450   2.797
  419    HG   SER  58           HG       SER  58  12.443  16.206   1.056
  420    H    ARG  59           HN       ARG  59   9.960  14.270   0.530
  421    HA   ARG  59           HA       ARG  59   9.498  11.464   1.252
  422    HB2  ARG  59           HB2      ARG  59   8.236  12.744  -1.171
  423    HB3  ARG  59           HB1      ARG  59   7.888  11.160  -0.457
  424    HG2  ARG  59           HG2      ARG  59   7.134  12.479   1.595
  425    HG3  ARG  59           HG1      ARG  59   7.120  13.879   0.527
  426    HD2  ARG  59           HD2      ARG  59   5.567  11.329   0.127
  427    HD3  ARG  59           HD1      ARG  59   4.910  12.869   0.671
  428    HE   ARG  59           HE       ARG  59   6.141  12.542  -1.994
  429   HH11  ARG  59          HH11      ARG  59   3.571  13.704   0.094
  430   HH12  ARG  59          HH12      ARG  59   2.682  14.429  -1.217
  431   HH21  ARG  59          HH21      ARG  59   4.991  13.575  -3.701
  432   HH22  ARG  59          HH22      ARG  59   3.478  14.362  -3.344
  433    HA   PRO  60           HA       PRO  60  13.278  10.977  -1.040
  434    HB2  PRO  60           HB2      PRO  60  12.783   8.253  -1.501
  435    HB3  PRO  60           HB1      PRO  60  13.697   8.937  -0.156
  436    HG2  PRO  60           HG2      PRO  60  10.851   8.067  -0.272
  437    HG3  PRO  60           HG1      PRO  60  12.011   7.936   1.062
  438    HD2  PRO  60           HD2      PRO  60  10.087   9.778   1.108
  439    HD3  PRO  60           HD1      PRO  60  11.723  10.165   1.685
  440    H    VAL  61           HN       VAL  61  13.789  11.106  -3.124
  441    HA   VAL  61           HA       VAL  61  11.668  10.816  -5.103
  442    HB   VAL  61           HB       VAL  61  14.510  11.757  -5.534
  443   HG11  VAL  61          HG11      VAL  61  13.338  11.113  -7.573
  444   HG12  VAL  61          HG12      VAL  61  13.626  12.852  -7.523
  445   HG13  VAL  61          HG13      VAL  61  12.019  12.213  -7.172
  446   HG21  VAL  61          HG21      VAL  61  13.478  13.166  -3.852
  447   HG22  VAL  61          HG22      VAL  61  12.068  13.406  -4.887
  448   HG23  VAL  61          HG23      VAL  61  13.640  14.050  -5.370
  449    H    LYS  62           HN       LYS  62  12.029   9.539  -7.043
  450    HA   LYS  62           HA       LYS  62  13.141   7.005  -6.486
  451    HB2  LYS  62           HB2      LYS  62  12.113   8.169  -9.060
  452    HB3  LYS  62           HB1      LYS  62  12.666   6.509  -8.891
  453    HG2  LYS  62           HG2      LYS  62  10.958   6.492  -6.895
  454    HG3  LYS  62           HG1      LYS  62  10.229   7.816  -7.805
  455    HD2  LYS  62           HD2      LYS  62  10.001   6.426  -9.742
  456    HD3  LYS  62           HD1      LYS  62  10.892   5.121  -8.962
  457    HE2  LYS  62           HE2      LYS  62   9.073   5.188  -7.171
  458    HE3  LYS  62           HE1      LYS  62   8.150   6.154  -8.318
  459    HZ1  LYS  62           HZ1      LYS  62   9.028   3.337  -8.555
  460    HZ2  LYS  62           HZ2      LYS  62   8.610   4.243  -9.932
  461    HZ3  LYS  62           HZ3      LYS  62   7.467   3.986  -8.709
  462    H    GLY  63           HN       GLY  63  15.140   6.587  -6.311
  463    HA2  GLY  63           HA2      GLY  63  17.200   6.423  -7.856
  464    HA3  GLY  63           HA1      GLY  63  17.108   8.176  -7.788
  465    H    GLN  64           HN       GLN  64  16.086   8.126  -5.028
  466    HA   GLN  64           HA       GLN  64  18.645   8.006  -3.701
  467    HB2  GLN  64           HB2      GLN  64  16.133   8.152  -2.100
  468    HB3  GLN  64           HB1      GLN  64  17.657   9.014  -1.879
  469    HG2  GLN  64           HG2      GLN  64  15.557   9.626  -3.938
  470    HG3  GLN  64           HG1      GLN  64  15.805  10.493  -2.431
  471   HE21  GLN  64          HE21      GLN  64  18.384   9.378  -4.570
  472   HE22  GLN  64          HE22      GLN  64  18.944  10.965  -4.991
  473    H    VAL  65           HN       VAL  65  19.413   6.390  -2.386
  474    HA   VAL  65           HA       VAL  65  17.758   4.011  -2.209
  475    HB   VAL  65           HB       VAL  65  19.607   2.779  -1.449
  476   HG11  VAL  65          HG11      VAL  65  20.682   4.779  -3.425
  477   HG12  VAL  65          HG12      VAL  65  19.716   3.355  -3.809
  478   HG13  VAL  65          HG13      VAL  65  21.331   3.166  -3.124
  479   HG21  VAL  65          HG21      VAL  65  21.058   5.368  -0.923
  480   HG22  VAL  65          HG22      VAL  65  21.759   3.757  -0.773
  481   HG23  VAL  65          HG23      VAL  65  20.433   4.241   0.285
  482    H    VAL  66           HN       VAL  66  16.729   3.400  -0.443
  483    HA   VAL  66           HA       VAL  66  16.874   5.179   1.885
  484    HB   VAL  66           HB       VAL  66  14.445   5.119   2.054
  485   HG11  VAL  66          HG11      VAL  66  15.487   6.929   0.753
  486   HG12  VAL  66          HG12      VAL  66  13.888   6.525   0.143
  487   HG13  VAL  66          HG13      VAL  66  15.326   5.960  -0.709
  488   HG21  VAL  66          HG21      VAL  66  13.057   4.167   0.326
  489   HG22  VAL  66          HG22      VAL  66  14.130   2.914   0.954
  490   HG23  VAL  66          HG23      VAL  66  14.477   3.685  -0.597
  491    H    THR  67           HN       THR  67  16.397   4.298   3.866
  492    HA   THR  67           HA       THR  67  16.598   1.386   3.977
  493    HB   THR  67           HB       THR  67  16.938   1.783   6.440
  494    HG1  THR  67           HG1      THR  67  17.632   4.066   6.837
  495   HG21  THR  67          HG21      THR  67  19.230   2.637   6.213
  496   HG22  THR  67          HG22      THR  67  18.867   3.123   4.554
  497   HG23  THR  67          HG23      THR  67  18.844   1.416   4.998
  498    H    VAL  68           HN       VAL  68  14.707   0.373   3.972
  499    HA   VAL  68           HA       VAL  68  12.576   1.544   5.607
  500    HB   VAL  68           HB       VAL  68  10.998   0.031   4.410
  501   HG11  VAL  68          HG11      VAL  68  11.222   2.348   3.710
  502   HG12  VAL  68          HG12      VAL  68  10.972   1.312   2.303
  503   HG13  VAL  68          HG13      VAL  68  12.584   1.927   2.672
  504   HG21  VAL  68          HG21      VAL  68  12.539  -1.693   3.690
  505   HG22  VAL  68          HG22      VAL  68  13.408  -0.539   2.678
  506   HG23  VAL  68          HG23      VAL  68  11.747  -0.984   2.285
  507    H    HIS  69           HN       HIS  69  11.672   0.394   7.233
  508    HA   HIS  69           HA       HIS  69  12.795  -2.277   7.737
  509    HB2  HIS  69           HB2      HIS  69  12.912  -0.779   9.685
  510    HB3  HIS  69           HB1      HIS  69  11.179  -0.471   9.574
  511    HD1  HIS  69           HD1      HIS  69  12.699  -1.873  12.073
  512    HD2  HIS  69           HD2      HIS  69  10.455  -3.731   9.122
  513    HE1  HIS  69           HE1      HIS  69  11.878  -4.066  13.047
  514    HE2  HIS  69           HE2      HIS  69  10.396  -5.035  11.337
  515    H    LEU  70           HN       LEU  70  11.624  -3.821   6.826
  516    HA   LEU  70           HA       LEU  70   8.717  -3.441   6.793
  517    HB2  LEU  70           HB2      LEU  70   8.477  -4.523   4.768
  518    HB3  LEU  70           HB1      LEU  70   9.925  -3.570   4.528
  519    HG   LEU  70           HG       LEU  70  10.097  -6.401   5.433
  520   HD11  LEU  70          HD11      LEU  70   9.912  -5.442   2.585
  521   HD12  LEU  70          HD12      LEU  70   8.725  -6.439   3.427
  522   HD13  LEU  70          HD13      LEU  70  10.337  -7.076   3.090
  523   HD21  LEU  70          HD21      LEU  70  12.162  -5.212   5.570
  524   HD22  LEU  70          HD22      LEU  70  11.933  -4.508   3.972
  525   HD23  LEU  70          HD23      LEU  70  12.258  -6.231   4.135
  526    H    GLN  71           HN       GLN  71   7.518  -4.867   7.672
  527    HA   GLN  71           HA       GLN  71   8.445  -7.617   8.051
  528    HB2  GLN  71           HB2      GLN  71   6.569  -6.592  10.087
  529    HB3  GLN  71           HB1      GLN  71   7.832  -7.796  10.247
  530    HG2  GLN  71           HG2      GLN  71   8.720  -6.203  11.545
  531    HG3  GLN  71           HG1      GLN  71   9.402  -5.710   9.999
  532   HE21  GLN  71          HE21      GLN  71   6.679  -4.810   9.164
  533   HE22  GLN  71          HE22      GLN  71   6.535  -3.264   9.913
  534    H    THR  72           HN       THR  72   7.120  -8.849   7.058
  535    HA   THR  72           HA       THR  72   4.703  -7.579   6.026
  536    HB   THR  72           HB       THR  72   6.468  -9.675   4.785
  537    HG1  THR  72           HG1      THR  72   7.393  -8.031   3.708
  538   HG21  THR  72          HG21      THR  72   4.145  -8.131   3.661
  539   HG22  THR  72          HG22      THR  72   4.155  -9.851   4.051
  540   HG23  THR  72          HG23      THR  72   5.182  -9.236   2.756
  541    H    SER  73           HN       SER  73   2.849  -8.440   6.521
  542    HA   SER  73           HA       SER  73   2.808 -11.147   7.633
  543    HB2  SER  73           HB2      SER  73   0.400  -9.417   7.839
  544    HB3  SER  73           HB1      SER  73   1.159 -10.435   9.062
  545    HG   SER  73           HG       SER  73   1.854  -7.817   8.261
  546    H    LEU  74           HN       LEU  74   1.295 -12.598   6.894
  547    HA   LEU  74           HA       LEU  74   0.485 -12.322   4.175
  548    HB2  LEU  74           HB2      LEU  74   0.076 -14.419   6.275
  549    HB3  LEU  74           HB1      LEU  74  -0.598 -14.571   4.666
  550    HG   LEU  74           HG       LEU  74   2.242 -14.704   5.557
  551   HD11  LEU  74          HD11      LEU  74   2.270 -16.618   4.027
  552   HD12  LEU  74          HD12      LEU  74   0.590 -16.290   3.598
  553   HD13  LEU  74          HD13      LEU  74   1.004 -16.769   5.245
  554   HD21  LEU  74          HD21      LEU  74   2.236 -12.926   3.897
  555   HD22  LEU  74          HD22      LEU  74   1.358 -13.966   2.772
  556   HD23  LEU  74          HD23      LEU  74   3.000 -14.385   3.254
  557    H    GLU  75           HN       GLU  75  -1.766 -12.751   3.479
  558    HA   GLU  75           HA       GLU  75  -3.719 -11.115   4.540
  559    HB2  GLU  75           HB2      GLU  75  -5.332 -12.602   3.296
  560    HB3  GLU  75           HB1      GLU  75  -3.983 -12.008   2.341
  561    HG2  GLU  75           HG2      GLU  75  -2.835 -14.142   2.620
  562    HG3  GLU  75           HG1      GLU  75  -4.191 -14.742   3.571
  563    H    ASN  76           HN       ASN  76  -2.631 -14.204   5.578
  564    HA   ASN  76           HA       ASN  76  -4.895 -14.832   7.247
  565    HB2  ASN  76           HB2      ASN  76  -2.137 -16.085   7.133
  566    HB3  ASN  76           HB1      ASN  76  -3.537 -16.751   7.970
  567   HD21  ASN  76          HD21      ASN  76  -2.018 -16.222   4.886
  568   HD22  ASN  76          HD22      ASN  76  -3.088 -17.208   3.954
  569    H    GLY  77           HN       GLY  77  -2.255 -12.771   7.482
  570    HA2  GLY  77           HA2      GLY  77  -1.917 -11.346   9.360
  571    HA3  GLY  77           HA1      GLY  77  -2.550 -12.615  10.402
  572    H    THR  78           HN       THR  78  -0.706 -14.326   8.486
  573    HA   THR  78           HA       THR  78   1.310 -14.664  10.460
  574    HB   THR  78           HB       THR  78   1.239 -15.896   7.714
  575    HG1  THR  78           HG1      THR  78   0.168 -17.337   9.814
  576   HG21  THR  78          HG21      THR  78   3.299 -16.278   8.967
  577   HG22  THR  78          HG22      THR  78   2.370 -17.768   8.832
  578   HG23  THR  78          HG23      THR  78   2.366 -16.866  10.345
  579    H    ARG  79           HN       ARG  79   2.946 -13.270  10.646
  580    HA   ARG  79           HA       ARG  79   3.983 -11.825   8.404
  581    HB2  ARG  79           HB2      ARG  79   4.911 -12.097  11.246
  582    HB3  ARG  79           HB1      ARG  79   5.787 -11.152  10.043
  583    HG2  ARG  79           HG2      ARG  79   3.391 -10.115   9.646
  584    HG3  ARG  79           HG1      ARG  79   3.158 -10.639  11.315
  585    HD2  ARG  79           HD2      ARG  79   5.036  -9.357  12.050
  586    HD3  ARG  79           HD1      ARG  79   5.490  -8.975  10.385
  587    HE   ARG  79           HE       ARG  79   2.930  -7.999  10.706
  588   HH11  ARG  79          HH11      ARG  79   6.014  -7.529  12.266
  589   HH12  ARG  79          HH12      ARG  79   5.727  -5.861  12.660
  590   HH21  ARG  79          HH21      ARG  79   2.534  -5.772  11.208
  591   HH22  ARG  79          HH22      ARG  79   3.756  -4.849  12.022
  592    H    VAL  80           HN       VAL  80   5.311 -12.473   6.964
  593    HA   VAL  80           HA       VAL  80   6.561 -15.091   7.311
  594    HB   VAL  80           HB       VAL  80   6.721 -15.054   4.838
  595   HG11  VAL  80          HG11      VAL  80   3.974 -14.552   5.940
  596   HG12  VAL  80          HG12      VAL  80   4.835 -16.092   5.988
  597   HG13  VAL  80          HG13      VAL  80   4.354 -15.397   4.438
  598   HG21  VAL  80          HG21      VAL  80   5.159 -12.496   5.092
  599   HG22  VAL  80          HG22      VAL  80   5.486 -13.361   3.590
  600   HG23  VAL  80          HG23      VAL  80   6.815 -12.645   4.503
  601    H    GLN  81           HN       GLN  81   7.386 -11.865   7.331
  602    HA   GLN  81           HA       GLN  81  10.195 -12.416   7.235
  603    HB2  GLN  81           HB2      GLN  81  10.696 -10.872   5.376
  604    HB3  GLN  81           HB1      GLN  81   9.757 -12.255   4.840
  605    HG2  GLN  81           HG2      GLN  81   7.726 -10.880   4.877
  606    HG3  GLN  81           HG1      GLN  81   8.704  -9.487   5.356
  607   HE21  GLN  81          HE21      GLN  81   7.769 -11.594   2.794
  608   HE22  GLN  81          HE22      GLN  81   8.533 -10.707   1.519
  609    H    GLU  82           HN       GLU  82  11.345 -10.853   8.318
  610    HA   GLU  82           HA       GLU  82  10.063  -8.312   8.900
  611    HB2  GLU  82           HB2      GLU  82   9.323  -9.777  10.732
  612    HB3  GLU  82           HB1      GLU  82  10.991 -10.196  11.079
  613    HG2  GLU  82           HG2      GLU  82  11.468  -8.155  12.001
  614    HG3  GLU  82           HG1      GLU  82  10.158  -7.346  11.142
  615    H    GLU  83           HN       GLU  83  11.528  -7.021   8.104
  616    HA   GLU  83           HA       GLU  83  14.368  -7.579   8.627
  617    HB2  GLU  83           HB2      GLU  83  13.318  -6.065   6.232
  618    HB3  GLU  83           HB1      GLU  83  14.912  -6.778   6.452
  619    HG2  GLU  83           HG2      GLU  83  12.366  -8.355   6.194
  620    HG3  GLU  83           HG1      GLU  83  13.433  -7.963   4.848
  621    HA   PRO  84           HA       PRO  84  13.879  -3.726  10.768
  622    HB2  PRO  84           HB2      PRO  84  16.424  -3.554  11.716
  623    HB3  PRO  84           HB1      PRO  84  15.197  -4.605  12.430
  624    HG2  PRO  84           HG2      PRO  84  17.400  -5.289  10.523
  625    HG3  PRO  84           HG1      PRO  84  16.830  -6.182  11.945
  626    HD2  PRO  84           HD2      PRO  84  16.125  -6.864   9.418
  627    HD3  PRO  84           HD1      PRO  84  15.058  -7.114  10.811
  628    H    GLU  85           HN       GLU  85  15.962  -4.340   8.115
  629    HA   GLU  85           HA       GLU  85  15.846  -1.628   7.307
  630    HB2  GLU  85           HB2      GLU  85  17.621  -1.486   9.053
  631    HB3  GLU  85           HB1      GLU  85  18.578  -2.625   8.118
  632    HG2  GLU  85           HG2      GLU  85  18.964  -1.107   6.417
  633    HG3  GLU  85           HG1      GLU  85  17.622  -0.070   6.904
  634    H    LEU  86           HN       LEU  86  15.438  -1.859   5.367
  635    HA   LEU  86           HA       LEU  86  17.184  -3.478   3.654
  636    HB2  LEU  86           HB2      LEU  86  14.972  -4.449   3.674
  637    HB3  LEU  86           HB1      LEU  86  14.232  -2.882   3.441
  638    HG   LEU  86           HG       LEU  86  15.301  -2.770   1.214
  639   HD11  LEU  86          HD11      LEU  86  15.961  -5.665   1.718
  640   HD12  LEU  86          HD12      LEU  86  17.132  -4.346   1.646
  641   HD13  LEU  86          HD13      LEU  86  16.205  -4.784   0.209
  642   HD21  LEU  86          HD21      LEU  86  12.991  -3.421   1.401
  643   HD22  LEU  86          HD22      LEU  86  13.454  -5.087   1.751
  644   HD23  LEU  86          HD23      LEU  86  13.768  -4.403   0.157
  645    H    VAL  87           HN       VAL  87  18.491  -2.067   2.617
  646    HA   VAL  87           HA       VAL  87  17.368   0.547   1.872
  647    HB   VAL  87           HB       VAL  87  19.427   0.626   3.214
  648   HG11  VAL  87          HG11      VAL  87  20.464  -1.449   2.497
  649   HG12  VAL  87          HG12      VAL  87  21.565  -0.084   2.292
  650   HG13  VAL  87          HG13      VAL  87  20.735  -0.768   0.892
  651   HG21  VAL  87          HG21      VAL  87  20.708   2.144   1.775
  652   HG22  VAL  87          HG22      VAL  87  18.971   2.442   1.689
  653   HG23  VAL  87          HG23      VAL  87  19.783   1.579   0.382
  654    H    PHE  88           HN       PHE  88  17.035   1.044  -0.219
  655    HA   PHE  88           HA       PHE  88  18.146  -0.631  -2.345
  656    HB2  PHE  88           HB2      PHE  88  16.009  -1.304  -3.196
  657    HB3  PHE  88           HB1      PHE  88  16.133  -1.807  -1.517
  658    HD1  PHE  88           HD2      PHE  88  14.856  -0.646   0.220
