*HEADER    ANTIFREEZE PROTEIN                      14-NOV-04   1Y03              
*TITLE     SOLUTION STRUCTURE OF A RECOMBINANT TYPE I SCULPIN                    
*TITLE    2 ANTIFREEZE PROTEIN                                                   
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ANTIFREEZE PEPTIDE SS-3;                                   
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: RSS3;                                                       
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: MYOXOCEPHALUS SCORPIUS;                         
*SOURCE   3 ORGANISM_COMMON: SHORTHORN SCULPIN;                                  
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   8 EXPRESSION_SYSTEM_PLASMID: PGEX-2T                                   
*KEYWDS    TYPE I ANTIFREEZE PROTEIN, SCULPIN, NMR SPECTROSCOPY,                 
*KEYWDS   2 SOLUTION STRUCTURE, A-HELIX                                          
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    A.H.Y.KWAN, K.FAIRLEY, P.I.ANDERBERG, C.W.LIEW, M.M.HARDING,          
*AUTHOR   2 J.P.MACKAY                                                           
*REVDAT   1   15-MAR-05 1Y03    0                                                

 ASSI {    2}
   (( segid "    " and resid 3    and name HA  ))
   (( segid "    " and resid 3    and name HN  ))
      2.800     1.000     1.000 peak     2 spectrum    1 weight  0.10000E+01 volume  0.24396E-02 ppm1      4.519 ppm2      8.744 CV     1
 ASSI {    3}
   (( segid "    " and resid 3    and name HG2 ))
   (( segid "    " and resid 3    and name HN  ))
      3.300     1.400     1.400 peak     3 spectrum    1 weight  0.10000E+01 volume  0.85579E-03 ppm1      2.612 ppm2      8.743 CV     1
 ASSI {    4}
   (( segid "    " and resid 3    and name HG3 ))
   (( segid "    " and resid 3    and name HN  ))
      3.600     1.600     1.600 peak     4 spectrum    1 weight  0.10000E+01 volume  0.54134E-03 ppm1      2.557 ppm2      8.743 CV     1
 ASSI {    5}
   (( segid "    " and resid 3    and name HB2 ))
   (( segid "    " and resid 3    and name HN  ))
      3.100     1.200     1.200 peak     5 spectrum    1 weight  0.10000E+01 volume  0.12411E-02 ppm1      2.091 ppm2      8.743 CV     1
 ASSI {    6}
   (( segid "    " and resid 3    and name HB3 ))
   (( segid "    " and resid 3    and name HN  ))
      2.600     0.900     0.900 peak     6 spectrum    1 weight  0.10000E+01 volume  0.33995E-02 ppm1      2.015 ppm2      8.743 CV     1
 ASSI {    7}
   (( segid "    " and resid 3    and name HA  ))
   (( segid "    " and resid 3    and name HG2 ))
      3.700     1.700     1.700 peak     7 spectrum    1 weight  0.10000E+01 volume  0.42246E-03 ppm1      4.520 ppm2      2.602 CV     1
 ASSI {    8}
   (( segid "    " and resid 3    and name HA  ))
   (( segid "    " and resid 3    and name HG3 ))
      3.200     1.300     1.300 peak     8 spectrum    1 weight  0.10000E+01 volume  0.10025E-02 ppm1      4.524 ppm2      2.544 CV     1
 ASSI {    9}
   (( segid "    " and resid 3    and name HA  ))
   (( segid "    " and resid 3    and name HB2 ))
      2.900     1.000     1.000 peak     9 spectrum    1 weight  0.10000E+01 volume  0.20449E-02 ppm1      4.521 ppm2      2.089 CV     1
 ASSI {   10}
   (( segid "    " and resid 3    and name HA  ))
   (( segid "    " and resid 3    and name HB3 ))
      2.700     0.900     0.900 peak    10 spectrum    1 weight  0.10000E+01 volume  0.28856E-02 ppm1      4.521 ppm2      2.008 CV     1
 ASSI {   11}
   (( segid "    " and resid 3    and name HG2 ))
   (( segid "    " and resid 3    and name HG3 ))
      2.400     0.700     0.700 peak    11 spectrum    1 weight  0.10000E+01 volume  0.55065E-02 ppm1      2.614 ppm2      2.545 CV     1
 ASSI {   12}
   (( segid "    " and resid 3    and name HG2 ))
   (( segid "    " and resid 3    and name HB2 ))
      6.000     4.500     0.000 peak    12 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.613 ppm2      2.089 CV     1
 ASSI {   13}
   (( segid "    " and resid 3    and name HG2 ))
   (( segid "    " and resid 3    and name HB3 ))