  659    HD2  PHE  88           HD1      PHE  88  14.389   0.268  -3.907
  660    HE1  PHE  88           HE2      PHE  88  12.731   0.474   0.719
  661    HE2  PHE  88           HE1      PHE  88  12.260   1.391  -3.429
  662    HZ   PHE  88           HZ       PHE  88  11.415   1.486  -1.122
  663    H    THR  89           HN       THR  89  17.688   0.136  -4.468
  664    HA   THR  89           HA       THR  89  17.679   3.011  -4.656
  665    HB   THR  89           HB       THR  89  17.462   1.177  -7.027
  666    HG1  THR  89           HG1      THR  89  19.050   0.192  -5.763
  667   HG21  THR  89          HG21      THR  89  19.008   3.720  -6.487
  668   HG22  THR  89          HG22      THR  89  17.514   3.590  -7.418
  669   HG23  THR  89          HG23      THR  89  18.993   2.835  -8.012
  670    H    LEU  90           HN       LEU  90  15.780   4.047  -4.425
  671    HA   LEU  90           HA       LEU  90  13.230   2.998  -4.944
  672    HB2  LEU  90           HB2      LEU  90  13.919   5.076  -3.596
  673    HB3  LEU  90           HB1      LEU  90  13.935   5.905  -5.113
  674    HG   LEU  90           HG       LEU  90  11.587   5.475  -5.457
  675   HD11  LEU  90          HD11      LEU  90  11.474   3.295  -4.391
  676   HD12  LEU  90          HD12      LEU  90  10.250   4.382  -3.742
  677   HD13  LEU  90          HD13      LEU  90  11.709   4.043  -2.811
  678   HD21  LEU  90          HD21      LEU  90  10.699   6.867  -3.687
  679   HD22  LEU  90          HD22      LEU  90  12.289   7.456  -4.168
  680   HD23  LEU  90          HD23      LEU  90  12.106   6.529  -2.678
  681    H    GLY  91           HN       GLY  91  12.172   2.649  -6.820
  682    HA2  GLY  91           HA2      GLY  91  11.330   3.204  -8.915
  683    HA3  GLY  91           HA1      GLY  91  12.489   4.514  -9.023
  684    H    ASP  92           HN       ASP  92  13.920   1.605  -8.097
  685    HA   ASP  92           HA       ASP  92  14.731   1.105 -10.884
  686    HB2  ASP  92           HB2      ASP  92  16.565   1.990  -9.404
  687    HB3  ASP  92           HB1      ASP  92  16.374   0.545  -8.410
  688    H    CYS  93           HN       CYS  93  12.625   0.059  -8.891
  689    HA   CYS  93           HA       CYS  93  11.681  -1.916  -8.272
  690    HB2  CYS  93           HB2      CYS  93  13.121  -3.014 -10.695
  691    HB3  CYS  93           HB1      CYS  93  11.694  -3.696  -9.910
  692    HG   CYS  93           HG       CYS  93  11.921  -1.183 -12.123
  693    H    ASP  94           HN       ASP  94  14.067  -1.241  -6.998
  694    HA   ASP  94           HA       ASP  94  15.883  -3.420  -6.909
  695    HB2  ASP  94           HB2      ASP  94  16.105  -0.904  -6.146
  696    HB3  ASP  94           HB1      ASP  94  15.464  -1.519  -4.629
  697    H    VAL  95           HN       VAL  95  12.789  -2.918  -5.916
  698    HA   VAL  95           HA       VAL  95  12.783  -5.106  -3.958
  699    HB   VAL  95           HB       VAL  95  11.074  -3.752  -2.661
  700   HG11  VAL  95          HG11      VAL  95  12.759  -2.447  -1.476
  701   HG12  VAL  95          HG12      VAL  95  13.869  -2.655  -2.832
  702   HG13  VAL  95          HG13      VAL  95  13.364  -4.054  -1.883
  703   HG21  VAL  95          HG21      VAL  95  10.526  -2.120  -4.364
  704   HG22  VAL  95          HG22      VAL  95  12.192  -1.539  -4.386
  705   HG23  VAL  95          HG23      VAL  95  11.189  -1.299  -2.951
  706    H    ILE  96           HN       ILE  96  10.047  -4.851  -3.342
  707    HA   ILE  96           HA       ILE  96   8.808  -5.833  -5.739
  708    HB   ILE  96           HB       ILE  96   6.789  -6.084  -4.320
  709   HG12  ILE  96          HG12      ILE  96   8.571  -5.049  -2.102
  710   HG13  ILE  96          HG11      ILE  96   7.222  -4.169  -2.812
  711   HG21  ILE  96          HG21      ILE  96   9.319  -7.231  -3.147
  712   HG22  ILE  96          HG22      ILE  96   8.385  -7.906  -4.482
  713   HG23  ILE  96          HG23      ILE  96   7.691  -7.843  -2.863
  714   HD11  ILE  96          HD11      ILE  96   5.671  -5.853  -1.992
  715   HD12  ILE  96          HD12      ILE  96   6.630  -5.179  -0.672
  716   HD13  ILE  96          HD13      ILE  96   7.017  -6.771  -1.319
  717    H    GLN  97           HN       GLN  97   7.231  -4.760  -6.875
  718    HA   GLN  97           HA       GLN  97   7.673  -2.016  -7.145
  719    HB2  GLN  97           HB2      GLN  97   6.670  -3.731  -8.842
  720    HB3  GLN  97           HB1      GLN  97   5.130  -3.231  -8.147
  721    HG2  GLN  97           HG2      GLN  97   5.405  -1.822  -9.974
  722    HG3  GLN  97           HG1      GLN  97   5.907  -0.849  -8.591
  723   HE21  GLN  97          HE21      GLN  97   8.179  -0.479  -8.259
  724   HE22  GLN  97          HE22      GLN  97   9.274  -0.592  -9.592
  725    H    ALA  98           HN       ALA  98   5.238  -3.780  -5.339
  726    HA   ALA  98           HA       ALA  98   3.474  -1.750  -4.634
  727    HB1  ALA  98           HB1      ALA  98   3.132  -3.024  -2.542
  728    HB2  ALA  98           HB2      ALA  98   4.538  -4.010  -2.943
  729    HB3  ALA  98           HB3      ALA  98   3.109  -4.048  -3.975
  730    H    LEU  99           HN       LEU  99   6.623  -2.570  -3.297
  731    HA   LEU  99           HA       LEU  99   6.505  -0.579  -1.231
  732    HB2  LEU  99           HB2      LEU  99   7.783  -2.653  -0.925
  733    HB3  LEU  99           HB1      LEU  99   8.854  -2.165  -2.235
  734    HG   LEU  99           HG       LEU  99   9.591  -0.221  -0.928
  735   HD11  LEU  99          HD11      LEU  99   7.564   0.201   0.335
  736   HD12  LEU  99          HD12      LEU  99   8.937   0.009   1.426
  737   HD13  LEU  99          HD13      LEU  99   7.780  -1.306   1.223
  738   HD21  LEU  99          HD21      LEU  99  10.806  -2.333  -0.715
  739   HD22  LEU  99          HD22      LEU  99   9.778  -2.781   0.646
  740   HD23  LEU  99          HD23      LEU  99  10.853  -1.388   0.775
  741    H    ASP 100           HN       ASP 100   8.017  -0.938  -4.356
  742    HA   ASP 100           HA       ASP 100   9.805   1.218  -4.243
  743    HB2  ASP 100           HB2      ASP 100   9.951  -0.600  -5.881
  744    HB3  ASP 100           HB1      ASP 100   8.453  -0.074  -6.624
  745    H    LEU 101           HN       LEU 101   6.427   0.994  -5.001
  746    HA   LEU 101           HA       LEU 101   6.267   3.769  -5.791
  747    HB2  LEU 101           HB2      LEU 101   4.107   1.708  -5.368
  748    HB3  LEU 101           HB1      LEU 101   3.908   3.260  -6.123
  749    HG   LEU 101           HG       LEU 101   5.545   0.973  -7.197
  750   HD11  LEU 101          HD11      LEU 101   3.870   0.868  -8.952
  751   HD12  LEU 101          HD12      LEU 101   2.965   2.177  -8.188
  752   HD13  LEU 101          HD13      LEU 101   3.138   0.623  -7.369
  753   HD21  LEU 101          HD21      LEU 101   5.821   2.352  -9.198
  754   HD22  LEU 101          HD22      LEU 101   6.572   3.084  -7.782
  755   HD23  LEU 101          HD23      LEU 101   5.029   3.699  -8.376
  756    H    SER 102           HN       SER 102   5.604   1.787  -2.980
  757    HA   SER 102           HA       SER 102   3.816   3.543  -1.690
  758    HB2  SER 102           HB2      SER 102   3.916   1.203  -1.061
  759    HB3  SER 102           HB1      SER 102   5.602   1.371  -0.576
  760    HG   SER 102           HG       SER 102   4.880   2.842   1.047
  761    H    VAL 103           HN       VAL 103   7.294   3.258  -1.758
  762    HA   VAL 103           HA       VAL 103   7.873   4.772   0.526
  763    HB   VAL 103           HB       VAL 103   9.472   4.180  -1.926
  764   HG11  VAL 103          HG11      VAL 103  10.426   5.500   0.635
  765   HG12  VAL 103          HG12      VAL 103  10.310   6.281  -0.943
  766   HG13  VAL 103          HG13      VAL 103  11.459   4.966  -0.692
  767   HG21  VAL 103          HG21      VAL 103   9.204   2.211  -0.744
  768   HG22  VAL 103          HG22      VAL 103   9.218   3.029   0.817
  769   HG23  VAL 103          HG23      VAL 103  10.719   2.831  -0.082
  770    HA   PRO 104           HA       PRO 104   8.403   8.652  -2.345
  771    HB2  PRO 104           HB2      PRO 104   7.068   8.463  -4.756
  772    HB3  PRO 104           HB1      PRO 104   8.806   8.229  -4.546
  773    HG2  PRO 104           HG2      PRO 104   6.637   6.187  -4.752
  774    HG3  PRO 104           HG1      PRO 104   8.271   6.165  -5.434
  775    HD2  PRO 104           HD2      PRO 104   7.659   4.751  -3.257
  776    HD3  PRO 104           HD1      PRO 104   9.244   5.524  -3.462
  777    H    LEU 105           HN       LEU 105   5.561   6.619  -2.311
  778    HA   LEU 105           HA       LEU 105   3.699   8.807  -2.158
  779    HB2  LEU 105           HB2      LEU 105   3.532   5.850  -1.700
  780    HB3  LEU 105           HB1      LEU 105   2.181   6.901  -1.291
  781    HG   LEU 105           HG       LEU 105   3.312   6.261  -3.993
  782   HD11  LEU 105          HD11      LEU 105   0.541   6.199  -2.837
  783   HD12  LEU 105          HD12      LEU 105   1.584   4.808  -3.132
  784   HD13  LEU 105          HD13      LEU 105   0.975   5.759  -4.490
  785   HD21  LEU 105          HD21      LEU 105   1.441   8.533  -3.341
  786   HD22  LEU 105          HD22      LEU 105   1.885   7.990  -4.958
  787   HD23  LEU 105          HD23      LEU 105   3.105   8.698  -3.901
  788    H    MET 106           HN       MET 106   5.795   7.265   0.021
  789    HA   MET 106           HA       MET 106   4.270   8.181   2.342
  790    HB2  MET 106           HB2      MET 106   5.034   6.364   3.413
  791    HB3  MET 106           HB1      MET 106   5.483   5.785   1.819
  792    HG2  MET 106           HG2      MET 106   7.714   6.978   2.253
  793    HG3  MET 106           HG1      MET 106   7.184   7.005   3.938
  794    HE1  MET 106           HE1      MET 106   6.788   3.170   4.704
  795    HE2  MET 106           HE2      MET 106   5.537   4.258   4.100
  796    HE3  MET 106           HE3      MET 106   6.654   4.804   5.350
  797    H    ASP 107           HN       ASP 107   5.412   9.263   4.093
  798    HA   ASP 107           HA       ASP 107   7.419  11.121   3.040
  799    HB2  ASP 107           HB2      ASP 107   5.671  11.172   5.499
  800    HB3  ASP 107           HB1      ASP 107   6.994  12.306   5.274
  801    H    VAL 108           HN       VAL 108   9.332  11.635   4.211
  802    HA   VAL 108           HA       VAL 108  10.789   9.433   5.184
  803    HB   VAL 108           HB       VAL 108  11.361  12.346   5.785
  804   HG11  VAL 108          HG11      VAL 108  13.164   9.933   5.678
  805   HG12  VAL 108          HG12      VAL 108  12.684  10.821   7.125
  806   HG13  VAL 108          HG13      VAL 108  13.699  11.598   5.908
  807   HG21  VAL 108          HG21      VAL 108  12.222  10.701   3.416
  808   HG22  VAL 108          HG22      VAL 108  12.761  12.337   3.792
  809   HG23  VAL 108          HG23      VAL 108  11.069  12.037   3.395
  810    H    GLY 109           HN       GLY 109  10.712   8.461   7.027
  811    HA2  GLY 109           HA2      GLY 109  10.940   8.319   9.361
  812    HA3  GLY 109           HA1      GLY 109  10.336   9.963   9.494
  813    H    GLU 110           HN       GLU 110   8.493   7.969   7.415
  814    HA   GLU 110           HA       GLU 110   6.455   7.821   9.506
  815    HB2  GLU 110           HB2      GLU 110   4.802   7.845   7.899
  816    HB3  GLU 110           HB1      GLU 110   6.003   8.948   7.247
  817    HG2  GLU 110           HG2      GLU 110   6.642   7.430   5.589
  818    HG3  GLU 110           HG1      GLU 110   5.889   6.071   6.421
  819    H    THR 111           HN       THR 111   4.947   5.950   9.369
  820    HA   THR 111           HA       THR 111   6.271   3.515   8.444
  821    HB   THR 111           HB       THR 111   4.659   3.625  10.994
  822    HG1  THR 111           HG1      THR 111   7.220   4.438  10.555
  823   HG21  THR 111          HG21      THR 111   4.832   1.440   9.883
  824   HG22  THR 111          HG22      THR 111   5.695   1.454  11.420
  825   HG23  THR 111          HG23      THR 111   6.592   1.574   9.907
  826    H    ALA 112           HN       ALA 112   5.040   2.644   6.941
  827    HA   ALA 112           HA       ALA 112   2.138   3.090   7.138
  828    HB1  ALA 112           HB1      ALA 112   2.061   3.138   4.697
  829    HB2  ALA 112           HB2      ALA 112   3.814   2.955   4.637
  830    HB3  ALA 112           HB3      ALA 112   3.103   4.410   5.334
  831    H    MET 113           HN       MET 113   0.858   1.376   6.938
  832    HA   MET 113           HA       MET 113   2.143  -1.202   6.371
  833    HB2  MET 113           HB2      MET 113   0.941  -1.366   8.410
  834    HB3  MET 113           HB1      MET 113  -0.431  -0.474   7.767
  835    HG2  MET 113           HG2      MET 113  -1.015  -2.310   6.338
  836    HG3  MET 113           HG1      MET 113   0.420  -3.202   6.833
  837    HE1  MET 113           HE1      MET 113   0.694  -3.035   9.834
  838    HE2  MET 113           HE2      MET 113   0.647  -4.565   8.959
  839    HE3  MET 113           HE3      MET 113  -0.344  -4.343  10.400
  840    H    VAL 114           HN       VAL 114   1.973  -1.906   4.394
  841    HA   VAL 114           HA       VAL 114  -0.186  -0.800   2.713
  842    HB   VAL 114           HB       VAL 114   2.380  -1.947   1.679
  843   HG11  VAL 114          HG11      VAL 114   0.461   0.062   0.541
  844   HG12  VAL 114          HG12      VAL 114   0.636  -1.624   0.049
  845   HG13  VAL 114          HG13      VAL 114   1.951  -0.482  -0.234
  846   HG21  VAL 114          HG21      VAL 114   3.318   0.323   1.613
  847   HG22  VAL 114          HG22      VAL 114   3.057  -0.278   3.250
  848   HG23  VAL 114          HG23      VAL 114   1.931   0.882   2.551
  849    H    THR 115           HN       THR 115  -1.600  -2.260   1.936
  850    HA   THR 115           HA       THR 115  -0.694  -5.036   2.010
  851    HB   THR 115           HB       THR 115  -3.566  -4.110   1.942
  852    HG1  THR 115           HG1      THR 115  -1.901  -4.087   3.953
  853   HG21  THR 115          HG21      THR 115  -2.438  -6.803   2.585
  854   HG22  THR 115          HG22      THR 115  -2.899  -6.339   0.938
  855   HG23  THR 115          HG23      THR 115  -4.116  -6.374   2.217
  856    H    ALA 116           HN       ALA 116  -0.089  -5.766   0.253
  857    HA   ALA 116           HA       ALA 116  -1.206  -4.786  -2.288
  858    HB1  ALA 116           HB1      ALA 116   1.078  -3.963  -1.881
  859    HB2  ALA 116           HB2      ALA 116   0.974  -5.022  -3.287
  860    HB3  ALA 116           HB3      ALA 116   1.631  -5.632  -1.769
  861    H    ASP 117           HN       ASP 117  -1.920  -6.315  -3.652
  862    HA   ASP 117           HA       ASP 117  -2.147  -9.003  -3.055
  863    HB2  ASP 117           HB2      ASP 117  -3.259  -7.768  -4.985
  864    HB3  ASP 117           HB1      ASP 117  -1.741  -7.940  -5.828
  865    H    SER 118           HN       SER 118  -0.942 -10.825  -3.670
  866    HA   SER 118           HA       SER 118   1.797 -10.682  -3.272
  867    HB2  SER 118           HB2      SER 118   0.104 -12.681  -3.211
  868    HB3  SER 118           HB1      SER 118   0.594 -12.893  -4.897
  869    HG   SER 118           HG       SER 118   1.833 -14.072  -3.228
  870    H    LYS 119           HN       LYS 119  -0.074 -10.386  -6.184
  871    HA   LYS 119           HA       LYS 119   1.825 -10.754  -8.155
  872    HB2  LYS 119           HB2      LYS 119   0.480  -9.075  -9.446
  873    HB3  LYS 119           HB1      LYS 119  -0.459 -10.391  -8.733
  874    HG2  LYS 119           HG2      LYS 119  -1.208  -8.947  -6.978
  875    HG3  LYS 119           HG1      LYS 119  -0.120  -7.665  -7.510
  876    HD2  LYS 119           HD2      LYS 119  -2.304  -7.120  -8.265
  877    HD3  LYS 119           HD1      LYS 119  -1.369  -7.615  -9.675
  878    HE2  LYS 119           HE2      LYS 119  -2.362  -9.914  -9.369
  879    HE3  LYS 119           HE1      LYS 119  -3.444  -9.194  -8.177
  880    HZ1  LYS 119           HZ1      LYS 119  -4.691  -9.055 -10.094
  881    HZ2  LYS 119           HZ2      LYS 119  -3.350  -8.746 -11.084
  882    HZ3  LYS 119           HZ3      LYS 119  -3.951  -7.525 -10.072
  883    H    TYR 120           HN       TYR 120   1.345  -7.920  -6.041
  884    HA   TYR 120           HA       TYR 120   3.590  -6.573  -7.359
  885    HB2  TYR 120           HB2      TYR 120   1.738  -5.617  -5.159
  886    HB3  TYR 120           HB1      TYR 120   3.040  -4.664  -5.869
  887    HD1  TYR 120           HD1      TYR 120   2.886  -3.905  -8.186
  888    HD2  TYR 120           HD2      TYR 120  -0.338  -5.915  -6.280
  889    HE1  TYR 120           HE1      TYR 120   1.367  -3.079  -9.915
  890    HE2  TYR 120           HE2      TYR 120  -1.876  -5.095  -8.019
  891    HH   TYR 120           HH       TYR 120  -1.977  -3.186  -9.640
  892    H    CYS 121           HN       CYS 121   3.284  -8.898  -5.238
  893    HA   CYS 121           HA       CYS 121   5.493  -7.978  -3.529
  894    HB2  CYS 121           HB2      CYS 121   3.276  -9.906  -2.835
  895    HB3  CYS 121           HB1      CYS 121   4.607  -9.453  -1.773
  896    HG   CYS 121           HG       CYS 121   1.704  -8.000  -2.164
  897    H    TYR 122           HN       TYR 122   4.243 -11.291  -3.588
  898    HA   TYR 122           HA       TYR 122   6.431 -12.100  -5.346
  899    HB2  TYR 122           HB2      TYR 122   6.082 -13.545  -2.724
  900    HB3  TYR 122           HB1      TYR 122   7.416 -13.620  -3.858
  901    HD1  TYR 122           HD2      TYR 122   9.079 -11.813  -3.958
  902    HD2  TYR 122           HD1      TYR 122   5.978 -11.811  -1.033
  903    HE1  TYR 122           HE2      TYR 122  10.319 -10.153  -2.636
  904    HE2  TYR 122           HE1      TYR 122   7.202 -10.150   0.270
  905    HH   TYR 122           HH       TYR 122   9.842  -8.428  -0.930
  906    H    GLY 123           HN       GLY 123   3.563 -12.161  -5.832
  907    HA2  GLY 123           HA2      GLY 123   2.311 -14.576  -5.416
  908    HA3  GLY 123           HA1      GLY 123   2.119 -13.617  -6.874
  909    HA   PRO 124           HA       PRO 124   4.231 -16.945  -8.957
  910    HB2  PRO 124           HB2      PRO 124   4.998 -15.249 -11.143
  911    HB3  PRO 124           HB1      PRO 124   3.650 -16.384 -11.074
  912    HG2  PRO 124           HG2      PRO 124   3.377 -13.643 -11.216
  913    HG3  PRO 124           HG1      PRO 124   2.143 -14.749 -10.587
  914    HD2  PRO 124           HD2      PRO 124   4.108 -13.054  -9.096
  915    HD3  PRO 124           HD1      PRO 124   2.412 -13.422  -8.711
  916    H    GLN 125           HN       GLN 125   5.660 -14.681  -7.298
  917    HA   GLN 125           HA       GLN 125   8.315 -14.844  -8.554
  918    HB2  GLN 125           HB2      GLN 125   7.347 -12.931  -6.423
  919    HB3  GLN 125           HB1      GLN 125   8.859 -12.840  -7.322
  920    HG2  GLN 125           HG2      GLN 125   7.684 -12.403  -9.363
  921    HG3  GLN 125           HG1      GLN 125   6.130 -12.647  -8.569
  922   HE21  GLN 125          HE21      GLN 125   5.316 -11.045  -7.246
  923   HE22  GLN 125          HE22      GLN 125   5.976  -9.455  -7.170
  924    H    GLY 126           HN       GLY 126   6.654 -14.967  -5.454
  925    HA2  GLY 126           HA2      GLY 126   7.024 -16.263  -3.616
  926    HA3  GLY 126           HA1      GLY 126   8.368 -17.029  -4.451
  927    H    SER 127           HN       SER 127   7.984 -15.886  -1.731
  928    HA   SER 127           HA       SER 127   9.829 -13.684  -1.705
  929    HB2  SER 127           HB2      SER 127   7.944 -13.290  -0.319
  930    HB3  SER 127           HB1      SER 127   8.030 -14.885   0.381
  931    HG   SER 127           HG       SER 127   9.300 -12.566   1.107
  932    H    ARG 128           HN       ARG 128  11.498 -13.630   0.055
  933    HA   ARG 128           HA       ARG 128  13.473 -15.485  -0.496
  934    HB2  ARG 128           HB2      ARG 128  13.075 -13.401   1.587
  935    HB3  ARG 128           HB1      ARG 128  14.377 -14.557   1.822
  936    HG2  ARG 128           HG2      ARG 128  14.038 -12.879  -0.651
  937    HG3  ARG 128           HG1      ARG 128  15.061 -12.440   0.717
  938    HD2  ARG 128           HD2      ARG 128  16.497 -13.458  -0.872
  939    HD3  ARG 128           HD1      ARG 128  16.225 -14.657   0.398
  940    HE   ARG 128           HE       ARG 128  14.758 -15.825  -1.085
  941   HH11  ARG 128          HH11      ARG 128  16.628 -13.266  -2.578
  942   HH12  ARG 128          HH12      ARG 128  16.423 -13.883  -4.189
  943   HH21  ARG 128          HH21      ARG 128  14.457 -16.630  -3.187
  944   HH22  ARG 128          HH22      ARG 128  15.184 -15.798  -4.538
  945    H    SER 129           HN       SER 129  11.709 -15.175   2.583
  946    HA   SER 129           HA       SER 129  12.777 -17.679   3.465
  947    HB2  SER 129           HB2      SER 129  12.331 -15.769   5.006
  948    HB3  SER 129           HB1      SER 129  10.603 -16.030   4.762
  949    HG   SER 129           HG       SER 129  10.769 -17.430   6.310
  950    HA   PRO 130           HA       PRO 130   8.678 -19.417   2.098
  951    HB2  PRO 130           HB2      PRO 130   6.395 -17.875   2.292
  952    HB3  PRO 130           HB1      PRO 130   7.081 -18.791   3.633
  953    HG2  PRO 130           HG2      PRO 130   6.872 -15.968   3.425
  954    HG3  PRO 130           HG1      PRO 130   7.727 -16.882   4.677
  955    HD2  PRO 130           HD2      PRO 130   8.798 -15.646   2.165
  956    HD3  PRO 130           HD1      PRO 130   9.548 -15.765   3.765
  957    H    TYR 131           HN       TYR 131   8.732 -19.675  -0.161
  958    HA   TYR 131           HA       TYR 131   8.144 -17.744  -2.056
  959    HB2  TYR 131           HB2      TYR 131   8.847 -20.009  -2.705
  960    HB3  TYR 131           HB1      TYR 131   7.347 -20.676  -2.070
  961    HD1  TYR 131           HD1      TYR 131   5.198 -20.213  -3.243
  962    HD2  TYR 131           HD2      TYR 131   8.935 -19.004  -4.870
  963    HE1  TYR 131           HE1      TYR 131   4.150 -19.947  -5.453
  964    HE2  TYR 131           HE2      TYR 131   7.898 -18.736  -7.078
  965    HH   TYR 131           HH       TYR 131   5.910 -19.690  -8.282
  966    H    ILE 132           HN       ILE 132   6.571 -16.322  -1.566
  967    HA   ILE 132           HA       ILE 132   4.201 -16.954  -0.207
  968    HB   ILE 132           HB       ILE 132   4.729 -14.580  -1.997
  969   HG12  ILE 132          HG12      ILE 132   6.440 -14.558  -0.367
  970   HG13  ILE 132          HG11      ILE 132   5.235 -13.384   0.155
  971   HG21  ILE 132          HG21      ILE 132   2.770 -14.956   0.258
  972   HG22  ILE 132          HG22      ILE 132   2.376 -14.914  -1.463
  973   HG23  ILE 132          HG23      ILE 132   3.008 -13.472  -0.668
  974   HD11  ILE 132          HD11      ILE 132   4.402 -14.922   1.798
  975   HD12  ILE 132          HD12      ILE 132   6.145 -14.692   1.979
  976   HD13  ILE 132          HD13      ILE 132   5.518 -16.168   1.237
  977    HA   PRO 133           HA       PRO 133   1.845 -18.919  -3.454
  978    HB2  PRO 133           HB2      PRO 133  -0.413 -17.826  -1.841
  979    HB3  PRO 133           HB1      PRO 133  -0.139 -19.475  -2.418
  980    HG2  PRO 133           HG2      PRO 133   0.257 -18.852   0.138
  981    HG3  PRO 133           HG1      PRO 133   1.351 -19.966  -0.706
  982    HD2  PRO 133           HD2      PRO 133   1.761 -17.098   0.029
  983    HD3  PRO 133           HD1      PRO 133   2.924 -18.439   0.019
  984    HA   PRO 134           HA       PRO 134   0.971 -15.500  -6.162
  985    HB2  PRO 134           HB2      PRO 134  -0.954 -17.380  -7.410
  986    HB3  PRO 134           HB1      PRO 134   0.371 -16.460  -8.144
  987    HG2  PRO 134           HG2      PRO 134   0.590 -19.095  -7.723
  988    HG3  PRO 134           HG1      PRO 134   1.974 -18.009  -7.491
  989    HD2  PRO 134           HD2      PRO 134   0.199 -19.283  -5.443
  990    HD3  PRO 134           HD1      PRO 134   1.950 -18.989  -5.394
  991    H    HIS 135           HN       HIS 135  -0.310 -13.887  -5.883
  992    HA   HIS 135           HA       HIS 135  -2.141 -12.593  -5.583
  993    HB2  HIS 135           HB2      HIS 135  -3.436 -15.180  -6.176
  994    HB3  HIS 135           HB1      HIS 135  -4.417 -14.015  -5.296
  995    HD1  HIS 135           HD1      HIS 135  -4.425 -11.520  -6.525
  996    HD2  HIS 135           HD2      HIS 135  -3.563 -14.873  -8.838
  997    HE1  HIS 135           HE1      HIS 135  -4.894 -10.852  -8.904
  998    HE2  HIS 135           HE2      HIS 135  -4.128 -12.808 -10.290
  999    H    ALA 136           HN       ALA 136  -0.874 -14.527  -3.328
 1000    HA   ALA 136           HA       ALA 136  -2.768 -14.262  -1.224
 1001    HB1  ALA 136           HB1      ALA 136   0.239 -14.496  -1.063
 1002    HB2  ALA 136           HB2      ALA 136  -0.897 -15.843  -1.087
 1003    HB3  ALA 136           HB3      ALA 136  -0.888 -14.723   0.274
 1004    H    ALA 137           HN       ALA 137  -3.377 -12.447  -0.199
 1005    HA   ALA 137           HA       ALA 137  -2.230  -9.960  -1.059
 1006    HB1  ALA 137           HB1      ALA 137  -4.620 -10.108  -0.663
 1007    HB2  ALA 137           HB2      ALA 137  -3.907  -8.926   0.437
 1008    HB3  ALA 137           HB3      ALA 137  -4.343 -10.529   1.027
 1009    H    LEU 138           HN       LEU 138  -0.414  -9.206  -0.272
 1010    HA   LEU 138           HA       LEU 138   0.525 -10.039   2.338
 1011    HB2  LEU 138           HB2      LEU 138   1.724  -9.134  -0.130
 1012    HB3  LEU 138           HB1      LEU 138   2.366  -8.259   1.246
 1013    HG   LEU 138           HG       LEU 138   3.005 -10.358   2.305
 1014   HD11  LEU 138          HD11      LEU 138   2.749 -12.473   1.123
 1015   HD12  LEU 138          HD12      LEU 138   1.850 -11.640  -0.147
 1016   HD13  LEU 138          HD13      LEU 138   1.194 -11.725   1.488
 1017   HD21  LEU 138          HD21      LEU 138   4.742 -11.068   0.747
 1018   HD22  LEU 138          HD22      LEU 138   4.607  -9.308   0.803
 1019   HD23  LEU 138          HD23      LEU 138   3.923 -10.205  -0.555
 1020    H    CYS 139           HN       CYS 139   0.409  -8.790   4.103
 1021    HA   CYS 139           HA       CYS 139  -0.060  -5.909   3.709
 1022    HB2  CYS 139           HB2      CYS 139  -0.655  -7.537   6.165
 1023    HB3  CYS 139           HB1      CYS 139  -1.109  -5.873   5.897
 1024    HG   CYS 139           HG       CYS 139  -3.100  -6.372   4.154
 1025    H    LEU 140           HN       LEU 140   1.941  -5.081   3.682
 1026    HA   LEU 140           HA       LEU 140   3.873  -6.032   5.680
 1027    HB2  LEU 140           HB2      LEU 140   5.582  -5.094   4.154
 1028    HB3  LEU 140           HB1      LEU 140   4.670  -6.432   3.482
 1029    HG   LEU 140           HG       LEU 140   3.393  -3.994   2.729
 1030   HD11  LEU 140          HD11      LEU 140   5.195  -2.951   1.462
 1031   HD12  LEU 140          HD12      LEU 140   6.341  -4.112   2.133
 1032   HD13  LEU 140          HD13      LEU 140   5.552  -2.945   3.193
 1033   HD21  LEU 140          HD21      LEU 140   4.980  -6.030   1.162
 1034   HD22  LEU 140          HD22      LEU 140   3.897  -4.822   0.469
 1035   HD23  LEU 140          HD23      LEU 140   3.251  -6.096   1.505
 1036    H    GLU 141           HN       GLU 141   4.798  -4.669   7.084
 1037    HA   GLU 141           HA       GLU 141   3.830  -1.897   7.060
 1038    HB2  GLU 141           HB2      GLU 141   3.245  -3.223   9.018
 1039    HB3  GLU 141           HB1      GLU 141   4.926  -3.655   9.264
 1040    HG2  GLU 141           HG2      GLU 141   5.466  -1.362   9.832
 1041    HG3  GLU 141           HG1      GLU 141   3.798  -0.873   9.495
 1042    H    VAL 142           HN       VAL 142   5.255  -0.420   6.333
 1043    HA   VAL 142           HA       VAL 142   8.108  -1.091   6.536
 1044    HB   VAL 142           HB       VAL 142   8.376   0.464   4.529
 1045   HG11  VAL 142          HG11      VAL 142   6.968  -2.187   4.243
 1046   HG12  VAL 142          HG12      VAL 142   8.708  -1.923   4.383
 1047   HG13  VAL 142          HG13      VAL 142   7.839  -1.356   2.955
 1048   HG21  VAL 142          HG21      VAL 142   6.458   0.681   3.056
 1049   HG22  VAL 142          HG22      VAL 142   6.107   1.436   4.611
 1050   HG23  VAL 142          HG23      VAL 142   5.433  -0.149   4.227
 1051    H    THR 143           HN       THR 143   9.156   0.072   7.927
 1052    HA   THR 143           HA       THR 143   8.473   2.833   8.548
 1053    HB   THR 143           HB       THR 143  10.948   1.365   9.481
 1054    HG1  THR 143           HG1      THR 143   9.039   1.138  11.327
 1055   HG21  THR 143          HG21      THR 143   9.207   3.494  10.747
 1056   HG22  THR 143          HG22      THR 143  10.794   3.734  10.017
 1057   HG23  THR 143          HG23      THR 143  10.636   2.765  11.483
 1058    H    LEU 144           HN       LEU 144   9.095   4.292   7.015
 1059    HA   LEU 144           HA       LEU 144  11.636   4.001   5.640
 1060    HB2  LEU 144           HB2      LEU 144   9.708   5.002   4.476
 1061    HB3  LEU 144           HB1      LEU 144   9.666   6.297   5.660
 1062    HG   LEU 144           HG       LEU 144  11.919   7.015   4.914
 1063   HD11  LEU 144          HD11      LEU 144  12.821   6.109   2.825
 1064   HD12  LEU 144          HD12      LEU 144  11.528   4.911   2.785
 1065   HD13  LEU 144          HD13      LEU 144  12.728   4.869   4.076
 1066   HD21  LEU 144          HD21      LEU 144  11.199   7.989   2.817
 1067   HD22  LEU 144          HD22      LEU 144   9.879   8.021   3.988
 1068   HD23  LEU 144          HD23      LEU 144   9.889   6.816   2.699
 1069    H    LYS 145           HN       LYS 145  13.299   4.182   6.944
 1070    HA   LYS 145           HA       LYS 145  13.145   6.032   9.199
 1071    HB2  LYS 145           HB2      LYS 145  15.333   4.031   8.667
 1072    HB3  LYS 145           HB1      LYS 145  14.865   4.758  10.195
 1073    HG2  LYS 145           HG2      LYS 145  12.805   3.502  10.212
 1074    HG3  LYS 145           HG1      LYS 145  13.189   2.821   8.629
 1075    HD2  LYS 145           HD2      LYS 145  14.833   2.436  11.135
 1076    HD3  LYS 145           HD1      LYS 145  13.681   1.261  10.480
 1077    HE2  LYS 145           HE2      LYS 145  14.967   0.915   8.556
 1078    HE3  LYS 145           HE1      LYS 145  15.982   2.330   8.859
 1079    HZ1  LYS 145           HZ1      LYS 145  16.626   1.056  11.001
 1080    HZ2  LYS 145           HZ2      LYS 145  17.329   0.602   9.530
 1081    HZ3  LYS 145           HZ3      LYS 145  16.044  -0.309  10.175
 1082    H    THR 146           HN       THR 146  14.857   5.502   6.212
 1083    HA   THR 146           HA       THR 146  16.135   8.081   6.489
 1084    HB   THR 146           HB       THR 146  17.842   5.639   5.974
 1085    HG1  THR 146           HG1      THR 146  17.007   6.765   8.344
 1086   HG21  THR 146          HG21      THR 146  19.722   7.199   6.371
 1087   HG22  THR 146          HG22      THR 146  18.570   8.527   6.516
 1088   HG23  THR 146          HG23      THR 146  18.741   7.669   4.984
 1089    H    ALA 147           HN       ALA 147  16.762   8.984   4.533
 1090    HA   ALA 147           HA       ALA 147  16.663   7.316   2.136
 1091    HB1  ALA 147           HB1      ALA 147  14.473   8.404   2.276
 1092    HB2  ALA 147           HB2      ALA 147  15.408   9.045   0.925
 1093    HB3  ALA 147           HB3      ALA 147  15.258   9.977   2.415
 1094    H    VAL 148           HN       VAL 148  18.441   7.674   0.868
 1095    HA   VAL 148           HA       VAL 148  19.831  10.233   1.323
 1096    HB   VAL 148           HB       VAL 148  22.006   9.153   1.226
 1097   HG11  VAL 148          HG11      VAL 148  21.079   9.512   3.408
 1098   HG12  VAL 148          HG12      VAL 148  21.921   7.962   3.399
 1099   HG13  VAL 148          HG13      VAL 148  20.159   8.009   3.314
 1100   HG21  VAL 148          HG21      VAL 148  22.216   6.711   1.380
 1101   HG22  VAL 148          HG22      VAL 148  21.486   7.226  -0.142
 1102   HG23  VAL 148          HG23      VAL 148  20.475   6.558   1.142
 1103    H    ASP 149           HN       ASP 149  20.856  11.147  -0.400
 1104    HA   ASP 149           HA       ASP 149  19.772  10.274  -2.943
 1105    HB2  ASP 149           HB2      ASP 149  19.320  12.556  -2.510
 1106    HB3  ASP 149           HB1      ASP 149  20.974  12.872  -1.983
 1107    H    LEU 150           HN       LEU 150  20.974   9.284  -4.418
 1108    HA   LEU 150           HA       LEU 150  23.854   9.555  -4.469
 1109    HB2  LEU 150           HB2      LEU 150  22.428   7.197  -3.344
 1110    HB3  LEU 150           HB1      LEU 150  23.881   6.904  -4.289
 1111    HG   LEU 150           HG       LEU 150  23.724   8.638  -1.819
 1112   HD11  LEU 150          HD11      LEU 150  24.924   6.850  -0.707
 1113   HD12  LEU 150          HD12      LEU 150  24.877   5.880  -2.180
 1114   HD13  LEU 150          HD13      LEU 150  23.380   6.267  -1.330
 1115   HD21  LEU 150          HD21      LEU 150  26.103   7.704  -3.420
 1116   HD22  LEU 150          HD22      LEU 150  26.155   8.644  -1.931
 1117   HD23  LEU 150          HD23      LEU 150  25.460   9.346  -3.391
 1118    H    GLU 151           HN       GLU 151  21.268   9.655  -6.152
 1119    HA   GLU 151           HA       GLU 151  21.958   7.699  -8.207
 1120    HB2  GLU 151           HB2      GLU 151  19.639   7.720  -7.501
 1121    HB3  GLU 151           HB1      GLU 151  19.516   9.437  -7.832
 1122    HG2  GLU 151           HG2      GLU 151  18.482   7.772  -9.473
 1123    HG3  GLU 151           HG1      GLU 151  19.432   9.129 -10.106
 1124    H    HIS 152           HN       HIS 152  20.534  10.939  -8.713
 1125    HA   HIS 152           HA       HIS 152  22.984  11.799  -9.998
 1126    HB2  HIS 152           HB2      HIS 152  21.985  12.286 -12.167
 1127    HB3  HIS 152           HB1      HIS 152  21.880  10.567 -11.814
 1128    HD1  HIS 152           HD1      HIS 152  19.726  13.651 -12.115
 1129    HD2  HIS 152           HD2      HIS 152  19.322   9.530 -11.761
 1130    HE1  HIS 152           HE1      HIS 152  17.299  13.171 -12.544
 1131    HE2  HIS 152           HE2      HIS 152  17.157  10.657 -12.621
 1132    H    HIS 153           HN       HIS 153  23.269  13.956  -9.935
 1133    HA   HIS 153           HA       HIS 153  20.864  15.590  -9.509
 1134    HB2  HIS 153           HB2      HIS 153  22.511  17.321  -8.536
 1135    HB3  HIS 153           HB1      HIS 153  22.067  15.950  -7.534
 1136    HD1  HIS 153           HD1      HIS 153  23.910  14.392  -6.782
 1137    HD2  HIS 153           HD2      HIS 153  25.200  17.280  -9.491
 1138    HE1  HIS 153           HE1      HIS 153  26.422  14.275  -6.752
 1139    HE2  HIS 153           HE2      HIS 153  27.191  16.064  -8.361
 1140    H    HIS 154           HN       HIS 154  22.711  14.568 -11.807