      6.000     4.500     0.000 peak    13 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.613 ppm2      2.008 CV     1
 ASSI {   14}
   (( segid "    " and resid 3    and name HG3 ))
   (( segid "    " and resid 3    and name HB2 ))
      6.000     4.500     0.000 peak    14 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      2.552 ppm2      2.089 CV     1
 ASSI {   15}
   (( segid "    " and resid 3    and name HG3 ))
   (( segid "    " and resid 3    and name HB3 ))
      3.500     1.600     1.600 peak    15 spectrum    1 weight  0.10000E+01 volume  0.56461E-03 ppm1      2.552 ppm2      2.008 CV     1
 ASSI {   16}
   (( segid "    " and resid 3    and name HB2 ))
   (( segid "    " and resid 3    and name HB3 ))
      2.300     0.700     0.700 peak    16 spectrum    1 weight  0.10000E+01 volume  0.67408E-02 ppm1      2.095 ppm2      2.008 CV     1
 ASSI {   17}
   (( segid "    " and resid 8    and name HA  ))
   (( segid "    " and resid 8    and name HN  ))
      6.000     4.500     0.000 peak    17 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.233 ppm2      8.454 CV     1
 ASSI {   18}
   (( segid "    " and resid 8    and name HD3 ))
   (( segid "    " and resid 8    and name HN  ))
      3.700     1.700     1.700 peak    18 spectrum    1 weight  0.10000E+01 volume  0.43177E-03 ppm1      3.220 ppm2      8.454 CV     1
 OR {   18}
   (( segid "    " and resid 8    and name HD2 ))
   (( segid "    " and resid 8    and name HN  ))
 ASSI {   19}
   (( segid "    " and resid 8    and name HB2 ))
   (( segid "    " and resid 8    and name HN  ))
      2.800     1.000     1.000 peak    19 spectrum    1 weight  0.10000E+01 volume  0.23338E-02 ppm1      1.840 ppm2      8.454 CV     1
 ASSI {   20}
   (( segid "    " and resid 8    and name HG2 ))
   (( segid "    " and resid 8    and name HN  ))
      2.600     0.900     0.900 peak    20 spectrum    1 weight  0.10000E+01 volume  0.35139E-02 ppm1      1.708 ppm2      8.454 CV     1
 ASSI {   22}
   (( segid "    " and resid 8    and name HD3 ))
   (( segid "    " and resid 8    and name HE  ))
      2.500     0.800     0.800 peak    22 spectrum    1 weight  0.10000E+01 volume  0.43886E-02 ppm1      3.220 ppm2      7.262 CV     1
 OR {   22}
   (( segid "    " and resid 8    and name HD2 ))
   (( segid "    " and resid 8    and name HE  ))
 ASSI {   23}
   (( segid "    " and resid 8    and name HA  ))
   (( segid "    " and resid 8    and name HE  ))
      4.500     2.500     1.500 peak    23 spectrum    1 weight  0.10000E+01 volume  0.13303E-03 ppm1      4.232 ppm2      7.261 CV     1
 ASSI {   24}
   (( segid "    " and resid 8    and name HB2 ))
   (( segid "    " and resid 8    and name HE  ))
      3.000     1.100     1.100 peak    24 spectrum    1 weight  0.10000E+01 volume  0.14419E-02 ppm1      1.838 ppm2      7.261 CV     1
 OR {   24}
   (( segid "    " and resid 8    and name HB3 ))
   (( segid "    " and resid 8    and name HE  ))
 ASSI {   25}
   (( segid "    " and resid 8    and name HG2 ))
   (( segid "    " and resid 8    and name HE  ))
      3.400     1.400     1.400 peak    25 spectrum    1 weight  0.10000E+01 volume  0.71733E-03 ppm1      1.704 ppm2      7.261 CV     1
 ASSI {   26}
   (( segid "    " and resid 8    and name HG3 ))
   (( segid "    " and resid 8    and name HE  ))
      3.700     1.700     1.700 peak    26 spectrum    1 weight  0.10000E+01 volume  0.41549E-03 ppm1      1.642 ppm2      7.261 CV     1
 ASSI {   27}
   (( segid "    " and resid 8    and name HA  ))
   (( segid "    " and resid 8    and name HD2 ))
      3.100     1.200     1.200 peak    27 spectrum    1 weight  0.10000E+01 volume  0.12305E-02 ppm1      4.236 ppm2      3.208 CV     1
 OR {   27}
   (( segid "    " and resid 8    and name HA  ))
   (( segid "    " and resid 8    and name HD3 ))
 ASSI {   28}
   (( segid "    " and resid 8    and name HA  ))
   (( segid "    " and resid 8    and name HB3 ))
      2.300     0.700     0.700 peak    28 spectrum    1 weight  0.10000E+01 volume  0.67941E-02 ppm1      4.239 ppm2      1.828 CV     1
 OR {   28}
   (( segid "    " and resid 8    and name HA  ))
   (( segid "    " and resid 8    and name HB2 ))
 ASSI {   30}