 1141    HA   HIS 154           HA       HIS 154  23.089  17.016 -13.300
 1142    HB2  HIS 154           HB2      HIS 154  23.673  14.161 -13.689
 1143    HB3  HIS 154           HB1      HIS 154  23.094  14.954 -15.145
 1144    HD1  HIS 154           HD1      HIS 154  25.979  13.888 -14.952
 1145    HD2  HIS 154           HD2      HIS 154  24.851  17.799 -14.102
 1146    HE1  HIS 154           HE1      HIS 154  28.055  15.274 -15.252
 1147    HE2  HIS 154           HE2      HIS 154  27.392  17.593 -14.521
 1148    H    HIS 155           HN       HIS 155  21.552  18.002 -14.409
 1149    HA   HIS 155           HA       HIS 155  19.638  18.455 -15.548
 1150    HB2  HIS 155           HB2      HIS 155  19.432  15.462 -15.963
 1151    HB3  HIS 155           HB1      HIS 155  18.560  16.697 -16.861
 1152    HD1  HIS 155           HD1      HIS 155  20.109  18.254 -18.450
 1153    HD2  HIS 155           HD2      HIS 155  21.847  14.778 -16.968
 1154    HE1  HIS 155           HE1      HIS 155  22.137  17.842 -19.881
 1155    HE2  HIS 155           HE2      HIS 155  23.073  15.641 -19.074
 1156    H    HIS 156           HN       HIS 156  17.176  17.659 -15.692
 1157    HA   HIS 156           HA       HIS 156  16.326  16.906 -12.965
 1158    HB2  HIS 156           HB2      HIS 156  14.833  18.530 -15.039
 1159    HB3  HIS 156           HB1      HIS 156  14.200  18.071 -13.462
 1160    HD1  HIS 156           HD1      HIS 156  15.506  20.884 -15.061
 1161    HD2  HIS 156           HD2      HIS 156  16.268  19.096 -11.382
 1162    HE1  HIS 156           HE1      HIS 156  16.562  22.675 -13.637
 1163    HE2  HIS 156           HE2      HIS 156  16.904  21.600 -11.378
 1164    H    HIS 157           HN       HIS 157  16.973  15.427 -15.593
 1165    HA   HIS 157           HA       HIS 157  14.600  13.739 -15.601
 1166    HB2  HIS 157           HB2      HIS 157  14.405  15.457 -17.442
 1167    HB3  HIS 157           HB1      HIS 157  15.863  14.774 -18.151
 1168    HD1  HIS 157           HD1      HIS 157  15.650  12.545 -19.382
 1169    HD2  HIS 157           HD2      HIS 157  12.091  13.876 -17.700
 1170    HE1  HIS 157           HE1      HIS 157  13.853  11.102 -20.381
 1171    HE2  HIS 157           HE2      HIS 157  11.686  12.018 -19.458
  Start of MODEL   20
    1    H1   MET   1           HT1      MET   1  19.882  -9.047 -37.946
    2    H2   MET   1           HT2      MET   1  18.631  -9.401 -36.857
    3    H3   MET   1           HT3      MET   1  18.865 -10.378 -38.216
    4    HA   MET   1           HA       MET   1  21.024 -11.066 -37.380
    5    HB2  MET   1           HB2      MET   1  21.501  -9.034 -36.080
    6    HB3  MET   1           HB1      MET   1  20.222  -9.450 -34.947
    7    HG2  MET   1           HG2      MET   1  21.472 -11.514 -34.381
    8    HG3  MET   1           HG1      MET   1  22.777 -10.963 -35.429
    9    HE1  MET   1           HE1      MET   1  20.767 -10.344 -32.121
   10    HE2  MET   1           HE2      MET   1  20.458  -8.868 -33.036
   11    HE3  MET   1           HE3      MET   1  21.436  -8.807 -31.569
   12    H    GLY   2           HN       GLY   2  18.361 -10.589 -35.034
   13    HA2  GLY   2           HA2      GLY   2  17.949 -13.501 -35.065
   14    HA3  GLY   2           HA1      GLY   2  18.225 -12.689 -33.528
   15    H    GLN   3           HN       GLN   3  15.894 -14.103 -34.985
   16    HA   GLN   3           HA       GLN   3  13.855 -12.025 -34.533
   17    HB2  GLN   3           HB2      GLN   3  13.732 -14.554 -36.188
   18    HB3  GLN   3           HB1      GLN   3  12.373 -13.476 -35.911
   19    HG2  GLN   3           HG2      GLN   3  13.423 -11.719 -37.124
   20    HG3  GLN   3           HG1      GLN   3  14.933 -12.624 -37.234
   21   HE21  GLN   3          HE21      GLN   3  13.175 -11.532 -39.335
   22   HE22  GLN   3          HE22      GLN   3  12.781 -12.880 -40.353
   23    HA   PRO   4           HA       PRO   4  12.074 -14.580 -31.273
   24    HB2  PRO   4           HB2      PRO   4   9.411 -14.159 -31.786
   25    HB3  PRO   4           HB1      PRO   4  10.429 -13.026 -30.892
   26    HG2  PRO   4           HG2      PRO   4   9.581 -12.956 -33.755
   27    HG3  PRO   4           HG1      PRO   4   9.719 -11.625 -32.590
   28    HD2  PRO   4           HD2      PRO   4  11.597 -12.089 -34.478
   29    HD3  PRO   4           HD1      PRO   4  12.002 -11.448 -32.875
   30    HA   PRO   5           HA       PRO   5  11.635 -18.340 -33.559
   31    HB2  PRO   5           HB2      PRO   5  10.486 -19.415 -31.054
   32    HB3  PRO   5           HB1      PRO   5  11.906 -19.948 -31.962
   33    HG2  PRO   5           HG2      PRO   5  12.167 -18.650 -29.641
   34    HG3  PRO   5           HG1      PRO   5  13.290 -18.357 -30.983
   35    HD2  PRO   5           HD2      PRO   5  10.970 -16.710 -30.059
   36    HD3  PRO   5           HD1      PRO   5  12.580 -16.184 -30.596
   37    H    ALA   6           HN       ALA   6  10.131 -19.322 -34.723
   38    HA   ALA   6           HA       ALA   6   8.174 -20.146 -35.472
   39    HB1  ALA   6           HB1      ALA   6   7.737 -20.931 -33.208
   40    HB2  ALA   6           HB2      ALA   6   6.251 -20.412 -34.005
   41    HB3  ALA   6           HB3      ALA   6   7.013 -19.375 -32.798
   42    H    GLU   7           HN       GLU   7   6.957 -17.411 -33.500
   43    HA   GLU   7           HA       GLU   7   6.070 -16.057 -35.906
   44    HB2  GLU   7           HB2      GLU   7   3.671 -16.194 -35.249
   45    HB3  GLU   7           HB1      GLU   7   4.357 -17.751 -35.705
   46    HG2  GLU   7           HG2      GLU   7   4.702 -18.208 -33.260
   47    HG3  GLU   7           HG1      GLU   7   3.777 -16.744 -32.927
   48    H    GLU   8           HN       GLU   8   5.005 -14.005 -35.439
   49    HA   GLU   8           HA       GLU   8   5.271 -13.129 -32.641
   50    HB2  GLU   8           HB2      GLU   8   5.981 -10.943 -33.326
   51    HB3  GLU   8           HB1      GLU   8   7.031 -12.121 -34.096
   52    HG2  GLU   8           HG2      GLU   8   6.232 -11.676 -36.189
   53    HG3  GLU   8           HG1      GLU   8   4.663 -11.128 -35.596
   54    H    ALA   9           HN       ALA   9   3.445 -13.028 -35.637
   55    HA   ALA   9           HA       ALA   9   1.035 -12.344 -34.273
   56    HB1  ALA   9           HB1      ALA   9   0.596 -10.200 -35.337
   57    HB2  ALA   9           HB2      ALA   9   2.165 -10.262 -36.142
   58    HB3  ALA   9           HB3      ALA   9   2.083 -10.118 -34.386
   59    H    GLU  10           HN       GLU  10  -0.050 -13.954 -35.221
   60    HA   GLU  10           HA       GLU  10  -1.276 -13.411 -37.683
   61    HB2  GLU  10           HB2      GLU  10   0.948 -14.356 -38.498
   62    HB3  GLU  10           HB1      GLU  10   0.445 -15.893 -37.803
   63    HG2  GLU  10           HG2      GLU  10  -1.514 -15.916 -39.249
   64    HG3  GLU  10           HG1      GLU  10  -1.040 -14.364 -39.931
   65    H    GLN  11           HN       GLN  11  -3.096 -14.745 -37.983
   66    HA   GLN  11           HA       GLN  11  -4.891 -15.915 -37.227
   67    HB2  GLN  11           HB2      GLN  11  -2.821 -17.624 -35.820
   68    HB3  GLN  11           HB1      GLN  11  -4.502 -18.061 -36.084
   69    HG2  GLN  11           HG2      GLN  11  -4.124 -18.023 -38.502
   70    HG3  GLN  11           HG1      GLN  11  -2.432 -17.613 -38.215
   71   HE21  GLN  11          HE21      GLN  11  -4.194 -19.821 -36.171
   72   HE22  GLN  11          HE22      GLN  11  -3.355 -21.259 -36.656
   73    HA   PRO  12           HA       PRO  12  -4.502 -13.276 -33.438
   74    HB2  PRO  12           HB2      PRO  12  -7.248 -12.540 -34.250
   75    HB3  PRO  12           HB1      PRO  12  -5.873 -11.502 -33.863
   76    HG2  PRO  12           HG2      PRO  12  -6.729 -11.809 -36.381
   77    HG3  PRO  12           HG1      PRO  12  -5.007 -11.623 -35.997
   78    HD2  PRO  12           HD2      PRO  12  -6.540 -14.092 -36.694
   79    HD3  PRO  12           HD1      PRO  12  -4.894 -13.615 -37.162
   80    H    GLY  13           HN       GLY  13  -6.793 -15.656 -34.451
   81    HA2  GLY  13           HA2      GLY  13  -7.691 -17.308 -33.036
   82    HA3  GLY  13           HA1      GLY  13  -7.332 -16.282 -31.656
   83    H    ALA  14           HN       ALA  14  -9.432 -16.480 -34.502
   84    HA   ALA  14           HA       ALA  14 -11.316 -14.576 -33.590
   85    HB1  ALA  14           HB1      ALA  14 -11.707 -16.831 -35.557
   86    HB2  ALA  14           HB2      ALA  14 -11.088 -15.225 -35.943
   87    HB3  ALA  14           HB3      ALA  14 -12.747 -15.415 -35.372
   88    H    LEU  15           HN       LEU  15 -10.789 -17.890 -32.868
   89    HA   LEU  15           HA       LEU  15 -11.648 -19.276 -31.308
   90    HB2  LEU  15           HB2      LEU  15 -13.160 -16.813 -30.449
   91    HB3  LEU  15           HB1      LEU  15 -13.202 -18.335 -29.587
   92    HG   LEU  15           HG       LEU  15 -10.695 -16.719 -30.046
   93   HD11  LEU  15          HD11      LEU  15 -12.418 -16.972 -27.584
   94   HD12  LEU  15          HD12      LEU  15 -12.251 -15.533 -28.589
   95   HD13  LEU  15          HD13      LEU  15 -10.867 -16.137 -27.680
   96   HD21  LEU  15          HD21      LEU  15  -9.778 -18.229 -28.305
   97   HD22  LEU  15          HD22      LEU  15 -10.220 -19.068 -29.792
   98   HD23  LEU  15          HD23      LEU  15 -11.271 -19.164 -28.379
   99    H    ALA  16           HN       ALA  16 -14.070 -19.763 -30.305
  100    HA   ALA  16           HA       ALA  16 -16.134 -19.600 -32.294
  101    HB1  ALA  16           HB1      ALA  16 -16.363 -22.032 -32.627
  102    HB2  ALA  16           HB2      ALA  16 -14.895 -22.294 -31.685
  103    HB3  ALA  16           HB3      ALA  16 -14.811 -21.443 -33.227
  104    H    ARG  17           HN       ARG  17 -15.563 -22.192 -29.966
  105    HA   ARG  17           HA       ARG  17 -17.842 -21.217 -28.405
  106    HB2  ARG  17           HB2      ARG  17 -17.790 -23.528 -27.388
  107    HB3  ARG  17           HB1      ARG  17 -18.173 -23.473 -29.103
  108    HG2  ARG  17           HG2      ARG  17 -15.876 -24.110 -29.642
  109    HG3  ARG  17           HG1      ARG  17 -15.484 -24.158 -27.922
  110    HD2  ARG  17           HD2      ARG  17 -17.023 -25.962 -27.560
  111    HD3  ARG  17           HD1      ARG  17 -17.627 -25.837 -29.210
  112    HE   ARG  17           HE       ARG  17 -14.967 -26.332 -29.526
  113   HH11  ARG  17          HH11      ARG  17 -17.587 -27.958 -27.854
  114   HH12  ARG  17          HH12      ARG  17 -16.886 -29.539 -28.050
  115   HH21  ARG  17          HH21      ARG  17 -14.051 -28.417 -29.776
  116   HH22  ARG  17          HH22      ARG  17 -14.881 -29.795 -29.120
  117    H    GLU  18           HN       GLU  18 -14.577 -20.996 -28.405
  118    HA   GLU  18           HA       GLU  18 -12.951 -20.485 -26.905
  119    HB2  GLU  18           HB2      GLU  18 -14.592 -18.660 -26.436
  120    HB3  GLU  18           HB1      GLU  18 -15.258 -19.644 -25.140
  121    HG2  GLU  18           HG2      GLU  18 -13.112 -19.586 -23.989
  122    HG3  GLU  18           HG1      GLU  18 -12.437 -18.609 -25.294
  123    H    PHE  19           HN       PHE  19 -12.143 -22.528 -26.483
  124    HA   PHE  19           HA       PHE  19 -13.110 -23.785 -24.011
  125    HB2  PHE  19           HB2      PHE  19 -12.952 -25.997 -25.071
  126    HB3  PHE  19           HB1      PHE  19 -14.119 -24.970 -25.898
  127    HD1  PHE  19           HD1      PHE  19 -13.457 -23.879 -28.058
  128    HD2  PHE  19           HD2      PHE  19 -11.116 -26.924 -26.219
  129    HE1  PHE  19           HE1      PHE  19 -12.312 -24.289 -30.198
  130    HE2  PHE  19           HE2      PHE  19  -9.966 -27.336 -28.355
  131    HZ   PHE  19           HZ       PHE  19 -10.549 -26.026 -30.336
  132    H    LEU  20           HN       LEU  20 -10.578 -22.271 -25.156
  133    HA   LEU  20           HA       LEU  20  -8.688 -23.973 -23.748
  134    HB2  LEU  20           HB2      LEU  20  -7.020 -23.591 -25.662
  135    HB3  LEU  20           HB1      LEU  20  -8.242 -24.826 -25.859
  136    HG   LEU  20           HG       LEU  20  -9.569 -23.168 -27.222
  137   HD11  LEU  20          HD11      LEU  20  -8.353 -21.272 -28.191
  138   HD12  LEU  20          HD12      LEU  20  -6.990 -21.606 -27.119
  139   HD13  LEU  20          HD13      LEU  20  -8.542 -21.105 -26.445
  140   HD21  LEU  20          HD21      LEU  20  -8.281 -24.950 -28.252
  141   HD22  LEU  20          HD22      LEU  20  -6.829 -23.952 -28.206
  142   HD23  LEU  20          HD23      LEU  20  -8.188 -23.484 -29.229
  143    H    ALA  21           HN       ALA  21  -9.984 -21.215 -23.539
  144    HA   ALA  21           HA       ALA  21  -7.490 -19.668 -23.315
  145    HB1  ALA  21           HB1      ALA  21 -10.217 -18.585 -24.039
  146    HB2  ALA  21           HB2      ALA  21  -8.879 -18.826 -25.163
  147    HB3  ALA  21           HB3      ALA  21  -8.738 -17.640 -23.864
  148    H    ALA  22           HN       ALA  22  -7.000 -19.455 -21.275
  149    HA   ALA  22           HA       ALA  22  -7.062 -18.831 -19.103
  150    HB1  ALA  22           HB1      ALA  22  -8.379 -16.894 -19.882
  151    HB2  ALA  22           HB2      ALA  22  -8.839 -17.421 -18.262
  152    HB3  ALA  22           HB3      ALA  22  -9.856 -17.829 -19.644
  153    H    MET  23           HN       MET  23  -8.619 -19.086 -17.059
  154    HA   MET  23           HA       MET  23  -9.958 -21.695 -17.236
  155    HB2  MET  23           HB2      MET  23  -8.943 -22.329 -15.068
  156    HB3  MET  23           HB1      MET  23  -7.736 -22.110 -16.329
  157    HG2  MET  23           HG2      MET  23  -7.152 -19.939 -15.449
  158    HG3  MET  23           HG1      MET  23  -8.430 -20.052 -14.241
  159    HE1  MET  23           HE1      MET  23  -8.340 -21.507 -12.105
  160    HE2  MET  23           HE2      MET  23  -7.131 -22.753 -11.795
  161    HE3  MET  23           HE3      MET  23  -8.284 -22.948 -13.117
  162    H    GLU  24           HN       GLU  24 -10.655 -18.734 -16.938
  163    HA   GLU  24           HA       GLU  24 -11.959 -17.318 -15.755
  164    HB2  GLU  24           HB2      GLU  24 -13.227 -19.938 -14.970
  165    HB3  GLU  24           HB1      GLU  24 -13.887 -18.377 -14.499
  166    HG2  GLU  24           HG2      GLU  24 -13.924 -17.804 -16.959
  167    HG3  GLU  24           HG1      GLU  24 -13.585 -19.509 -17.263
  168    HA   PRO  25           HA       PRO  25  -9.448 -17.603 -11.988
  169    HB2  PRO  25           HB2      PRO  25  -9.188 -14.728 -12.196
  170    HB3  PRO  25           HB1      PRO  25  -7.941 -15.963 -12.377
  171    HG2  PRO  25           HG2      PRO  25  -8.849 -14.421 -14.438
  172    HG3  PRO  25           HG1      PRO  25  -8.177 -16.048 -14.651
  173    HD2  PRO  25           HD2      PRO  25 -11.039 -15.171 -14.592
  174    HD3  PRO  25           HD1      PRO  25 -10.248 -16.372 -15.636
  175    H    GLU  26           HN       GLU  26  -9.888 -17.085  -9.877
  176    HA   GLU  26           HA       GLU  26 -12.479 -16.312  -9.129
  177    HB2  GLU  26           HB2      GLU  26  -9.931 -16.300  -7.497
  178    HB3  GLU  26           HB1      GLU  26 -11.555 -16.195  -6.837
  179    HG2  GLU  26           HG2      GLU  26 -10.451 -18.522  -8.391
  180    HG3  GLU  26           HG1      GLU  26 -10.606 -18.442  -6.637
  181    HA   PRO  27           HA       PRO  27 -12.089 -11.884  -9.506
  182    HB2  PRO  27           HB2      PRO  27 -14.426 -11.761  -7.725
  183    HB3  PRO  27           HB1      PRO  27 -14.269 -11.231  -9.401
  184    HG2  PRO  27           HG2      PRO  27 -15.731 -13.388  -8.723
  185    HG3  PRO  27           HG1      PRO  27 -14.834 -13.297 -10.249
  186    HD2  PRO  27           HD2      PRO  27 -14.118 -14.721  -7.716
  187    HD3  PRO  27           HD1      PRO  27 -13.943 -15.261  -9.398
  188    H    ALA  28           HN       ALA  28 -10.865 -10.524  -8.332
  189    HA   ALA  28           HA       ALA  28  -9.962 -11.080  -5.743
  190    HB1  ALA  28           HB1      ALA  28 -10.004  -8.412  -7.150
  191    HB2  ALA  28           HB2      ALA  28  -8.753  -9.641  -7.319
  192    HB3  ALA  28           HB3      ALA  28  -9.002  -8.844  -5.767
  193    HA   PRO  29           HA       PRO  29 -13.164 -10.147  -2.943
  194    HB2  PRO  29           HB2      PRO  29 -11.191  -8.426  -1.518
  195    HB3  PRO  29           HB1      PRO  29 -12.229  -9.712  -0.887
  196    HG2  PRO  29           HG2      PRO  29  -9.636 -10.161  -1.304
  197    HG3  PRO  29           HG1      PRO  29 -10.844 -11.404  -1.677
  198    HD2  PRO  29           HD2      PRO  29  -9.310  -9.636  -3.517
  199    HD3  PRO  29           HD1      PRO  29  -9.875 -11.301  -3.758
  200    H    ALA  30           HN       ALA  30 -14.763  -8.734  -2.735
  201    HA   ALA  30           HA       ALA  30 -14.378  -6.041  -3.781
  202    HB1  ALA  30           HB1      ALA  30 -16.189  -7.352  -4.763
  203    HB2  ALA  30           HB2      ALA  30 -16.805  -5.919  -3.945
  204    HB3  ALA  30           HB3      ALA  30 -16.948  -7.499  -3.178
  205    HA   PRO  31           HA       PRO  31 -16.341  -5.316   0.695
  206    HB2  PRO  31           HB2      PRO  31 -15.116  -7.679   2.017
  207    HB3  PRO  31           HB1      PRO  31 -16.678  -6.905   2.311
  208    HG2  PRO  31           HG2      PRO  31 -16.538  -9.238   1.032
  209    HG3  PRO  31           HG1      PRO  31 -17.700  -7.994   0.536
  210    HD2  PRO  31           HD2      PRO  31 -15.099  -8.766  -0.721
  211    HD3  PRO  31           HD1      PRO  31 -16.633  -8.310  -1.490
  212    H    ALA  32           HN       ALA  32 -15.113  -3.780   1.562
  213    HA   ALA  32           HA       ALA  32 -12.207  -4.234   1.727
  214    HB1  ALA  32           HB1      ALA  32 -12.821  -2.477   0.147
  215    HB2  ALA  32           HB2      ALA  32 -11.951  -1.806   1.527
  216    HB3  ALA  32           HB3      ALA  32 -13.702  -1.629   1.419
  217    HA   PRO  33           HA       PRO  33 -13.052  -4.148   6.153
  218    HB2  PRO  33           HB2      PRO  33 -10.377  -4.376   6.821
  219    HB3  PRO  33           HB1      PRO  33 -11.454  -5.741   6.512
  220    HG2  PRO  33           HG2      PRO  33  -9.462  -4.442   4.702
  221    HG3  PRO  33           HG1      PRO  33  -9.864  -6.158   4.884
  222    HD2  PRO  33           HD2      PRO  33 -10.770  -4.698   2.814
  223    HD3  PRO  33           HD1      PRO  33 -11.744  -5.990   3.548
  224    H    GLU  34           HN       GLU  34 -10.545  -2.328   4.489
  225    HA   GLU  34           HA       GLU  34 -11.291   0.152   5.636
  226    HB2  GLU  34           HB2      GLU  34 -10.047  -0.881   7.552
  227    HB3  GLU  34           HB1      GLU  34  -8.623  -0.966   6.526
  228    HG2  GLU  34           HG2      GLU  34  -8.625   1.467   6.324
  229    HG3  GLU  34           HG1      GLU  34 -10.042   1.545   7.372
  230    H    GLU  35           HN       GLU  35 -11.114   1.310   3.799
  231    HA   GLU  35           HA       GLU  35  -9.065   0.604   1.876
  232    HB2  GLU  35           HB2      GLU  35 -10.204   2.030   0.310
  233    HB3  GLU  35           HB1      GLU  35 -11.375   0.999   1.109
  234    HG2  GLU  35           HG2      GLU  35 -10.875   3.901   1.735
  235    HG3  GLU  35           HG1      GLU  35 -12.212   3.267   0.783
  236    H    TRP  36           HN       TRP  36  -7.126   1.401   2.079
  237    HA   TRP  36           HA       TRP  36  -6.722   4.126   3.032
  238    HB2  TRP  36           HB2      TRP  36  -4.488   2.358   2.123
  239    HB3  TRP  36           HB1      TRP  36  -4.492   3.584   3.382
  240    HD1  TRP  36           HD1      TRP  36  -6.771   2.477   5.268
  241    HE1  TRP  36           HE1      TRP  36  -6.396   0.284   6.566
  242    HE3  TRP  36           HE3      TRP  36  -3.085   0.473   2.359
  243    HZ2  TRP  36           HZ2      TRP  36  -4.702  -2.004   6.359
  244    HZ3  TRP  36           HZ3      TRP  36  -2.154  -1.691   2.973
  245    HH2  TRP  36           HH2      TRP  36  -2.940  -2.914   4.910
  246    H    LEU  37           HN       LEU  37  -4.388   4.709   1.602
  247    HA   LEU  37           HA       LEU  37  -5.507   5.642  -0.851
  248    HB2  LEU  37           HB2      LEU  37  -3.828   6.888   0.487
  249    HB3  LEU  37           HB1      LEU  37  -2.635   5.680   0.068
  250    HG   LEU  37           HG       LEU  37  -2.886   6.297  -2.324
  251   HD11  LEU  37          HD11      LEU  37  -5.139   7.150  -2.294
  252   HD12  LEU  37          HD12      LEU  37  -4.035   8.403  -2.863
  253   HD13  LEU  37          HD13      LEU  37  -4.660   8.460  -1.214
  254   HD21  LEU  37          HD21      LEU  37  -1.713   8.433  -2.164
  255   HD22  LEU  37          HD22      LEU  37  -1.113   7.280  -0.974
  256   HD23  LEU  37          HD23      LEU  37  -2.199   8.575  -0.475
  257    H    ASP  38           HN       ASP  38  -5.900   4.217  -2.408
  258    HA   ASP  38           HA       ASP  38  -4.343   1.985  -3.071
  259    HB2  ASP  38           HB2      ASP  38  -5.551   2.254  -5.344
  260    HB3  ASP  38           HB1      ASP  38  -6.514   1.928  -3.905
  261    H    ILE  39           HN       ILE  39  -2.222   2.383  -3.243
  262    HA   ILE  39           HA       ILE  39  -0.830   4.373  -4.540
  263    HB   ILE  39           HB       ILE  39  -0.071   1.449  -4.624
  264   HG12  ILE  39          HG12      ILE  39   0.301   3.477  -2.421
  265   HG13  ILE  39          HG11      ILE  39  -0.569   1.955  -2.330
  266   HG21  ILE  39          HG21      ILE  39   2.234   2.306  -4.658
  267   HG22  ILE  39          HG22      ILE  39   1.610   3.955  -4.695
  268   HG23  ILE  39          HG23      ILE  39   1.294   2.863  -6.042
  269   HD11  ILE  39          HD11      ILE  39   1.537   0.749  -2.675
  270   HD12  ILE  39          HD12      ILE  39   1.552   1.741  -1.220
  271   HD13  ILE  39          HD13      ILE  39   2.399   2.288  -2.668
  272    H    LEU  40           HN       LEU  40  -1.894   1.286  -5.814
  273    HA   LEU  40           HA       LEU  40  -1.009   1.813  -8.490
  274    HB2  LEU  40           HB2      LEU  40  -1.598  -0.412  -6.924
  275    HB3  LEU  40           HB1      LEU  40  -2.898  -0.377  -8.096
  276    HG   LEU  40           HG       LEU  40  -0.962  -1.831  -8.689
  277   HD11  LEU  40          HD11      LEU  40  -2.502  -1.040 -10.403
  278   HD12  LEU  40          HD12      LEU  40  -0.855  -1.091 -11.035
  279   HD13  LEU  40          HD13      LEU  40  -1.575   0.449 -10.568
  280   HD21  LEU  40          HD21      LEU  40   1.084  -0.884  -9.435
  281   HD22  LEU  40          HD22      LEU  40   0.761  -0.284  -7.806
  282   HD23  LEU  40          HD23      LEU  40   0.477   0.752  -9.204
  283    H    GLY  41           HN       GLY  41  -3.744   2.542  -6.660
  284    HA2  GLY  41           HA2      GLY  41  -5.794   3.428  -7.192
  285    HA3  GLY  41           HA1      GLY  41  -5.237   3.552  -8.853
  286    H    ASN  42           HN       ASN  42  -4.830   0.435  -7.716
  287    HA   ASN  42           HA       ASN  42  -7.251  -0.403  -9.134
  288    HB2  ASN  42           HB2      ASN  42  -6.174  -2.319  -9.854
  289    HB3  ASN  42           HB1      ASN  42  -4.918  -1.103  -9.943
  290   HD21  ASN  42          HD21      ASN  42  -4.323  -1.140  -7.049
  291   HD22  ASN  42          HD22      ASN  42  -3.505  -2.634  -6.789
  292    H    GLY  43           HN       GLY  43  -6.007  -0.178  -6.040
  293    HA2  GLY  43           HA2      GLY  43  -7.263  -0.675  -4.126
  294    HA3  GLY  43           HA1      GLY  43  -8.218  -1.802  -5.075
  295    H    LEU  44           HN       LEU  44  -5.559  -2.977  -6.089
  296    HA   LEU  44           HA       LEU  44  -5.399  -4.985  -4.010
  297    HB2  LEU  44           HB2      LEU  44  -4.122  -4.660  -6.713
  298    HB3  LEU  44           HB1      LEU  44  -3.557  -5.887  -5.603
  299    HG   LEU  44           HG       LEU  44  -5.068  -6.851  -7.230
  300   HD11  LEU  44          HD11      LEU  44  -6.626  -7.940  -5.729
  301   HD12  LEU  44          HD12      LEU  44  -6.364  -6.684  -4.518
  302   HD13  LEU  44          HD13      LEU  44  -5.044  -7.765  -4.966
  303   HD21  LEU  44          HD21      LEU  44  -7.425  -6.223  -7.326
  304   HD22  LEU  44          HD22      LEU  44  -6.382  -4.873  -7.775
  305   HD23  LEU  44          HD23      LEU  44  -7.127  -4.920  -6.178
  306    H    LEU  45           HN       LEU  45  -3.773  -2.193  -4.992
  307    HA   LEU  45           HA       LEU  45  -1.590  -2.678  -3.085
  308    HB2  LEU  45           HB2      LEU  45  -0.841  -2.590  -5.431
  309    HB3  LEU  45           HB1      LEU  45  -1.547  -0.995  -5.585
  310    HG   LEU  45           HG       LEU  45   0.043  -0.066  -4.046
  311   HD11  LEU  45          HD11      LEU  45   1.782  -1.454  -3.041
  312   HD12  LEU  45          HD12      LEU  45   1.027  -2.887  -3.744
  313   HD13  LEU  45          HD13      LEU  45   0.172  -1.950  -2.516
  314   HD21  LEU  45          HD21      LEU  45   0.715  -0.347  -6.384
  315   HD22  LEU  45          HD22      LEU  45   1.408  -1.918  -5.976
  316   HD23  LEU  45          HD23      LEU  45   2.091  -0.449  -5.278
  317    H    ARG  46           HN       ARG  46  -1.990  -1.532  -1.287
  318    HA   ARG  46           HA       ARG  46  -2.748   1.292  -1.527
  319    HB2  ARG  46           HB2      ARG  46  -4.252  -0.797   0.030
  320    HB3  ARG  46           HB1      ARG  46  -4.439   0.929   0.303
  321    HG2  ARG  46           HG2      ARG  46  -5.296   1.242  -1.886
  322    HG3  ARG  46           HG1      ARG  46  -4.923  -0.420  -2.335
  323    HD2  ARG  46           HD2      ARG  46  -6.894   0.457  -0.232
  324    HD3  ARG  46           HD1      ARG  46  -7.296  -0.157  -1.839
  325    HE   ARG  46           HE       ARG  46  -6.250  -2.283  -1.166
  326   HH11  ARG  46          HH11      ARG  46  -7.384  -0.091   1.304
  327   HH12  ARG  46          HH12      ARG  46  -7.440  -1.294   2.550
  328   HH21  ARG  46          HH21      ARG  46  -6.325  -3.886   0.466
  329   HH22  ARG  46          HH22      ARG  46  -6.815  -3.457   2.078
  330    H    LYS  47           HN       LYS  47  -1.949   2.587   0.101
  331    HA   LYS  47           HA       LYS  47  -0.259   1.248   2.135
  332    HB2  LYS  47           HB2      LYS  47   0.942   2.569   0.313
  333    HB3  LYS  47           HB1      LYS  47   0.200   4.006   0.987
  334    HG2  LYS  47           HG2      LYS  47   1.283   3.163   3.219
  335    HG3  LYS  47           HG1      LYS  47   2.325   2.251   2.124
  336    HD2  LYS  47           HD2      LYS  47   3.414   4.304   2.678
  337    HD3  LYS  47           HD1      LYS  47   2.912   4.393   1.004
  338    HE2  LYS  47           HE2      LYS  47   2.228   6.441   1.691
  339    HE3  LYS  47           HE1      LYS  47   0.779   5.517   2.080
  340    HZ1  LYS  47           HZ1      LYS  47   2.940   6.302   3.960
  341    HZ2  LYS  47           HZ2      LYS  47   1.640   5.293   4.362
  342    HZ3  LYS  47           HZ3      LYS  47   1.360   6.899   3.918
  343    H    LYS  48           HN       LYS  48  -0.812   1.644   4.216
  344    HA   LYS  48           HA       LYS  48  -2.559   3.950   4.768
  345    HB2  LYS  48           HB2      LYS  48  -3.502   1.891   5.584
  346    HB3  LYS  48           HB1      LYS  48  -1.994   1.466   6.390
  347    HG2  LYS  48           HG2      LYS  48  -2.284   3.102   8.045
  348    HG3  LYS  48           HG1      LYS  48  -3.524   3.944   7.116
  349    HD2  LYS  48           HD2      LYS  48  -4.522   2.738   8.964
  350    HD3  LYS  48           HD1      LYS  48  -5.037   2.042   7.430
  351    HE2  LYS  48           HE2      LYS  48  -3.406   0.240   7.692
  352    HE3  LYS  48           HE1      LYS  48  -2.856   0.958   9.207
  353    HZ1  LYS  48           HZ1      LYS  48  -4.512  -0.933   9.379
  354    HZ2  LYS  48           HZ2      LYS  48  -5.678   0.158   8.797
  355    HZ3  LYS  48           HZ3      LYS  48  -4.877   0.468  10.255
  356    H    THR  49           HN       THR  49  -1.836   5.645   5.830
  357    HA   THR  49           HA       THR  49   0.835   5.704   6.918
  358    HB   THR  49           HB       THR  49  -0.054   8.036   7.720
  359    HG1  THR  49           HG1      THR  49  -2.281   7.510   7.237
  360   HG21  THR  49          HG21      THR  49   0.393   9.000   5.499
  361   HG22  THR  49          HG22      THR  49   0.300   7.387   4.795
  362   HG23  THR  49          HG23      THR  49   1.582   7.774   5.943
  363    H    LEU  50           HN       LEU  50   0.846   4.246   8.668
  364    HA   LEU  50           HA       LEU  50  -0.993   4.337  10.837
  365    HB2  LEU  50           HB2      LEU  50   1.944   3.733  11.118
  366    HB3  LEU  50           HB1      LEU  50   0.609   3.065  12.039
  367    HG   LEU  50           HG       LEU  50   1.043   2.486   9.117
  368   HD11  LEU  50          HD11      LEU  50   2.044   0.386   9.815
  369   HD12  LEU  50          HD12      LEU  50   1.923   0.878  11.505
  370   HD13  LEU  50          HD13      LEU  50   2.976   1.766  10.401
  371   HD21  LEU  50          HD21      LEU  50  -0.591   1.091  11.234
  372   HD22  LEU  50          HD22      LEU  50  -0.451   0.621   9.538
  373   HD23  LEU  50          HD23      LEU  50  -1.223   2.146   9.967
  374    H    VAL  51           HN       VAL  51   2.239   5.616  10.400
  375    HA   VAL  51           HA       VAL  51   1.440   8.160  11.651
  376    HB   VAL  51           HB       VAL  51   4.133   6.817  11.891
  377   HG11  VAL  51          HG11      VAL  51   4.684   8.678  13.412
  378   HG12  VAL  51          HG12      VAL  51   3.123   9.416  13.052
  379   HG13  VAL  51          HG13      VAL  51   4.328   9.232  11.775
  380   HG21  VAL  51          HG21      VAL  51   2.502   5.729  13.319
  381   HG22  VAL  51          HG22      VAL  51   2.014   7.290  13.977
  382   HG23  VAL  51          HG23      VAL  51   3.631   6.665  14.302
  383    HA   PRO  52           HA       PRO  52   3.501   9.166   7.805
  384    HB2  PRO  52           HB2      PRO  52   1.949  11.210   7.132
  385    HB3  PRO  52           HB1      PRO  52   1.348   9.543   7.179
  386    HG2  PRO  52           HG2      PRO  52   0.775  11.782   9.024
  387    HG3  PRO  52           HG1      PRO  52  -0.192  10.343   8.675
  388    HD2  PRO  52           HD2      PRO  52   1.699  10.793  10.842
  389    HD3  PRO  52           HD1      PRO  52   0.590   9.425  10.598
  390    H    GLY  53           HN       GLY  53   5.466   9.747   8.856
  391    HA2  GLY  53           HA2      GLY  53   7.215  11.175   9.162
  392    HA3  GLY  53           HA1      GLY  53   6.268  12.340   8.268
  393    HA   PRO  54           HA       PRO  54   6.387  14.117  12.551
  394    HB2  PRO  54           HB2      PRO  54   8.391  15.889  12.221
  395    HB3  PRO  54           HB1      PRO  54   8.703  14.257  12.823
  396    HG2  PRO  54           HG2      PRO  54   9.059  15.355  10.059
  397    HG3  PRO  54           HG1      PRO  54  10.135  14.297  10.993
  398    HD2  PRO  54           HD2      PRO  54   8.425  13.386   9.067
  399    HD3  PRO  54           HD1      PRO  54   8.948  12.410  10.451
  400    HA   PRO  55           HA       PRO  55   4.325  17.614  10.588
  401    HB2  PRO  55           HB2      PRO  55   4.957  19.789  12.097
  402    HB3  PRO  55           HB1      PRO  55   3.831  18.536  12.629
  403    HG2  PRO  55           HG2      PRO  55   6.716  18.913  13.323
  404    HG3  PRO  55           HG1      PRO  55   5.356  18.480  14.377
  405    HD2  PRO  55           HD2      PRO  55   7.117  16.642  13.431
  406    HD3  PRO  55           HD1      PRO  55   5.412  16.260  13.742
  407    H    GLY  56           HN       GLY  56   6.948  16.943   9.530
  408    HA2  GLY  56           HA2      GLY  56   7.416  19.081   7.798
  409    HA3  GLY  56           HA1      GLY  56   8.573  19.214   9.115
  410    H    SER  57           HN       SER  57   7.239  16.463   7.254
  411    HA   SER  57           HA       SER  57   9.923  15.379   7.007
  412    HB2  SER  57           HB2      SER  57   8.293  13.547   5.861
  413    HB3  SER  57           HB1      SER  57   8.624  13.599   7.596
  414    HG   SER  57           HG       SER  57   6.337  13.522   6.943
  415    H    SER  58           HN       SER  58   9.940  13.981   4.816
  416    HA   SER  58           HA       SER  58   9.030  15.533   2.538
  417    HB2  SER  58           HB2      SER  58  11.300  16.414   3.129
  418    HB3  SER  58           HB1      SER  58  11.946  14.783   2.920
  419    HG   SER  58           HG       SER  58  11.944  16.439   1.075
  420    H    ARG  59           HN       ARG  59   8.615  14.189   0.774
  421    HA   ARG  59           HA       ARG  59   8.945  11.336   1.283
  422    HB2  ARG  59           HB2      ARG  59   7.607  11.235  -0.974
  423    HB3  ARG  59           HB1      ARG  59   6.790  11.627   0.537
  424    HG2  ARG  59           HG2      ARG  59   6.796  13.962  -0.002
  425    HG3  ARG  59           HG1      ARG  59   7.780  13.664  -1.442
  426    HD2  ARG  59           HD2      ARG  59   5.015  12.530  -0.988
  427    HD3  ARG  59           HD1      ARG  59   5.359  13.981  -1.933
  428    HE   ARG  59           HE       ARG  59   6.345  11.282  -2.620
  429   HH11  ARG  59          HH11      ARG  59   5.073  14.412  -3.548
  430   HH12  ARG  59          HH12      ARG  59   5.164  14.084  -5.247
  431   HH21  ARG  59          HH21      ARG  59   6.447  10.842  -4.845
  432   HH22  ARG  59          HH22      ARG  59   5.973  12.052  -5.997
  433    HA   PRO  60           HA       PRO  60  12.787  11.197  -0.953
  434    HB2  PRO  60           HB2      PRO  60  12.627   8.448  -1.370
  435    HB3  PRO  60           HB1      PRO  60  13.340   9.233   0.042
  436    HG2  PRO  60           HG2      PRO  60  10.590   8.108  -0.311
  437    HG3  PRO  60           HG1      PRO  60  11.680   7.996   1.086
  438    HD2  PRO  60           HD2      PRO  60   9.662   9.707   1.144
  439    HD3  PRO  60           HD1      PRO  60  11.259  10.206   1.741
  440    H    VAL  61           HN       VAL  61  13.489  10.951  -3.057
  441    HA   VAL  61           HA       VAL  61  11.337  10.634  -5.035
  442    HB   VAL  61           HB       VAL  61  14.114  11.699  -5.534
  443   HG11  VAL  61          HG11      VAL  61  13.062  12.780  -7.473
  444   HG12  VAL  61          HG12      VAL  61  11.540  11.988  -7.067
  445   HG13  VAL  61          HG13      VAL  61  12.940  11.022  -7.533
  446   HG21  VAL  61          HG21      VAL  61  13.175  13.956  -5.350
  447   HG22  VAL  61          HG22      VAL  61  13.092  13.082  -3.820
  448   HG23  VAL  61          HG23      VAL  61  11.644  13.267  -4.811
  449    H    LYS  62           HN       LYS  62  11.668   9.280  -6.862