   (( segid "    " and resid 8    and name HA  ))
   (( segid "    " and resid 8    and name HG3 ))
      2.400     0.700     0.700 peak    30 spectrum    1 weight  0.10000E+01 volume  0.57829E-02 ppm1      4.236 ppm2      1.629 CV     1
 ASSI {   31}
   (( segid "    " and resid 8    and name HD2 ))
   (( segid "    " and resid 8    and name HB3 ))
      2.300     0.700     0.700 peak    31 spectrum    1 weight  0.10000E+01 volume  0.72722E-02 ppm1      3.217 ppm2      1.830 CV     1
 OR {   31}
   (( segid "    " and resid 8    and name HD3 ))
   (( segid "    " and resid 8    and name HB3 ))
 OR {   31}
   (( segid "    " and resid 8    and name HD3 ))
   (( segid "    " and resid 8    and name HB2 ))
 OR {   31}
   (( segid "    " and resid 8    and name HD2 ))
   (( segid "    " and resid 8    and name HB2 ))
 ASSI {   32}
   (( segid "    " and resid 8    and name HD3 ))
   (( segid "    " and resid 8    and name HG2 ))
      2.400     0.700     0.700 peak    32 spectrum    1 weight  0.10000E+01 volume  0.61087E-02 ppm1      3.218 ppm2      1.695 CV     1
 OR {   32}
   (( segid "    " and resid 8    and name HD2 ))
   (( segid "    " and resid 8    and name HG2 ))
 ASSI {   33}
   (( segid "    " and resid 8    and name HD2 ))
   (( segid "    " and resid 8    and name HG3 ))
      2.300     0.700     0.700 peak    33 spectrum    1 weight  0.10000E+01 volume  0.66168E-02 ppm1      3.218 ppm2      1.629 CV     1
 OR {   33}
   (( segid "    " and resid 8    and name HD3 ))
   (( segid "    " and resid 8    and name HG3 ))
 ASSI {   34}
   (( segid "    " and resid 8    and name HB2 ))
   (( segid "    " and resid 8    and name HG2 ))
      2.800     1.000     1.000 peak    34 spectrum    1 weight  0.10000E+01 volume  0.23455E-02 ppm1      1.840 ppm2      1.696 CV     1
 OR {   34}
   (( segid "    " and resid 8    and name HB3 ))
   (( segid "    " and resid 8    and name HG2 ))
 ASSI {   35}
   (( segid "    " and resid 8    and name HB3 ))
   (( segid "    " and resid 8    and name HG3 ))
      2.600     0.800     0.800 peak    35 spectrum    1 weight  0.10000E+01 volume  0.37728E-02 ppm1      1.840 ppm2      1.629 CV     1
 OR {   35}
   (( segid "    " and resid 8    and name HB2 ))
   (( segid "    " and resid 8    and name HG3 ))
 ASSI {   36}
   (( segid "    " and resid 8    and name HG2 ))
   (( segid "    " and resid 8    and name HG3 ))
      6.000     4.500     0.000 peak    36 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.709 ppm2      1.629 CV     1
 ASSI {   37}
   (( segid "    " and resid 8    and name HH21))
   (( segid "    " and resid 8    and name HH12))
      1.900     0.500     0.500 peak    37 spectrum    1 weight  0.10000E+01 volume  0.22999E-01 ppm1      6.530 ppm2      6.967 CV     1
 ASSI {   39}
   (( segid "    " and resid 2    and name HB2 ))
   (( segid "    " and resid 2    and name HN  ))
      2.700     0.900     0.900 peak    39 spectrum    1 weight  0.10000E+01 volume  0.27421E-02 ppm1      3.872 ppm2      8.804 CV     1
 OR {   39}
   (( segid "    " and resid 2    and name HB3 ))
   (( segid "    " and resid 2    and name HN  ))
 ASSI {   40}
   (( segid "    " and resid 2    and name HA  ))
   (( segid "    " and resid 2    and name HB3 ))
      3.700     1.700     1.700 peak    40 spectrum    1 weight  0.10000E+01 volume  0.40666E-03 ppm1      4.501 ppm2      3.860 CV     1
 OR {   40}
   (( segid "    " and resid 2    and name HA  ))
   (( segid "    " and resid 2    and name HB2 ))
 ASSI {   41}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 27   and name HN  ))
      2.200     0.600     0.600 peak    41 spectrum    1 weight  0.10000E+01 volume  0.86423E-02 ppm1      4.464 ppm2      8.724 CV     1
 ASSI {   42}
   (( segid "    " and resid 27   and name HB2 ))
   (( segid "    " and resid 27   and name HN  ))
      2.300     0.600     0.600 peak    42 spectrum    1 weight  0.10000E+01 volume  0.85065E-02 ppm1      2.817 ppm2      8.724 CV     1
 ASSI {   43}
   (( segid "    " and resid 27   and name HB3 ))
   (( segid "    " and resid 27   and name HN  ))
      2.400     0.700     0.700 peak    43 spectrum    1 weight  0.10000E+01 volume  0.60873E-02 ppm1      2.697 ppm2      8.725 CV     1