  450    HA   LYS  62           HA       LYS  62  13.005   6.879  -6.394
  451    HB2  LYS  62           HB2      LYS  62  11.560   8.079  -8.671
  452    HB3  LYS  62           HB1      LYS  62  12.651   6.742  -9.027
  453    HG2  LYS  62           HG2      LYS  62  11.501   5.310  -7.511
  454    HG3  LYS  62           HG1      LYS  62  10.500   6.628  -6.919
  455    HD2  LYS  62           HD2      LYS  62   9.366   6.779  -9.034
  456    HD3  LYS  62           HD1      LYS  62  10.521   5.675  -9.783
  457    HE2  LYS  62           HE2      LYS  62   9.727   3.932  -8.123
  458    HE3  LYS  62           HE1      LYS  62   8.417   5.043  -7.722
  459    HZ1  LYS  62           HZ1      LYS  62   8.969   3.957 -10.434
  460    HZ2  LYS  62           HZ2      LYS  62   7.674   4.960 -10.009
  461    HZ3  LYS  62           HZ3      LYS  62   7.770   3.390  -9.387
  462    H    GLY  63           HN       GLY  63  15.005   6.510  -6.318
  463    HA2  GLY  63           HA2      GLY  63  17.066   6.523  -7.805
  464    HA3  GLY  63           HA1      GLY  63  16.866   8.271  -7.750
  465    H    GLN  64           HN       GLN  64  15.851   8.192  -4.985
  466    HA   GLN  64           HA       GLN  64  18.413   8.397  -3.727
  467    HB2  GLN  64           HB2      GLN  64  15.828   8.306  -2.204
  468    HB3  GLN  64           HB1      GLN  64  17.322   9.152  -1.797
  469    HG2  GLN  64           HG2      GLN  64  15.326   9.892  -3.919
  470    HG3  GLN  64           HG1      GLN  64  15.620  10.720  -2.399
  471   HE21  GLN  64          HE21      GLN  64  18.094   9.581  -4.669
  472   HE22  GLN  64          HE22      GLN  64  18.704  11.164  -5.040
  473    H    VAL  65           HN       VAL  65  19.412   7.053  -2.379
  474    HA   VAL  65           HA       VAL  65  18.483   4.334  -2.140
  475    HB   VAL  65           HB       VAL  65  20.971   5.776  -1.208
  476   HG11  VAL  65          HG11      VAL  65  21.835   3.610  -0.446
  477   HG12  VAL  65          HG12      VAL  65  20.254   2.885  -0.741
  478   HG13  VAL  65          HG13      VAL  65  20.439   4.127   0.497
  479   HG21  VAL  65          HG21      VAL  65  22.073   4.244  -2.774
  480   HG22  VAL  65          HG22      VAL  65  20.855   5.237  -3.573
  481   HG23  VAL  65          HG23      VAL  65  20.504   3.551  -3.186
  482    H    VAL  66           HN       VAL  66  17.165   3.691  -0.539
  483    HA   VAL  66           HA       VAL  66  16.963   5.436   1.812
  484    HB   VAL  66           HB       VAL  66  14.567   5.149   1.849
  485   HG11  VAL  66          HG11      VAL  66  15.631   6.199  -0.780
  486   HG12  VAL  66          HG12      VAL  66  15.360   7.112   0.702
  487   HG13  VAL  66          HG13      VAL  66  13.991   6.467  -0.193
  488   HG21  VAL  66          HG21      VAL  66  14.921   3.694  -0.767
  489   HG22  VAL  66          HG22      VAL  66  13.381   4.154  -0.048
  490   HG23  VAL  66          HG23      VAL  66  14.414   2.981   0.764
  491    H    THR  67           HN       THR  67  16.351   4.577   3.725
  492    HA   THR  67           HA       THR  67  16.622   1.678   4.003
  493    HB   THR  67           HB       THR  67  16.405   2.505   6.515
  494    HG1  THR  67           HG1      THR  67  17.526   4.586   6.620
  495   HG21  THR  67          HG21      THR  67  18.349   1.384   5.396
  496   HG22  THR  67          HG22      THR  67  18.737   2.484   6.722
  497   HG23  THR  67          HG23      THR  67  18.964   3.002   5.042
  498    H    VAL  68           HN       VAL  68  14.761   0.538   4.017
  499    HA   VAL  68           HA       VAL  68  12.563   1.730   5.557
  500    HB   VAL  68           HB       VAL  68  10.996   0.175   4.421
  501   HG11  VAL  68          HG11      VAL  68  11.254   2.493   3.658
  502   HG12  VAL  68          HG12      VAL  68  10.865   1.405   2.325
  503   HG13  VAL  68          HG13      VAL  68  12.517   1.980   2.540
  504   HG21  VAL  68          HG21      VAL  68  11.695  -0.936   2.354
  505   HG22  VAL  68          HG22      VAL  68  12.598  -1.536   3.746
  506   HG23  VAL  68          HG23      VAL  68  13.352  -0.403   2.627
  507    H    HIS  69           HN       HIS  69  11.626   0.507   7.182
  508    HA   HIS  69           HA       HIS  69  12.894  -2.096   7.695
  509    HB2  HIS  69           HB2      HIS  69  12.845  -0.620   9.668
  510    HB3  HIS  69           HB1      HIS  69  11.105  -0.421   9.494
  511    HD1  HIS  69           HD1      HIS  69  12.568  -1.743  12.071
  512    HD2  HIS  69           HD2      HIS  69  10.604  -3.743   8.997
  513    HE1  HIS  69           HE1      HIS  69  11.930  -4.024  12.974
  514    HE2  HIS  69           HE2      HIS  69  10.532  -5.046  11.214
  515    H    LEU  70           HN       LEU  70  11.773  -3.796   6.843
  516    HA   LEU  70           HA       LEU  70   8.872  -3.447   6.773
  517    HB2  LEU  70           HB2      LEU  70   8.613  -4.441   4.752
  518    HB3  LEU  70           HB1      LEU  70  10.162  -3.660   4.507
  519    HG   LEU  70           HG       LEU  70  10.021  -6.497   5.445
  520   HD11  LEU  70          HD11      LEU  70   9.966  -5.564   2.572
  521   HD12  LEU  70          HD12      LEU  70   8.639  -6.354   3.427
  522   HD13  LEU  70          HD13      LEU  70  10.139  -7.231   3.125
  523   HD21  LEU  70          HD21      LEU  70  12.039  -4.918   3.848
  524   HD22  LEU  70          HD22      LEU  70  12.196  -6.612   4.314
  525   HD23  LEU  70          HD23      LEU  70  12.171  -5.355   5.552
  526    H    GLN  71           HN       GLN  71   7.669  -4.887   7.674
  527    HA   GLN  71           HA       GLN  71   8.651  -7.629   7.984
  528    HB2  GLN  71           HB2      GLN  71   6.732  -6.709  10.031
  529    HB3  GLN  71           HB1      GLN  71   8.022  -7.888  10.173
  530    HG2  GLN  71           HG2      GLN  71   8.853  -6.302  11.529
  531    HG3  GLN  71           HG1      GLN  71   9.541  -5.768  10.003
  532   HE21  GLN  71          HE21      GLN  71   6.804  -4.907   9.156
  533   HE22  GLN  71          HE22      GLN  71   6.614  -3.373   9.923
  534    H    THR  72           HN       THR  72   7.398  -8.789   6.846
  535    HA   THR  72           HA       THR  72   4.967  -7.522   5.861
  536    HB   THR  72           HB       THR  72   6.683  -9.677   4.659
  537    HG1  THR  72           HG1      THR  72   7.656  -8.070   3.570
  538   HG21  THR  72          HG21      THR  72   5.388  -9.208   2.620
  539   HG22  THR  72          HG22      THR  72   4.372  -8.104   3.550
  540   HG23  THR  72          HG23      THR  72   4.380  -9.826   3.929
  541    H    SER  73           HN       SER  73   3.071  -8.390   6.204
  542    HA   SER  73           HA       SER  73   2.966 -11.018   7.505
  543    HB2  SER  73           HB2      SER  73   2.180  -8.907   8.764
  544    HB3  SER  73           HB1      SER  73   0.859  -8.837   7.604
  545    HG   SER  73           HG       SER  73   1.038 -10.317   9.804
  546    H    LEU  74           HN       LEU  74   1.158 -12.330   6.975
  547    HA   LEU  74           HA       LEU  74   0.309 -12.135   4.220
  548    HB2  LEU  74           HB2      LEU  74  -0.262 -14.127   6.406
  549    HB3  LEU  74           HB1      LEU  74  -0.892 -14.264   4.781
  550    HG   LEU  74           HG       LEU  74   1.939 -14.528   5.718
  551   HD11  LEU  74          HD11      LEU  74   0.180 -16.242   3.982
  552   HD12  LEU  74          HD12      LEU  74   0.582 -16.541   5.672
  553   HD13  LEU  74          HD13      LEU  74   1.841 -16.602   4.441
  554   HD21  LEU  74          HD21      LEU  74   2.626 -14.559   3.353
  555   HD22  LEU  74          HD22      LEU  74   2.041 -12.977   3.878
  556   HD23  LEU  74          HD23      LEU  74   1.005 -14.026   2.900
  557    H    GLU  75           HN       GLU  75  -1.990 -12.301   3.675
  558    HA   GLU  75           HA       GLU  75  -3.661 -10.423   4.757
  559    HB2  GLU  75           HB2      GLU  75  -5.515 -11.935   3.779
  560    HB3  GLU  75           HB1      GLU  75  -4.298 -11.284   2.691
  561    HG2  GLU  75           HG2      GLU  75  -3.103 -13.371   2.684
  562    HG3  GLU  75           HG1      GLU  75  -4.190 -14.037   3.900
  563    H    ASN  76           HN       ASN  76  -2.835 -13.525   5.945
  564    HA   ASN  76           HA       ASN  76  -5.164 -13.764   7.674
  565    HB2  ASN  76           HB2      ASN  76  -4.300 -16.032   8.116
  566    HB3  ASN  76           HB1      ASN  76  -4.513 -15.715   6.401
  567   HD21  ASN  76          HD21      ASN  76  -3.074 -17.019   5.508
  568   HD22  ASN  76          HD22      ASN  76  -1.379 -17.013   5.842
  569    H    GLY  77           HN       GLY  77  -2.099 -12.427   7.848
  570    HA2  GLY  77           HA2      GLY  77  -1.569 -11.180   9.834
  571    HA3  GLY  77           HA1      GLY  77  -2.264 -12.477  10.788
  572    H    THR  78           HN       THR  78  -0.588 -14.186   8.642
  573    HA   THR  78           HA       THR  78   1.576 -14.613  10.450
  574    HB   THR  78           HB       THR  78   1.167 -15.745   7.683
  575    HG1  THR  78           HG1      THR  78  -0.035 -17.241   8.623
  576   HG21  THR  78          HG21      THR  78   3.502 -15.895   8.434
  577   HG22  THR  78          HG22      THR  78   2.738 -17.482   8.363
  578   HG23  THR  78          HG23      THR  78   2.969 -16.685   9.919
  579    H    ARG  79           HN       ARG  79   3.190 -13.212  10.629
  580    HA   ARG  79           HA       ARG  79   4.130 -11.722   8.354
  581    HB2  ARG  79           HB2      ARG  79   5.118 -11.932  11.187
  582    HB3  ARG  79           HB1      ARG  79   5.914 -10.949   9.954
  583    HG2  ARG  79           HG2      ARG  79   3.371 -10.138   9.646
  584    HG3  ARG  79           HG1      ARG  79   3.373 -10.512  11.373
  585    HD2  ARG  79           HD2      ARG  79   5.171  -9.012  11.773
  586    HD3  ARG  79           HD1      ARG  79   5.456  -8.791  10.042
  587    HE   ARG  79           HE       ARG  79   2.896  -7.943  10.382
  588   HH11  ARG  79          HH11      ARG  79   5.880  -7.090  12.000
  589   HH12  ARG  79          HH12      ARG  79   5.418  -5.439  12.257
  590   HH21  ARG  79          HH21      ARG  79   2.290  -5.766  10.707
  591   HH22  ARG  79          HH22      ARG  79   3.396  -4.670  11.505
  592    H    VAL  80           HN       VAL  80   5.290 -12.502   6.874
  593    HA   VAL  80           HA       VAL  80   6.540 -15.097   7.229
  594    HB   VAL  80           HB       VAL  80   6.601 -15.155   4.780
  595   HG11  VAL  80          HG11      VAL  80   4.621 -15.956   5.902
  596   HG12  VAL  80          HG12      VAL  80   4.173 -15.152   4.398
  597   HG13  VAL  80          HG13      VAL  80   3.953 -14.324   5.939
  598   HG21  VAL  80          HG21      VAL  80   5.346 -12.417   4.923
  599   HG22  VAL  80          HG22      VAL  80   5.585 -13.367   3.456
  600   HG23  VAL  80          HG23      VAL  80   6.978 -12.774   4.360
  601    H    GLN  81           HN       GLN  81   7.489 -11.866   7.167
  602    HA   GLN  81           HA       GLN  81  10.266 -12.579   7.076
  603    HB2  GLN  81           HB2      GLN  81  10.837 -11.084   5.180
  604    HB3  GLN  81           HB1      GLN  81   9.858 -12.459   4.694
  605    HG2  GLN  81           HG2      GLN  81   7.860 -10.935   4.814
  606    HG3  GLN  81           HG1      GLN  81   8.996  -9.598   4.982
  607   HE21  GLN  81          HE21      GLN  81   7.749 -12.055   2.893
  608   HE22  GLN  81          HE22      GLN  81   8.410 -11.449   1.420
  609    H    GLU  82           HN       GLU  82  11.226 -11.401   8.570
  610    HA   GLU  82           HA       GLU  82  10.267  -8.653   8.987
  611    HB2  GLU  82           HB2      GLU  82   9.856  -9.995  10.980
  612    HB3  GLU  82           HB1      GLU  82  11.532 -10.525  10.994
  613    HG2  GLU  82           HG2      GLU  82  12.285  -8.278  11.416
  614    HG3  GLU  82           HG1      GLU  82  10.632  -7.685  11.309
  615    H    GLU  83           HN       GLU  83  11.647  -7.129   8.497
  616    HA   GLU  83           HA       GLU  83  14.498  -7.630   8.624
  617    HB2  GLU  83           HB2      GLU  83  14.062  -8.333   6.412
  618    HB3  GLU  83           HB1      GLU  83  12.928  -7.027   6.130
  619    HG2  GLU  83           HG2      GLU  83  14.568  -5.512   5.677
  620    HG3  GLU  83           HG1      GLU  83  15.788  -6.372   6.626
  621    HA   PRO  84           HA       PRO  84  13.724  -3.762  10.578
  622    HB2  PRO  84           HB2      PRO  84  16.212  -3.467  11.624
  623    HB3  PRO  84           HB1      PRO  84  15.003  -4.565  12.299
  624    HG2  PRO  84           HG2      PRO  84  17.302  -5.162  10.479
  625    HG3  PRO  84           HG1      PRO  84  16.739  -6.055  11.905
  626    HD2  PRO  84           HD2      PRO  84  16.143  -6.835   9.386
  627    HD3  PRO  84           HD1      PRO  84  15.033  -7.086  10.747
  628    H    GLU  85           HN       GLU  85  16.054  -4.291   8.075
  629    HA   GLU  85           HA       GLU  85  16.027  -1.514   7.375
  630    HB2  GLU  85           HB2      GLU  85  17.738  -1.729   9.254
  631    HB3  GLU  85           HB1      GLU  85  18.696  -2.694   8.145
  632    HG2  GLU  85           HG2      GLU  85  19.147  -0.904   6.764
  633    HG3  GLU  85           HG1      GLU  85  17.784   0.039   7.375
  634    H    LEU  86           HN       LEU  86  15.373  -1.969   5.497
  635    HA   LEU  86           HA       LEU  86  17.090  -3.511   3.700
  636    HB2  LEU  86           HB2      LEU  86  14.852  -4.406   3.822
  637    HB3  LEU  86           HB1      LEU  86  14.164  -2.813   3.598
  638    HG   LEU  86           HG       LEU  86  14.967  -2.735   1.341
  639   HD11  LEU  86          HD11      LEU  86  16.004  -4.709   0.289
  640   HD12  LEU  86          HD12      LEU  86  16.089  -5.480   1.874
  641   HD13  LEU  86          HD13      LEU  86  17.015  -4.012   1.559
  642   HD21  LEU  86          HD21      LEU  86  13.574  -4.534   0.394
  643   HD22  LEU  86          HD22      LEU  86  12.782  -3.702   1.734
  644   HD23  LEU  86          HD23      LEU  86  13.512  -5.287   1.989
  645    H    VAL  87           HN       VAL  87  18.331  -2.230   2.487
  646    HA   VAL  87           HA       VAL  87  17.342   0.479   1.892
  647    HB   VAL  87           HB       VAL  87  19.359   0.361   3.351
  648   HG11  VAL  87          HG11      VAL  87  21.523  -0.232   2.378
  649   HG12  VAL  87          HG12      VAL  87  20.702  -0.795   0.921
  650   HG13  VAL  87          HG13      VAL  87  20.427  -1.611   2.460
  651   HG21  VAL  87          HG21      VAL  87  20.678   2.021   2.121
  652   HG22  VAL  87          HG22      VAL  87  18.945   2.337   2.031
  653   HG23  VAL  87          HG23      VAL  87  19.782   1.625   0.655
  654    H    PHE  88           HN       PHE  88  17.250   1.126  -0.215
  655    HA   PHE  88           HA       PHE  88  18.360  -0.502  -2.357
  656    HB2  PHE  88           HB2      PHE  88  16.230  -1.105  -3.332
  657    HB3  PHE  88           HB1      PHE  88  16.342  -1.759  -1.703
  658    HD1  PHE  88           HD2      PHE  88  15.196  -0.478   0.159
  659    HD2  PHE  88           HD1      PHE  88  14.413   0.209  -3.965
  660    HE1  PHE  88           HE2      PHE  88  13.067   0.599   0.749
  661    HE2  PHE  88           HE1      PHE  88  12.279   1.287  -3.392
  662    HZ   PHE  88           HZ       PHE  88  11.558   1.428  -1.092
  663    H    THR  89           HN       THR  89  17.842   0.381  -4.475
  664    HA   THR  89           HA       THR  89  17.738   3.265  -4.473
  665    HB   THR  89           HB       THR  89  17.682   1.539  -6.942
  666    HG1  THR  89           HG1      THR  89  19.512   0.691  -6.303
  667   HG21  THR  89          HG21      THR  89  19.017   4.182  -6.319
  668   HG22  THR  89          HG22      THR  89  17.489   3.986  -7.180
  669   HG23  THR  89          HG23      THR  89  18.986   3.373  -7.885
  670    H    LEU  90           HN       LEU  90  15.811   4.230  -4.321
  671    HA   LEU  90           HA       LEU  90  13.328   3.016  -4.740
  672    HB2  LEU  90           HB2      LEU  90  13.886   5.184  -3.497
  673    HB3  LEU  90           HB1      LEU  90  13.812   5.961  -5.034
  674    HG   LEU  90           HG       LEU  90  11.501   5.377  -5.309
  675   HD11  LEU  90          HD11      LEU  90  11.757   3.947  -2.664
  676   HD12  LEU  90          HD12      LEU  90  11.618   3.166  -4.239
  677   HD13  LEU  90          HD13      LEU  90  10.282   4.133  -3.616
  678   HD21  LEU  90          HD21      LEU  90  12.056   6.461  -2.551
  679   HD22  LEU  90          HD22      LEU  90  10.536   6.617  -3.428
  680   HD23  LEU  90          HD23      LEU  90  11.991   7.399  -4.044
  681    H    GLY  91           HN       GLY  91  12.280   2.475  -6.544
  682    HA2  GLY  91           HA2      GLY  91  11.297   2.863  -8.609
  683    HA3  GLY  91           HA1      GLY  91  12.314   4.271  -8.801
  684    H    ASP  92           HN       ASP  92  14.226   1.790  -7.836
  685    HA   ASP  92           HA       ASP  92  15.113   1.216 -10.559
  686    HB2  ASP  92           HB2      ASP  92  16.791   1.737  -8.790
  687    HB3  ASP  92           HB1      ASP  92  16.246   0.326  -7.894
  688    H    CYS  93           HN       CYS  93  12.909   0.214  -8.375
  689    HA   CYS  93           HA       CYS  93  11.658  -1.636  -8.015
  690    HB2  CYS  93           HB2      CYS  93  12.661  -2.497 -10.734