 ASSI {   44}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 27   and name HB3 ))
      2.400     0.700     0.700 peak    44 spectrum    1 weight  0.10000E+01 volume  0.53252E-02 ppm1      4.466 ppm2      2.684 CV     1
 ASSI {   45}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 27   and name HB2 ))
      2.500     0.800     0.800 peak    45 spectrum    1 weight  0.10000E+01 volume  0.50886E-02 ppm1      4.467 ppm2      2.806 CV     1
 ASSI {   46}
   (( segid "    " and resid 27   and name HB2 ))
   (( segid "    " and resid 27   and name HB3 ))
      1.900     0.500     0.500 peak    46 spectrum    1 weight  0.10000E+01 volume  0.21885E-01 ppm1      2.818 ppm2      2.684 CV     1
 ASSI {   47}
   (( segid "    " and resid 8    and name HH22))
   (( segid "    " and resid 8    and name HE  ))
      3.200     1.200     1.200 peak    47 spectrum    1 weight  0.10000E+01 volume  0.11170E-02 ppm1      6.530 ppm2      7.261 CV     1
 ASSI {   48}
   (( segid "    " and resid 8    and name HH11))
   (( segid "    " and resid 8    and name HE  ))
      3.300     1.300     1.300 peak    48 spectrum    1 weight  0.10000E+01 volume  0.88944E-03 ppm1      6.970 ppm2      7.261 CV     1
 OR {   48}
   (( segid "    " and resid 8    and name HH12))
   (( segid "    " and resid 8    and name HE  ))
 ASSI {   49}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 23   and name HN  ))
      2.600     0.800     0.800 peak    49 spectrum    1 weight  0.10000E+01 volume  0.39774E-02 ppm1      4.259 ppm2      8.053 CV     1
 ASSI {   50}
   (( segid "    " and resid 23   and name HE3 ))
   (  segid "    " and resid 23   and name HZ% )
      3.000     1.100     1.100 peak    50 spectrum    1 weight  0.10000E+01 volume  0.15582E-02 ppm1      3.024 ppm2      7.765 CV     1
 OR {   50}
   (( segid "    " and resid 23   and name HE2 ))
   (  segid "    " and resid 23   and name HZ% )
 ASSI {   51}
   (( segid "    " and resid 23   and name HB2 ))
   (( segid "    " and resid 23   and name HN  ))
      2.200     0.600     0.600 peak    51 spectrum    1 weight  0.10000E+01 volume  0.99485E-02 ppm1      2.029 ppm2      8.053 CV     1
 ASSI {   52}
   (( segid "    " and resid 23   and name HB3 ))
   (( segid "    " and resid 23   and name HN  ))
      6.000     4.500     0.000 peak    52 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.896 ppm2      8.053 CV     1
 ASSI {   53}
   (( segid "    " and resid 23   and name HD2 ))
   (( segid "    " and resid 23   and name HN  ))
      4.200     2.200     1.800 peak    53 spectrum    1 weight  0.10000E+01 volume  0.20818E-03 ppm1      1.746 ppm2      8.053 CV     1
 ASSI {   54}
   (( segid "    " and resid 23   and name HD3 ))
   (( segid "    " and resid 23   and name HN  ))
      4.500     2.500     1.500 peak    54 spectrum    1 weight  0.10000E+01 volume  0.13488E-03 ppm1      1.661 ppm2      8.053 CV     1
 ASSI {   55}
   (( segid "    " and resid 23   and name HG3 ))
   (( segid "    " and resid 23   and name HN  ))
      6.000     4.500     0.000 peak    55 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.483 ppm2      8.054 CV     1
 OR {   55}
   (( segid "    " and resid 23   and name HG2 ))
   (( segid "    " and resid 23   and name HN  ))
 ASSI {   58}
   (( segid "    " and resid 23   and name HD2 ))
   (  segid "    " and resid 23   and name HZ% )
      3.700     1.700     1.700 peak    58 spectrum    1 weight  0.10000E+01 volume  0.43788E-03 ppm1      1.748 ppm2      7.765 CV     1
 ASSI {   59}
   (( segid "    " and resid 23   and name HD3 ))
   (  segid "    " and resid 23   and name HZ% )
      3.900     1.900     1.900 peak    59 spectrum    1 weight  0.10000E+01 volume  0.34005E-03 ppm1      1.662 ppm2      7.765 CV     1
 ASSI {   60}
   (( segid "    " and resid 23   and name HG2 ))
   (  segid "    " and resid 23   and name HZ% )
      3.100     1.200     1.200 peak    60 spectrum    1 weight  0.10000E+01 volume  0.12819E-02 ppm1      1.481 ppm2      7.764 CV     1
 OR {   60}
   (( segid "    " and resid 23   and name HG3 ))
   (  segid "    " and resid 23   and name HZ% )