  691    HB3  CYS  93           HB1      CYS  93  11.221  -3.082  -9.908
  692    HG   CYS  93           HG       CYS  93  10.917   0.139 -10.037
  693    H    ASP  94           HN       ASP  94  14.409  -1.589  -7.095
  694    HA   ASP  94           HA       ASP  94  15.661  -4.083  -7.538
  695    HB2  ASP  94           HB2      ASP  94  16.716  -1.958  -6.630
  696    HB3  ASP  94           HB1      ASP  94  15.934  -2.326  -5.097
  697    H    VAL  95           HN       VAL  95  12.977  -3.089  -5.832
  698    HA   VAL  95           HA       VAL  95  13.011  -5.377  -3.975
  699    HB   VAL  95           HB       VAL  95  11.346  -3.938  -2.688
  700   HG11  VAL  95          HG11      VAL  95  14.154  -2.899  -3.036
  701   HG12  VAL  95          HG12      VAL  95  13.678  -4.244  -1.999
  702   HG13  VAL  95          HG13      VAL  95  13.113  -2.611  -1.641
  703   HG21  VAL  95          HG21      VAL  95  10.775  -2.400  -4.489
  704   HG22  VAL  95          HG22      VAL  95  12.452  -1.852  -4.580
  705   HG23  VAL  95          HG23      VAL  95  11.484  -1.510  -3.141
  706    H    ILE  96           HN       ILE  96  10.263  -5.028  -3.259
  707    HA   ILE  96           HA       ILE  96   8.949  -6.159  -5.566
  708    HB   ILE  96           HB       ILE  96   6.970  -6.320  -4.069
  709   HG12  ILE  96          HG12      ILE  96   8.850  -5.249  -1.954
  710   HG13  ILE  96          HG11      ILE  96   7.477  -4.378  -2.631
  711   HG21  ILE  96          HG21      ILE  96   9.532  -7.494  -3.002
  712   HG22  ILE  96          HG22      ILE  96   8.475  -8.191  -4.230
  713   HG23  ILE  96          HG23      ILE  96   7.912  -8.038  -2.567
  714   HD11  ILE  96          HD11      ILE  96   6.918  -5.289  -0.470
  715   HD12  ILE  96          HD12      ILE  96   7.359  -6.910  -1.006
  716   HD13  ILE  96          HD13      ILE  96   5.973  -6.090  -1.722
  717    H    GLN  97           HN       GLN  97   7.446  -5.097  -6.762
  718    HA   GLN  97           HA       GLN  97   7.858  -2.370  -7.101
  719    HB2  GLN  97           HB2      GLN  97   6.914  -3.992  -8.809
  720    HB3  GLN  97           HB1      GLN  97   5.355  -3.771  -8.017
  721    HG2  GLN  97           HG2      GLN  97   5.395  -2.276  -9.841
  722    HG3  GLN  97           HG1      GLN  97   5.631  -1.308  -8.389
  723   HE21  GLN  97          HE21      GLN  97   7.780  -0.547  -7.920
  724   HE22  GLN  97          HE22      GLN  97   8.916  -0.322  -9.199
  725    H    ALA  98           HN       ALA  98   5.510  -4.068  -5.158
  726    HA   ALA  98           HA       ALA  98   3.743  -2.016  -4.513
  727    HB1  ALA  98           HB1      ALA  98   4.803  -4.232  -2.766
  728    HB2  ALA  98           HB2      ALA  98   3.367  -4.287  -3.789
  729    HB3  ALA  98           HB3      ALA  98   3.408  -3.225  -2.384
  730    H    LEU  99           HN       LEU  99   6.880  -2.824  -3.141
  731    HA   LEU  99           HA       LEU  99   6.735  -0.747  -1.149
  732    HB2  LEU  99           HB2      LEU  99   7.989  -2.789  -0.676
  733    HB3  LEU  99           HB1      LEU  99   9.081  -2.434  -2.006
  734    HG   LEU  99           HG       LEU  99   9.813  -0.380  -0.833
  735   HD11  LEU  99          HD11      LEU  99   9.207  -0.066   1.520
  736   HD12  LEU  99          HD12      LEU  99   8.079  -1.416   1.404
  737   HD13  LEU  99          HD13      LEU  99   7.799   0.047   0.462
  738   HD21  LEU  99          HD21      LEU  99  11.106  -2.408  -0.579
  739   HD22  LEU  99          HD22      LEU  99  10.066  -2.932   0.747
  740   HD23  LEU  99          HD23      LEU  99  11.086  -1.505   0.937
  741    H    ASP 100           HN       ASP 100   8.199  -1.205  -4.271
  742    HA   ASP 100           HA       ASP 100  10.029   0.938  -4.237
  743    HB2  ASP 100           HB2      ASP 100  10.048  -0.975  -5.833
  744    HB3  ASP 100           HB1      ASP 100   8.620  -0.311  -6.602
  745    H    LEU 101           HN       LEU 101   6.636   0.683  -4.914
  746    HA   LEU 101           HA       LEU 101   6.448   3.450  -5.734
  747    HB2  LEU 101           HB2      LEU 101   4.320   1.352  -5.341
  748    HB3  LEU 101           HB1      LEU 101   4.076   2.929  -6.042
  749    HG   LEU 101           HG       LEU 101   5.723   0.696  -7.211
  750   HD11  LEU 101          HD11      LEU 101   4.038   0.701  -8.976
  751   HD12  LEU 101          HD12      LEU 101   3.143   1.960  -8.126
  752   HD13  LEU 101          HD13      LEU 101   3.318   0.361  -7.402
  753   HD21  LEU 101          HD21      LEU 101   5.205   3.462  -8.298
  754   HD22  LEU 101          HD22      LEU 101   6.043   2.155  -9.139
  755   HD23  LEU 101          HD23      LEU 101   6.747   2.860  -7.683
  756    H    SER 102           HN       SER 102   5.752   1.478  -2.907
  757    HA   SER 102           HA       SER 102   3.953   3.286  -1.678
  758    HB2  SER 102           HB2      SER 102   3.903   1.030  -0.917
  759    HB3  SER 102           HB1      SER 102   5.627   1.036  -0.551
  760    HG   SER 102           HG       SER 102   4.921   2.861   0.954
  761    H    VAL 103           HN       VAL 103   7.413   3.033  -1.694
  762    HA   VAL 103           HA       VAL 103   7.928   4.567   0.610
  763    HB   VAL 103           HB       VAL 103   9.595   3.898  -1.776
  764   HG11  VAL 103          HG11      VAL 103  11.538   4.731  -0.559
  765   HG12  VAL 103          HG12      VAL 103  10.519   5.197   0.801
  766   HG13  VAL 103          HG13      VAL 103  10.363   6.033  -0.743
  767   HG21  VAL 103          HG21      VAL 103   9.250   1.951  -0.546
  768   HG22  VAL 103          HG22      VAL 103   9.256   2.809   0.993
  769   HG23  VAL 103          HG23      VAL 103  10.766   2.558   0.125
  770    HA   PRO 104           HA       PRO 104   8.708   8.304  -2.395
  771    HB2  PRO 104           HB2      PRO 104   7.434   8.122  -4.831
  772    HB3  PRO 104           HB1      PRO 104   9.139   7.743  -4.572
  773    HG2  PRO 104           HG2      PRO 104   6.792   5.901  -4.746
  774    HG3  PRO 104           HG1      PRO 104   8.425   5.701  -5.400
  775    HD2  PRO 104           HD2      PRO 104   7.646   4.441  -3.174
  776    HD3  PRO 104           HD1      PRO 104   9.301   5.034  -3.387
  777    H    LEU 105           HN       LEU 105   5.745   6.450  -2.414
  778    HA   LEU 105           HA       LEU 105   3.996   8.726  -2.394
  779    HB2  LEU 105           HB2      LEU 105   3.709   5.807  -1.789
  780    HB3  LEU 105           HB1      LEU 105   2.395   6.918  -1.417
  781    HG   LEU 105           HG       LEU 105   3.396   5.959  -4.049
  782   HD11  LEU 105          HD11      LEU 105   0.686   6.577  -2.893
  783   HD12  LEU 105          HD12      LEU 105   1.420   4.985  -3.078
  784   HD13  LEU 105          HD13      LEU 105   0.979   5.920  -4.506
  785   HD21  LEU 105          HD21      LEU 105   2.359   7.832  -5.222
  786   HD22  LEU 105          HD22      LEU 105   3.691   8.393  -4.211
  787   HD23  LEU 105          HD23      LEU 105   2.024   8.627  -3.685
  788    H    MET 106           HN       MET 106   5.696   6.870  -0.002
  789    HA   MET 106           HA       MET 106   4.216   8.057   2.192
  790    HB2  MET 106           HB2      MET 106   4.909   6.272   3.367
  791    HB3  MET 106           HB1      MET 106   5.478   5.621   1.840
  792    HG2  MET 106           HG2      MET 106   7.640   6.951   2.393
  793    HG3  MET 106           HG1      MET 106   6.998   6.926   4.042
  794    HE1  MET 106           HE1      MET 106   6.741   4.745   5.508
  795    HE2  MET 106           HE2      MET 106   6.830   3.115   4.833
  796    HE3  MET 106           HE3      MET 106   5.561   4.219   4.311
  797    H    ASP 107           HN       ASP 107   5.351   9.247   3.907
  798    HA   ASP 107           HA       ASP 107   7.554  10.806   2.733
  799    HB2  ASP 107           HB2      ASP 107   7.048  12.548   4.435
  800    HB3  ASP 107           HB1      ASP 107   5.748  12.254   3.301
  801    H    VAL 108           HN       VAL 108   9.242  11.615   4.179
  802    HA   VAL 108           HA       VAL 108  10.585   9.400   5.254
  803    HB   VAL 108           HB       VAL 108  11.150  12.330   5.146
  804   HG11  VAL 108          HG11      VAL 108  12.773  10.360   6.752
  805   HG12  VAL 108          HG12      VAL 108  11.873  11.736   7.391
  806   HG13  VAL 108          HG13      VAL 108  13.268  12.003   6.345
  807   HG21  VAL 108          HG21      VAL 108  11.652  10.869   3.242
  808   HG22  VAL 108          HG22      VAL 108  12.689   9.886   4.276
  809   HG23  VAL 108          HG23      VAL 108  13.119  11.562   3.932
  810    H    GLY 109           HN       GLY 109  10.477   8.466   7.106
  811    HA2  GLY 109           HA2      GLY 109  10.723   8.456   9.458
  812    HA3  GLY 109           HA1      GLY 109  10.040  10.071   9.511
  813    H    GLU 110           HN       GLU 110   8.211   8.114   7.472
  814    HA   GLU 110           HA       GLU 110   6.233   7.849   9.586
  815    HB2  GLU 110           HB2      GLU 110   4.557   7.772   7.968
  816    HB3  GLU 110           HB1      GLU 110   5.685   8.967   7.342
  817    HG2  GLU 110           HG2      GLU 110   6.253   7.684   5.567
  818    HG3  GLU 110           HG1      GLU 110   6.033   6.168   6.445
  819    H    THR 111           HN       THR 111   4.822   5.909   9.464
  820    HA   THR 111           HA       THR 111   6.262   3.529   8.551
  821    HB   THR 111           HB       THR 111   4.618   3.639  11.090
  822    HG1  THR 111           HG1      THR 111   7.020   4.620  10.735
  823   HG21  THR 111          HG21      THR 111   5.639   1.458  11.534
  824   HG22  THR 111          HG22      THR 111   6.504   1.545  10.000
  825   HG23  THR 111          HG23      THR 111   4.744   1.435  10.013
  826    H    ALA 112           HN       ALA 112   5.107   2.540   7.063
  827    HA   ALA 112           HA       ALA 112   2.219   3.092   6.984
  828    HB1  ALA 112           HB1      ALA 112   4.151   2.758   4.710
  829    HB2  ALA 112           HB2      ALA 112   3.390   4.262   5.238
  830    HB3  ALA 112           HB3      ALA 112   2.407   2.966   4.550
  831    H    MET 113           HN       MET 113   0.917   1.375   6.972
  832    HA   MET 113           HA       MET 113   2.121  -1.236   6.414
  833    HB2  MET 113           HB2      MET 113   0.847  -1.247   8.457
  834    HB3  MET 113           HB1      MET 113  -0.529  -0.485   7.665
  835    HG2  MET 113           HG2      MET 113  -1.135  -2.413   6.559
  836    HG3  MET 113           HG1      MET 113   0.461  -3.135   6.704
  837    HE1  MET 113           HE1      MET 113  -2.928  -2.348   8.434
  838    HE2  MET 113           HE2      MET 113  -1.794  -1.385   9.379
  839    HE3  MET 113           HE3      MET 113  -2.600  -2.771  10.116
  840    H    VAL 114           HN       VAL 114   1.939  -1.972   4.443
  841    HA   VAL 114           HA       VAL 114  -0.092  -0.772   2.666
  842    HB   VAL 114           HB       VAL 114   2.401  -2.248   1.863
  843   HG11  VAL 114          HG11      VAL 114   0.704  -0.280   0.353
  844   HG12  VAL 114          HG12      VAL 114   0.735  -2.027   0.110
  845   HG13  VAL 114          HG13      VAL 114   2.166  -1.060  -0.249
  846   HG21  VAL 114          HG21      VAL 114   2.088   0.704   2.246
  847   HG22  VAL 114          HG22      VAL 114   3.513  -0.120   1.604
  848   HG23  VAL 114          HG23      VAL 114   3.014  -0.385   3.278
  849    H    THR 115           HN       THR 115  -1.557  -2.115   1.696
  850    HA   THR 115           HA       THR 115  -0.967  -4.983   1.927
  851    HB   THR 115           HB       THR 115  -3.692  -3.736   1.504
  852    HG1  THR 115           HG1      THR 115  -2.257  -4.516   3.759
  853   HG21  THR 115          HG21      THR 115  -2.855  -6.582   2.017
  854   HG22  THR 115          HG22      THR 115  -3.349  -5.943   0.448
  855   HG23  THR 115          HG23      THR 115  -4.505  -6.010   1.784
  856    H    ALA 116           HN       ALA 116  -0.170  -5.744   0.209
  857    HA   ALA 116           HA       ALA 116  -1.009  -4.680  -2.421
  858    HB1  ALA 116           HB1      ALA 116   1.720  -5.699  -1.637
  859    HB2  ALA 116           HB2      ALA 116   1.284  -4.002  -1.840
  860    HB3  ALA 116           HB3      ALA 116   1.240  -5.096  -3.222
  861    H    ASP 117           HN       ASP 117  -1.836  -6.206  -3.747
  862    HA   ASP 117           HA       ASP 117  -2.124  -8.891  -3.144
  863    HB2  ASP 117           HB2      ASP 117  -3.192  -7.665  -5.110
  864    HB3  ASP 117           HB1      ASP 117  -1.657  -7.855  -5.926
  865    H    SER 118           HN       SER 118  -0.919 -10.731  -3.622
  866    HA   SER 118           HA       SER 118   1.806 -10.630  -3.242
  867    HB2  SER 118           HB2      SER 118   0.081 -12.615  -3.186
  868    HB3  SER 118           HB1      SER 118   0.611 -12.859  -4.849
  869    HG   SER 118           HG       SER 118   1.785 -13.995  -3.074
  870    H    LYS 119           HN       LYS 119  -0.011 -10.311  -6.193
  871    HA   LYS 119           HA       LYS 119   1.938 -10.722  -8.118
  872    HB2  LYS 119           HB2      LYS 119   0.667  -9.020  -9.451
  873    HB3  LYS 119           HB1      LYS 119  -0.310 -10.323  -8.781
  874    HG2  LYS 119           HG2      LYS 119  -1.039  -8.846  -6.999
  875    HG3  LYS 119           HG1      LYS 119  -0.008  -7.562  -7.636
  876    HD2  LYS 119           HD2      LYS 119  -2.265  -7.178  -8.354
  877    HD3  LYS 119           HD1      LYS 119  -1.296  -7.644  -9.755
  878    HE2  LYS 119           HE2      LYS 119  -2.133  -9.993  -9.401
  879    HE3  LYS 119           HE1      LYS 119  -3.250  -9.336  -8.207
  880    HZ1  LYS 119           HZ1      LYS 119  -4.431  -9.461 -10.220
  881    HZ2  LYS 119           HZ2      LYS 119  -3.162  -8.773 -11.113
  882    HZ3  LYS 119           HZ3      LYS 119  -4.048  -7.816 -10.023
  883    H    TYR 120           HN       TYR 120   1.509  -7.936  -5.982
  884    HA   TYR 120           HA       TYR 120   3.746  -6.558  -7.279
  885    HB2  TYR 120           HB2      TYR 120   1.872  -5.664  -5.074
  886    HB3  TYR 120           HB1      TYR 120   3.176  -4.683  -5.743
  887    HD1  TYR 120           HD1      TYR 120   3.073  -4.028  -8.164
  888    HD2  TYR 120           HD2      TYR 120  -0.197  -5.818  -6.124
  889    HE1  TYR 120           HE1      TYR 120   1.556  -3.146  -9.867
  890    HE2  TYR 120           HE2      TYR 120  -1.741  -4.939  -7.834
  891    HH   TYR 120           HH       TYR 120  -1.801  -3.061  -9.455
  892    H    CYS 121           HN       CYS 121   3.418  -8.928  -5.216
  893    HA   CYS 121           HA       CYS 121   5.650  -8.085  -3.510
  894    HB2  CYS 121           HB2      CYS 121   3.357  -9.906  -2.785
  895    HB3  CYS 121           HB1      CYS 121   4.716  -9.517  -1.738
  896    HG   CYS 121           HG       CYS 121   1.880  -7.935  -2.093
  897    H    TYR 122           HN       TYR 122   4.225 -11.332  -3.578
  898    HA   TYR 122           HA       TYR 122   6.411 -12.259  -5.287
  899    HB2  TYR 122           HB2      TYR 122   5.887 -13.660  -2.669
  900    HB3  TYR 122           HB1      TYR 122   7.237 -13.859  -3.768
  901    HD1  TYR 122           HD2      TYR 122   9.033 -12.156  -3.878
  902    HD2  TYR 122           HD1      TYR 122   5.913 -11.933  -0.993
  903    HE1  TYR 122           HE2      TYR 122  10.366 -10.578  -2.564
  904    HE2  TYR 122           HE1      TYR 122   7.242 -10.352   0.328
  905    HH   TYR 122           HH       TYR 122  10.052  -8.833  -0.872
  906    H    GLY 123           HN       GLY 123   3.552 -12.150  -5.845
  907    HA2  GLY 123           HA2      GLY 123   2.140 -14.471  -5.410
  908    HA3  GLY 123           HA1      GLY 123   2.022 -13.513  -6.875
  909    HA   PRO 124           HA       PRO 124   3.864 -16.980  -8.967
  910    HB2  PRO 124           HB2      PRO 124   4.871 -15.318 -11.099
  911    HB3  PRO 124           HB1      PRO 124   3.440 -16.349 -11.100
  912    HG2  PRO 124           HG2      PRO 124   3.359 -13.607 -11.212
  913    HG3  PRO 124           HG1      PRO 124   2.039 -14.618 -10.597
  914    HD2  PRO 124           HD2      PRO 124   4.129 -13.095  -9.085
  915    HD3  PRO 124           HD1      PRO 124   2.400 -13.303  -8.721
  916    H    GLN 125           HN       GLN 125   5.536 -14.827  -7.295
  917    HA   GLN 125           HA       GLN 125   8.166 -15.341  -8.511
  918    HB2  GLN 125           HB2      GLN 125   7.442 -13.262  -6.448
  919    HB3  GLN 125           HB1      GLN 125   8.925 -13.359  -7.391
  920    HG2  GLN 125           HG2      GLN 125   7.775 -12.802  -9.396
  921    HG3  GLN 125           HG1      GLN 125   6.209 -12.948  -8.606
  922   HE21  GLN 125          HE21      GLN 125   5.512 -11.321  -7.231
  923   HE22  GLN 125          HE22      GLN 125   6.261  -9.771  -7.159
  924    H    GLY 126           HN       GLY 126   6.509 -15.114  -5.396
  925    HA2  GLY 126           HA2      GLY 126   6.714 -16.444  -3.537
  926    HA3  GLY 126           HA1      GLY 126   8.031 -17.308  -4.308
  927    H    SER 127           HN       SER 127   7.659 -16.111  -1.643
  928    HA   SER 127           HA       SER 127   9.534 -13.946  -1.585
  929    HB2  SER 127           HB2      SER 127   7.683 -13.498  -0.227
  930    HB3  SER 127           HB1      SER 127   7.626 -15.134   0.392