 ASSI {   61}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 23   and name HE2 ))
      3.200     1.300     1.300 peak    61 spectrum    1 weight  0.10000E+01 volume  0.10025E-02 ppm1      4.259 ppm2      3.011 CV     1
 OR {   61}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 23   and name HE3 ))
 ASSI {   62}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 23   and name HB2 ))
      2.400     0.700     0.700 peak    62 spectrum    1 weight  0.10000E+01 volume  0.51719E-02 ppm1      4.257 ppm2      2.017 CV     1
 ASSI {   63}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 23   and name HB3 ))
      2.400     0.700     0.700 peak    63 spectrum    1 weight  0.10000E+01 volume  0.63520E-02 ppm1      4.257 ppm2      1.883 CV     1
 ASSI {   67}
   (( segid "    " and resid 23   and name HE2 ))
   (( segid "    " and resid 23   and name HG3 ))
      3.200     1.300     1.300 peak    67 spectrum    1 weight  0.10000E+01 volume  0.10753E-02 ppm1      3.020 ppm2      1.475 CV     1
 OR {   67}
   (( segid "    " and resid 23   and name HE3 ))
   (( segid "    " and resid 23   and name HG2 ))
 OR {   67}
   (( segid "    " and resid 23   and name HE3 ))
   (( segid "    " and resid 23   and name HG3 ))
 ASSI {   68}
   (( segid "    " and resid 23   and name HE3 ))
   (( segid "    " and resid 23   and name HD3 ))
      3.100     1.200     1.200 peak    68 spectrum    1 weight  0.10000E+01 volume  0.11752E-02 ppm1      3.022 ppm2      1.648 CV     1
 OR {   68}
   (( segid "    " and resid 23   and name HE2 ))
   (( segid "    " and resid 23   and name HD3 ))
 ASSI {   69}
   (( segid "    " and resid 23   and name HE2 ))
   (( segid "    " and resid 23   and name HD2 ))
      2.600     0.800     0.800 peak    69 spectrum    1 weight  0.10000E+01 volume  0.38688E-02 ppm1      3.022 ppm2      1.734 CV     1
 OR {   69}
   (( segid "    " and resid 23   and name HE3 ))
   (( segid "    " and resid 23   and name HD2 ))
 ASSI {   70}
   (( segid "    " and resid 23   and name HE3 ))
   (( segid "    " and resid 23   and name HB3 ))
      4.300     2.300     1.700 peak    70 spectrum    1 weight  0.10000E+01 volume  0.18181E-03 ppm1      3.021 ppm2      1.883 CV     1
 OR {   70}
   (( segid "    " and resid 23   and name HE2 ))
   (( segid "    " and resid 23   and name HB3 ))
 ASSI {   71}
   (( segid "    " and resid 23   and name HE2 ))
   (( segid "    " and resid 23   and name HB2 ))
      4.300     2.300     1.700 peak    71 spectrum    1 weight  0.10000E+01 volume  0.17832E-03 ppm1      3.020 ppm2      2.017 CV     1
 OR {   71}
   (( segid "    " and resid 23   and name HE3 ))
   (( segid "    " and resid 23   and name HB2 ))
 ASSI {   72}
   (( segid "    " and resid 23   and name HB2 ))
   (( segid "    " and resid 23   and name HB3 ))
      2.300     0.700     0.700 peak    72 spectrum    1 weight  0.10000E+01 volume  0.77415E-02 ppm1      2.027 ppm2      1.883 CV     1
 ASSI {   73}
   (( segid "    " and resid 23   and name HB2 ))
   (( segid "    " and resid 23   and name HD2 ))
      3.100     1.200     1.200 peak    73 spectrum    1 weight  0.10000E+01 volume  0.11442E-02 ppm1      2.026 ppm2      1.738 CV     1
 ASSI {   74}
   (( segid "    " and resid 23   and name HB3 ))
   (( segid "    " and resid 23   and name HD2 ))
      6.000     4.500     0.000 peak    74 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.887 ppm2      1.738 CV     1
 ASSI {   75}
   (( segid "    " and resid 23   and name HB2 ))
   (( segid "    " and resid 23   and name HD3 ))
      3.100     1.200     1.200 peak    75 spectrum    1 weight  0.10000E+01 volume  0.13148E-02 ppm1      2.026 ppm2      1.650 CV     1
 ASSI {   76}
   (( segid "    " and resid 23   and name HB2 ))
   (( segid "    " and resid 23   and name HG3 ))
      2.400     0.700     0.700 peak    76 spectrum    1 weight  0.10000E+01 volume  0.51488E-02 ppm1      2.026 ppm2      1.475 CV     1
 OR {   76}
   (( segid "    " and resid 23   and name HB2 ))
   (( segid "    " and resid 23   and name HG2 ))
 ASSI {   77}
   (( segid "    " and resid 23   and name HB3 ))
   (( segid "    " and resid 23   and name HD3 ))
      6.000     4.500     0.000 peak    77 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.887 ppm2      1.651 CV     1
 ASSI {   78}
   (( segid "    " and resid 23   and name HB3 ))
   (( segid "    " and resid 23   and name HG2 ))
      2.900     1.000     1.000 peak    78 spectrum    1 weight  0.10000E+01 volume  0.20178E-02 ppm1      1.887 ppm2      1.475 CV     1
 OR {   78}
   (( segid "    " and resid 23   and name HB3 ))
   (( segid "    " and resid 23   and name HG3 ))
 ASSI {   79}
   (( segid "    " and resid 23   and name HD2 ))
   (( segid "    " and resid 23   and name HG3 ))
      6.000     4.500     0.000 peak    79 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.747 ppm2      1.475 CV     1
 OR {   79}
   (( segid "    " and resid 23   and name HD2 ))
   (( segid "    " and resid 23   and name HG2 ))
 ASSI {   80}
   (( segid "    " and resid 23   and name HD2 ))
   (( segid "    " and resid 23   and name HD3 ))
      6.000     4.500     0.000 peak    80 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.747 ppm2      1.651 CV     1
 ASSI {   81}
   (( segid "    " and resid 23   and name HD3 ))
   (( segid "    " and resid 23   and name HG2 ))
      6.000     4.500     0.000 peak    81 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.661 ppm2      1.475 CV     1
 OR {   81}
   (( segid "    " and resid 23   and name HD3 ))
   (( segid "    " and resid 23   and name HG3 ))
 ASSI {   82}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name HN  ))
      2.200     0.600     0.600 peak    82 spectrum    1 weight  0.11000E+01 volume  0.11015E-01 ppm1      4.149 ppm2      8.197 CV     1
 ASSI {   83}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 22   and name HN  ))
      2.000     0.500     0.500 peak    83 spectrum    1 weight  0.10000E+01 volume  0.16338E-01 ppm1      1.911 ppm2      8.197 CV     1
 ASSI {   84}
   (( segid "    " and resid 22   and name HD3 ))
   (( segid "    " and resid 22   and name HN  ))
      2.800     1.000     1.000 peak    84 spectrum    1 weight  0.11000E+01 volume  0.25171E-02 ppm1      1.687 ppm2      8.197 CV     1
 OR {   84}
   (( segid "    " and resid 22   and name HD2 ))
   (( segid "    " and resid 22   and name HN  ))
 ASSI {   86}
   (( segid "    " and resid 22   and name HG3 ))
   (( segid "    " and resid 22   and name HN  ))
      2.900     1.000     1.000 peak    86 spectrum    1 weight  0.10000E+01 volume  0.19431E-02 ppm1      1.446 ppm2      8.197 CV     1
 ASSI {   87}
   (( segid "    " and resid 22   and name HD2 ))
   (  segid "    " and resid 22   and name HZ% )
      3.500     1.500     1.500 peak    87 spectrum    1 weight  0.10000E+01 volume  0.60961E-03 ppm1      1.689 ppm2      7.655 CV     1
 OR {   87}
   (( segid "    " and resid 22   and name HD3 ))
   (  segid "    " and resid 22   and name HZ% )
 ASSI {   91}
   (( segid "    " and resid 22   and name HE2 ))
   (  segid "    " and resid 22   and name HZ% )
      2.700     0.900     0.900 peak    91 spectrum    1 weight  0.10000E+01 volume  0.28323E-02 ppm1      2.967 ppm2      7.654 CV     1
 OR {   91}
   (( segid "    " and resid 22   and name HE3 ))
   (  segid "    " and resid 22   and name HZ% )
 ASSI {   93}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name HE2 ))
      3.300     1.400     1.400 peak    93 spectrum    1 weight  0.10000E+01 volume  0.82845E-03 ppm1      4.148 ppm2      2.957 CV     1
 OR {   93}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name HE3 ))
 ASSI {   94}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name HB3 ))
      2.100     0.500     0.500 peak    94 spectrum    1 weight  0.10000E+01 volume  0.14651E-01 ppm1      4.148 ppm2      1.899 CV     1
 OR {   94}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name HB2 ))
 ASSI {   95}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name HD2 ))
      2.400     0.700     0.700 peak    95 spectrum    1 weight  0.11000E+01 volume  0.54454E-02 ppm1      4.148 ppm2      1.678 CV     1
 OR {   95}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name HD3 ))
 ASSI {   96}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name HG2 ))