  931    HG   SER 127           HG       SER 127   9.428 -14.681   1.648
  932    H    ARG 128           HN       ARG 128  11.192 -13.847   0.130
  933    HA   ARG 128           HA       ARG 128  13.170 -15.680  -0.440
  934    HB2  ARG 128           HB2      ARG 128  14.481 -14.629   1.322
  935    HB3  ARG 128           HB1      ARG 128  13.595 -13.418   0.407
  936    HG2  ARG 128           HG2      ARG 128  11.930 -13.292   2.206
  937    HG3  ARG 128           HG1      ARG 128  12.845 -14.485   3.125
  938    HD2  ARG 128           HD2      ARG 128  13.552 -12.474   4.041
  939    HD3  ARG 128           HD1      ARG 128  14.818 -12.838   2.870
  940    HE   ARG 128           HE       ARG 128  12.920 -11.254   1.582
  941   HH11  ARG 128          HH11      ARG 128  15.264 -11.012   4.162
  942   HH12  ARG 128          HH12      ARG 128  15.428  -9.284   4.043
  943   HH21  ARG 128          HH21      ARG 128  13.135  -8.941   1.431
  944   HH22  ARG 128          HH22      ARG 128  14.225  -8.111   2.508
  945    H    SER 129           HN       SER 129  11.297 -15.533   2.617
  946    HA   SER 129           HA       SER 129  12.363 -18.077   3.398
  947    HB2  SER 129           HB2      SER 129  10.133 -16.492   4.667
  948    HB3  SER 129           HB1      SER 129  10.985 -17.859   5.383
  949    HG   SER 129           HG       SER 129  12.745 -16.641   5.668
  950    HA   PRO 130           HA       PRO 130   8.290 -19.788   1.963
  951    HB2  PRO 130           HB2      PRO 130   6.000 -18.276   2.247
  952    HB3  PRO 130           HB1      PRO 130   6.713 -19.236   3.542
  953    HG2  PRO 130           HG2      PRO 130   6.489 -16.402   3.433
  954    HG3  PRO 130           HG1      PRO 130   7.343 -17.358   4.651
  955    HD2  PRO 130           HD2      PRO 130   8.396 -16.019   2.196
  956    HD3  PRO 130           HD1      PRO 130   9.161 -16.225   3.780
  957    H    TYR 131           HN       TYR 131   8.291 -19.959  -0.296
  958    HA   TYR 131           HA       TYR 131   7.723 -17.973  -2.120
  959    HB2  TYR 131           HB2      TYR 131   8.384 -20.227  -2.806
  960    HB3  TYR 131           HB1      TYR 131   6.869 -20.881  -2.198
  961    HD1  TYR 131           HD1      TYR 131   4.710 -20.227  -3.374
  962    HD2  TYR 131           HD2      TYR 131   8.548 -19.351  -4.989
  963    HE1  TYR 131           HE1      TYR 131   3.694 -19.889  -5.585
  964    HE2  TYR 131           HE2      TYR 131   7.539 -19.003  -7.203
  965    HH   TYR 131           HH       TYR 131   4.203 -18.692  -7.677
  966    H    ILE 132           HN       ILE 132   6.192 -16.517  -1.550
  967    HA   ILE 132           HA       ILE 132   3.806 -17.128  -0.203
  968    HB   ILE 132           HB       ILE 132   4.342 -14.719  -1.940
  969   HG12  ILE 132          HG12      ILE 132   6.135 -14.817  -0.376
  970   HG13  ILE 132          HG11      ILE 132   5.011 -13.580   0.167
  971   HG21  ILE 132          HG21      ILE 132   2.469 -15.163   0.374
  972   HG22  ILE 132          HG22      ILE 132   2.021 -14.964  -1.325
  973   HG23  ILE 132          HG23      ILE 132   2.734 -13.616  -0.433
  974   HD11  ILE 132          HD11      ILE 132   5.908 -14.897   1.984
  975   HD12  ILE 132          HD12      ILE 132   5.206 -16.359   1.284
  976   HD13  ILE 132          HD13      ILE 132   4.154 -15.062   1.860
  977    HA   PRO 133           HA       PRO 133   1.413 -18.935  -3.528
  978    HB2  PRO 133           HB2      PRO 133  -1.043 -18.093  -2.455
  979    HB3  PRO 133           HB1      PRO 133  -0.250 -19.644  -2.166
  980    HG2  PRO 133           HG2      PRO 133  -0.286 -17.190  -0.484
  981    HG3  PRO 133           HG1      PRO 133  -0.238 -18.894   0.005
  982    HD2  PRO 133           HD2      PRO 133   1.938 -17.332   0.144
  983    HD3  PRO 133           HD1      PRO 133   2.051 -19.049  -0.299
  984    HA   PRO 134           HA       PRO 134   0.850 -15.451  -6.220
  985    HB2  PRO 134           HB2      PRO 134  -1.062 -17.244  -7.608
  986    HB3  PRO 134           HB1      PRO 134   0.341 -16.372  -8.245
  987    HG2  PRO 134           HG2      PRO 134   0.430 -19.013  -7.846
  988    HG3  PRO 134           HG1      PRO 134   1.837 -17.985  -7.513
  989    HD2  PRO 134           HD2      PRO 134  -0.114 -19.205  -5.601
  990    HD3  PRO 134           HD1      PRO 134   1.641 -18.987  -5.436
  991    H    HIS 135           HN       HIS 135  -0.365 -13.777  -5.929
  992    HA   HIS 135           HA       HIS 135  -2.163 -12.405  -5.787
  993    HB2  HIS 135           HB2      HIS 135  -3.763 -14.940  -6.165
  994    HB3  HIS 135           HB1      HIS 135  -4.499 -13.354  -5.985
  995    HD1  HIS 135           HD1      HIS 135  -3.094 -15.619  -8.464
  996    HD2  HIS 135           HD2      HIS 135  -3.815 -11.538  -8.146
  997    HE1  HIS 135           HE1      HIS 135  -3.021 -14.735 -10.813
  998    HE2  HIS 135           HE2      HIS 135  -3.635 -12.299 -10.619
  999    H    ALA 136           HN       ALA 136  -1.076 -14.300  -3.479
 1000    HA   ALA 136           HA       ALA 136  -3.164 -14.021  -1.523
 1001    HB1  ALA 136           HB1      ALA 136  -1.434 -15.751  -1.292
 1002    HB2  ALA 136           HB2      ALA 136  -1.479 -14.681   0.109
 1003    HB3  ALA 136           HB3      ALA 136  -0.210 -14.495  -1.102
 1004    H    ALA 137           HN       ALA 137  -3.597 -12.263  -0.279
 1005    HA   ALA 137           HA       ALA 137  -2.356  -9.818  -1.127
 1006    HB1  ALA 137           HB1      ALA 137  -4.432 -10.253   1.019
 1007    HB2  ALA 137           HB2      ALA 137  -4.765  -9.933  -0.681
 1008    HB3  ALA 137           HB3      ALA 137  -3.972  -8.708   0.309
 1009    H    LEU 138           HN       LEU 138  -0.481  -9.167  -0.362
 1010    HA   LEU 138           HA       LEU 138   0.440 -10.059   2.236
 1011    HB2  LEU 138           HB2      LEU 138   1.665  -9.329  -0.232
 1012    HB3  LEU 138           HB1      LEU 138   2.303  -8.301   1.037
 1013    HG   LEU 138           HG       LEU 138   3.011 -10.220   2.308
 1014   HD11  LEU 138          HD11      LEU 138   1.784 -11.866   0.111
 1015   HD12  LEU 138          HD12      LEU 138   1.145 -11.680   1.745
 1016   HD13  LEU 138          HD13      LEU 138   2.696 -12.482   1.491
 1017   HD21  LEU 138          HD21      LEU 138   4.648 -11.183   0.741
 1018   HD22  LEU 138          HD22      LEU 138   4.560  -9.420   0.655
 1019   HD23  LEU 138          HD23      LEU 138   3.788 -10.405  -0.589
 1020    H    CYS 139           HN       CYS 139   0.570  -8.806   4.008
 1021    HA   CYS 139           HA       CYS 139   0.000  -5.933   3.674
 1022    HB2  CYS 139           HB2      CYS 139  -1.709  -7.486   4.879
 1023    HB3  CYS 139           HB1      CYS 139  -0.542  -7.462   6.187
 1024    HG   CYS 139           HG       CYS 139  -1.781  -5.479   7.255
 1025    H    LEU 140           HN       LEU 140   1.957  -5.049   3.753
 1026    HA   LEU 140           HA       LEU 140   3.912  -6.074   5.699
 1027    HB2  LEU 140           HB2      LEU 140   5.600  -5.064   4.185
 1028    HB3  LEU 140           HB1      LEU 140   4.684  -6.377   3.471
 1029    HG   LEU 140           HG       LEU 140   3.261  -4.102   2.773
 1030   HD11  LEU 140          HD11      LEU 140   5.114  -2.709   3.537
 1031   HD12  LEU 140          HD12      LEU 140   4.952  -2.622   1.781
 1032   HD13  LEU 140          HD13      LEU 140   6.228  -3.604   2.505
 1033   HD21  LEU 140          HD21      LEU 140   5.342  -5.625   1.199
 1034   HD22  LEU 140          HD22      LEU 140   4.095  -4.582   0.515
 1035   HD23  LEU 140          HD23      LEU 140   3.640  -6.058   1.368
 1036    H    GLU 141           HN       GLU 141   4.854  -4.749   7.134
 1037    HA   GLU 141           HA       GLU 141   3.886  -1.981   7.208
 1038    HB2  GLU 141           HB2      GLU 141   3.434  -3.368   9.182
 1039    HB3  GLU 141           HB1      GLU 141   5.149  -3.711   9.340
 1040    HG2  GLU 141           HG2      GLU 141   5.514  -1.257   9.683
 1041    HG3  GLU 141           HG1      GLU 141   3.758  -1.081   9.744
 1042    H    VAL 142           HN       VAL 142   5.281  -0.471   6.483
 1043    HA   VAL 142           HA       VAL 142   8.144  -1.068   6.695
 1044    HB   VAL 142           HB       VAL 142   8.409   0.481   4.685
 1045   HG11  VAL 142          HG11      VAL 142   8.012  -1.361   3.119
 1046   HG12  VAL 142          HG12      VAL 142   7.043  -2.188   4.341
 1047   HG13  VAL 142          HG13      VAL 142   8.769  -1.932   4.610
 1048   HG21  VAL 142          HG21      VAL 142   5.471  -0.161   4.413
 1049   HG22  VAL 142          HG22      VAL 142   6.476   0.566   3.161
 1050   HG23  VAL 142          HG23      VAL 142   6.173   1.438   4.663
 1051    H    THR 143           HN       THR 143   9.219   0.204   8.003
 1052    HA   THR 143           HA       THR 143   8.341   2.943   8.529
 1053    HB   THR 143           HB       THR 143  10.771   1.470   9.605
 1054    HG1  THR 143           HG1      THR 143   8.105   1.710  10.575
 1055   HG21  THR 143          HG21      THR 143  10.645   3.220  11.387
 1056   HG22  THR 143          HG22      THR 143   9.435   4.055  10.413
 1057   HG23  THR 143          HG23      THR 143  11.073   3.838   9.792
 1058    H    LEU 144           HN       LEU 144   9.002   4.511   7.169
 1059    HA   LEU 144           HA       LEU 144  11.368   4.108   5.551
 1060    HB2  LEU 144           HB2      LEU 144   9.419   5.298   4.622
 1061    HB3  LEU 144           HB1      LEU 144   9.609   6.548   5.842
 1062    HG   LEU 144           HG       LEU 144  11.739   7.219   4.881
 1063   HD11  LEU 144          HD11      LEU 144  11.279   4.992   2.897
 1064   HD12  LEU 144          HD12      LEU 144  12.533   5.039   4.136
 1065   HD13  LEU 144          HD13      LEU 144  12.563   6.197   2.805
 1066   HD21  LEU 144          HD21      LEU 144   9.649   6.899   2.736
 1067   HD22  LEU 144          HD22      LEU 144  10.958   8.081   2.761
 1068   HD23  LEU 144          HD23      LEU 144   9.667   8.168   3.959
 1069    H    LYS 145           HN       LYS 145  13.164   4.135   6.591
 1070    HA   LYS 145           HA       LYS 145  13.396   5.496   9.117
 1071    HB2  LYS 145           HB2      LYS 145  15.696   4.103   7.819
 1072    HB3  LYS 145           HB1      LYS 145  15.192   4.099   9.506
 1073    HG2  LYS 145           HG2      LYS 145  13.317   2.628   8.945
 1074    HG3  LYS 145           HG1      LYS 145  13.826   2.626   7.256
 1075    HD2  LYS 145           HD2      LYS 145  14.565   0.604   8.423
 1076    HD3  LYS 145           HD1      LYS 145  15.941   1.575   7.896
 1077    HE2  LYS 145           HE2      LYS 145  16.187   2.499  10.089
 1078    HE3  LYS 145           HE1      LYS 145  14.731   1.644  10.635
 1079    HZ1  LYS 145           HZ1      LYS 145  16.539   0.396  11.407
 1080    HZ2  LYS 145           HZ2      LYS 145  17.387   0.520   9.943
 1081    HZ3  LYS 145           HZ3      LYS 145  15.999  -0.452  10.044
 1082    H    THR 146           HN       THR 146  14.932   5.642   5.927
 1083    HA   THR 146           HA       THR 146  15.629   8.409   6.328
 1084    HB   THR 146           HB       THR 146  17.895   6.518   5.691
 1085    HG1  THR 146           HG1      THR 146  16.755   7.030   8.148
 1086   HG21  THR 146          HG21      THR 146  17.850   9.363   6.726
 1087   HG22  THR 146          HG22      THR 146  18.174   8.874   5.062
 1088   HG23  THR 146          HG23      THR 146  19.294   8.420   6.346
 1089    H    ALA 147           HN       ALA 147  16.395   9.403   4.364
 1090    HA   ALA 147           HA       ALA 147  16.532   7.689   1.998
 1091    HB1  ALA 147           HB1      ALA 147  15.029  10.307   2.162
 1092    HB2  ALA 147           HB2      ALA 147  14.316   8.706   1.952
 1093    HB3  ALA 147           HB3      ALA 147  15.330   9.394   0.683
 1094    H    VAL 148           HN       VAL 148  18.380   8.056   0.879
 1095    HA   VAL 148           HA       VAL 148  19.664  10.683   1.284
 1096    HB   VAL 148           HB       VAL 148  21.868   9.675   1.275
 1097   HG11  VAL 148          HG11      VAL 148  20.053   8.330   3.274
 1098   HG12  VAL 148          HG12      VAL 148  20.765   9.937   3.431
 1099   HG13  VAL 148          HG13      VAL 148  21.801   8.507   3.429
 1100   HG21  VAL 148          HG21      VAL 148  22.210   7.260   1.339
 1101   HG22  VAL 148          HG22      VAL 148  21.411   7.744  -0.157
 1102   HG23  VAL 148          HG23      VAL 148  20.477   7.001   1.140
 1103    H    ASP 149           HN       ASP 149  20.623  11.604  -0.503
 1104    HA   ASP 149           HA       ASP 149  19.592  10.529  -2.992
 1105    HB2  ASP 149           HB2      ASP 149  19.181  12.832  -2.789
 1106    HB3  ASP 149           HB1      ASP 149  20.827  13.173  -2.238
 1107    H    LEU 150           HN       LEU 150  20.765   9.245  -4.210
 1108    HA   LEU 150           HA       LEU 150  23.663   9.652  -4.355
 1109    HB2  LEU 150           HB2      LEU 150  22.892   7.754  -2.773
 1110    HB3  LEU 150           HB1      LEU 150  22.462   6.896  -4.239
 1111    HG   LEU 150           HG       LEU 150  24.818   7.039  -4.990
 1112   HD11  LEU 150          HD11      LEU 150  25.455   9.073  -3.830
 1113   HD12  LEU 150          HD12      LEU 150  26.528   7.753  -3.360
 1114   HD13  LEU 150          HD13      LEU 150  25.242   8.278  -2.272
 1115   HD21  LEU 150          HD21      LEU 150  24.032   5.062  -3.796
 1116   HD22  LEU 150          HD22      LEU 150  24.417   5.825  -2.254
 1117   HD23  LEU 150          HD23      LEU 150  25.708   5.413  -3.381
 1118    H    GLU 151           HN       GLU 151  20.954   9.823  -5.944
 1119    HA   GLU 151           HA       GLU 151  21.873   8.427  -8.370
 1120    HB2  GLU 151           HB2      GLU 151  19.410   8.298  -7.123
 1121    HB3  GLU 151           HB1      GLU 151  19.143   9.494  -8.386
 1122    HG2  GLU 151           HG2      GLU 151  20.226   6.720  -8.815
 1123    HG3  GLU 151           HG1      GLU 151  18.550   7.218  -9.087
 1124    H    HIS 152           HN       HIS 152  22.751   9.748  -9.852
 1125    HA   HIS 152           HA       HIS 152  21.703  12.485 -10.020
 1126    HB2  HIS 152           HB2      HIS 152  24.635  11.720 -10.109
 1127    HB3  HIS 152           HB1      HIS 152  23.999  13.331 -10.443
 1128    HD1  HIS 152           HD1      HIS 152  25.467  11.488  -7.796
 1129    HD2  HIS 152           HD2      HIS 152  22.346  14.214  -8.038
 1130    HE1  HIS 152           HE1      HIS 152  25.118  12.316  -5.454
 1131    HE2  HIS 152           HE2      HIS 152  23.014  13.713  -5.593
 1132    H    HIS 153           HN       HIS 153  20.437  11.407 -11.652
 1133    HA   HIS 153           HA       HIS 153  21.668  10.398 -14.014
 1134    HB2  HIS 153           HB2      HIS 153  19.234  10.835 -14.935
 1135    HB3  HIS 153           HB1      HIS 153  19.561   9.520 -13.814
 1136    HD1  HIS 153           HD1      HIS 153  18.210   9.443 -11.748
 1137    HD2  HIS 153           HD2      HIS 153  18.059  13.182 -13.581
 1138    HE1  HIS 153           HE1      HIS 153  16.476  10.759 -10.476
 1139    HE2  HIS 153           HE2      HIS 153  16.588  13.080 -11.444
 1140    H    HIS 154           HN       HIS 154  22.528  11.432 -15.611
 1141    HA   HIS 154           HA       HIS 154  22.514  14.329 -15.577
 1142    HB2  HIS 154           HB2      HIS 154  24.010  12.397 -17.368
 1143    HB3  HIS 154           HB1      HIS 154  24.276  14.133 -17.280
 1144    HD1  HIS 154           HD1      HIS 154  25.328  15.050 -15.031
 1145    HD2  HIS 154           HD2      HIS 154  25.330  10.906 -15.440
 1146    HE1  HIS 154           HE1      HIS 154  26.968  14.194 -13.321
 1147    HE2  HIS 154           HE2      HIS 154  26.866  11.683 -13.497
 1148    H    HIS 155           HN       HIS 155  21.141  11.743 -17.475
 1149    HA   HIS 155           HA       HIS 155  20.069  13.749 -19.344
 1150    HB2  HIS 155           HB2      HIS 155  21.916  12.048 -20.144
 1151    HB3  HIS 155           HB1      HIS 155  20.559  10.932 -20.231
 1152    HD1  HIS 155           HD1      HIS 155  22.255  13.573 -22.071
 1153    HD2  HIS 155           HD2      HIS 155  18.479  11.830 -22.070
 1154    HE1  HIS 155           HE1      HIS 155  21.190  14.259 -24.248
 1155    HE2  HIS 155           HE2      HIS 155  19.018  12.981 -24.320
 1156    H    HIS 156           HN       HIS 156  18.206  13.849 -18.020
 1157    HA   HIS 156           HA       HIS 156  16.114  13.359 -17.344
 1158    HB2  HIS 156           HB2      HIS 156  16.330  11.579 -19.749
 1159    HB3  HIS 156           HB1      HIS 156  14.879  11.554 -18.747
 1160    HD1  HIS 156           HD1      HIS 156  15.872  12.962 -21.759
 1161    HD2  HIS 156           HD2      HIS 156  14.123  14.558 -18.341
 1162    HE1  HIS 156           HE1      HIS 156  14.785  15.105 -22.494
 1163    HE2  HIS 156           HE2      HIS 156  13.559  15.947 -20.456
 1164    H    HIS 157           HN       HIS 157  16.588  10.004 -18.298
 1165    HA   HIS 157           HA       HIS 157  17.682   9.034 -15.933
 1166    HB2  HIS 157           HB2      HIS 157  15.955   8.356 -14.572
 1167    HB3  HIS 157           HB1      HIS 157  15.257   9.831 -15.219
 1168    HD1  HIS 157           HD1      HIS 157  13.258   9.547 -16.889
 1169    HD2  HIS 157           HD2      HIS 157  14.674   5.999 -15.261
 1170    HE1  HIS 157           HE1      HIS 157  11.462   7.843 -17.321
 1171    HE2  HIS 157           HE2      HIS 157  12.247   5.770 -16.117