      2.900     1.000     1.000 peak    96 spectrum    1 weight  0.10000E+01 volume  0.18888E-02 ppm1      4.148 ppm2      1.618 CV     1
 ASSI {   97}
   (( segid "    " and resid 22   and name HE3 ))
   (( segid "    " and resid 22   and name HB2 ))
      3.000     1.200     1.200 peak    97 spectrum    1 weight  0.10000E+01 volume  0.13924E-02 ppm1      2.969 ppm2      1.901 CV     1
 OR {   97}
   (( segid "    " and resid 22   and name HE2 ))
   (( segid "    " and resid 22   and name HB2 ))
 OR {   97}
   (( segid "    " and resid 22   and name HE3 ))
   (( segid "    " and resid 22   and name HB3 ))
 ASSI {   98}
   (( segid "    " and resid 22   and name HE2 ))
   (( segid "    " and resid 22   and name HD3 ))
      2.600     0.800     0.800 peak    98 spectrum    1 weight  0.10000E+01 volume  0.40182E-02 ppm1      2.969 ppm2      1.679 CV     1
 OR {   98}
   (( segid "    " and resid 22   and name HE2 ))
   (( segid "    " and resid 22   and name HD2 ))
 OR {   98}
   (( segid "    " and resid 22   and name HE3 ))
   (( segid "    " and resid 22   and name HD3 ))
 OR {   98}
   (( segid "    " and resid 22   and name HE3 ))
   (( segid "    " and resid 22   and name HD2 ))
 ASSI {   99}
   (( segid "    " and resid 22   and name HE2 ))
   (( segid "    " and resid 22   and name HG2 ))
      2.900     1.000     1.000 peak    99 spectrum    1 weight  0.10000E+01 volume  0.19654E-02 ppm1      2.969 ppm2      1.618 CV     1
 OR {   99}
   (( segid "    " and resid 22   and name HE3 ))
   (( segid "    " and resid 22   and name HG2 ))
 ASSI {  100}
   (( segid "    " and resid 22   and name HE3 ))
   (( segid "    " and resid 22   and name HG3 ))
      2.800     1.000     1.000 peak   100 spectrum    1 weight  0.10000E+01 volume  0.22758E-02 ppm1      2.969 ppm2      1.434 CV     1
 OR {  100}
   (( segid "    " and resid 22   and name HE2 ))
   (( segid "    " and resid 22   and name HG3 ))
 ASSI {  101}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 22   and name HD3 ))
      2.400     0.700     0.700 peak   101 spectrum    1 weight  0.10000E+01 volume  0.51729E-02 ppm1      1.910 ppm2      1.679 CV     1
 OR {  101}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 22   and name HD2 ))
 OR {  101}
   (( segid "    " and resid 22   and name HB3 ))
   (( segid "    " and resid 22   and name HD3 ))
 ASSI {  102}
   (( segid "    " and resid 22   and name HB3 ))
   (( segid "    " and resid 22   and name HG2 ))
      2.600     0.900     0.900 peak   102 spectrum    1 weight  0.10000E+01 volume  0.32424E-02 ppm1      1.910 ppm2      1.619 CV     1
 OR {  102}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 22   and name HG2 ))
 ASSI {  103}
   (( segid "    " and resid 22   and name HD3 ))
   (( segid "    " and resid 22   and name HG2 ))
      6.000     4.500     0.000 peak   103 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.687 ppm2      1.619 CV     1
 OR {  103}
   (( segid "    " and resid 22   and name HD2 ))
   (( segid "    " and resid 22   and name HG2 ))
 ASSI {  105}
   (( segid "    " and resid 22   and name HD2 ))
   (( segid "    " and resid 22   and name HG3 ))
      2.500     0.800     0.800 peak   105 spectrum    1 weight  0.10000E+01 volume  0.48452E-02 ppm1      1.687 ppm2      1.434 CV     1
 OR {  105}
   (( segid "    " and resid 22   and name HD3 ))
   (( segid "    " and resid 22   and name HG3 ))
 ASSI {  106}
   (( segid "    " and resid 22   and name HG2 ))
   (( segid "    " and resid 22   and name HG3 ))
      2.700     0.900     0.900 peak   106 spectrum    1 weight  0.10000E+01 volume  0.27925E-02 ppm1      1.628 ppm2      1.434 CV     1
 ASSI {  107}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 12   and name HN  ))
      2.400     0.700     0.700 peak   107 spectrum    1 weight  0.10000E+01 volume  0.56645E-02 ppm1      4.340 ppm2      8.321 CV     1
 ASSI {  109}
   (( segid "    " and resid 12   and name HB2 ))
   (( segid "    " and resid 12   and name HN  ))
      2.500     0.800     0.800 peak   109 spectrum    1 weight  0.10000E+01 volume  0.50828E-02 ppm1      1.958 ppm2      8.320 CV     1
 ASSI {  110}
   (( segid "    " and resid 12   and name HB3 ))
   (( segid "    " and resid 12   and name HN  ))
      2.500     0.800     0.800 peak   110 spectrum    1 weight  0.10000E+01 volume  0.48685E-02 ppm1      1.855 ppm2      8.320 CV     1
 ASSI {  113}
   (( segid "    " and resid 12   and name HD2 ))
   (( segid "    " and resid 12   and name HN  ))
      4.300     2.300     1.700 peak   113 spectrum    1 weight  0.10000E+01 volume  0.18695E-03 ppm1      1.720 ppm2      8.320 CV     1
 ASSI {  114}
   (( segid "    " and resid 12   and name HD3 ))
   (( segid "    " and resid 12   and name HN  ))
      4.300     2.300     1.700 peak   114 spectrum    1 weight  0.10000E+01 volume  0.16910E-03 ppm1      1.664 ppm2      8.320 CV     1
 ASSI {  115}
   (( segid "    " and resid 12   and name HD2 ))
   (  segid "    " and resid 12   and name HZ% )
      4.000     2.000     2.000 peak   115 spectrum    1 weight  0.10000E+01 volume  0.26588E-03 ppm1      1.720 ppm2      7.723 CV     1
 ASSI {  116}
   (( segid "    " and resid 12   and name HD3 ))
   (  segid "    " and resid 12   and name HZ% )
      3.800     1.800     1.800 peak   116 spectrum    1 weight  0.10000E+01 volume  0.39144E-03 ppm1      1.664 ppm2      7.723 CV     1
 ASSI {  117}
   (( segid "    " and resid 12   and name HG2 ))
   (( segid "    " and resid 12   and name HN  ))
      3.200     1.300     1.300 peak   117 spectrum    1 weight  0.10000E+01 volume  0.10705E-02 ppm1      1.514 ppm2      8.320 CV     1
 ASSI {  118}
   (( segid "    " and resid 12   and name HG3 ))
   (( segid "    " and resid 12   and name HN  ))
      6.000     4.500     0.000 peak   118 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.477 ppm2      8.320 CV     1
 ASSI {  121}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 12   and name HE3 ))
      3.700     1.700     1.700 peak   121 spectrum    1 weight  0.10000E+01 volume  0.42567E-03 ppm1      4.341 ppm2      3.004 CV     1
 OR {  121}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 12   and name HE2 ))
 ASSI {  122}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 12   and name HB2 ))
      2.300     0.700     0.700 peak   122 spectrum    1 weight  0.10000E+01 volume  0.66817E-02 ppm1      4.338 ppm2      1.950 CV     1
 ASSI {  123}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 12   and name HB3 ))
      2.400     0.700     0.700 peak   123 spectrum    1 weight  0.10000E+01 volume  0.65809E-02 ppm1      4.338 ppm2      1.844 CV     1
 ASSI {  124}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 12   and name HD2 ))
      3.200     1.300     1.300 peak   124 spectrum    1 weight  0.10000E+01 volume  0.10268E-02 ppm1      4.338 ppm2      1.711 CV     1
 ASSI {  125}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 12   and name HD3 ))
      3.200     1.300     1.300 peak   125 spectrum    1 weight  0.10000E+01 volume  0.10889E-02 ppm1      4.338 ppm2      1.653 CV     1
 ASSI {  126}
   (( segid "    " and resid 12   and name HE3 ))
   (( segid "    " and resid 12   and name HB2 ))
      4.700     2.800     1.300 peak   126 spectrum    1 weight  0.10000E+01 volume  0.98126E-04 ppm1      3.012 ppm2      1.949 CV     1
 OR {  126}
   (( segid "    " and resid 12   and name HE2 ))
   (( segid "    " and resid 12   and name HB2 ))
 ASSI {  127}
   (( segid "    " and resid 12   and name HE3 ))
   (( segid "    " and resid 12   and name HB3 ))
      4.000     2.000     2.000 peak   127 spectrum    1 weight  0.10000E+01 volume  0.25598E-03 ppm1      3.012 ppm2      1.844 CV     1
 OR {  127}
   (( segid "    " and resid 12   and name HE2 ))
   (( segid "    " and resid 12   and name HB3 ))
 ASSI {  128}
   (( segid "    " and resid 12   and name HE3 ))
   (( segid "    " and resid 12   and name HD2 ))
      3.000     1.100     1.100 peak   128 spectrum    1 weight  0.10000E+01 volume  0.16600E-02 ppm1      3.012 ppm2      1.711 CV     1
 OR {  128}
   (( segid "    " and resid 12   and name HE2 ))
   (( segid "    " and resid 12   and name HD2 ))
 ASSI {  129}
   (( segid "    " and resid 12   and name HE2 ))
   (( segid "    " and resid 12   and name HD3 ))
      2.800     1.000     1.000 peak   129 spectrum    1 weight  0.10000E+01 volume  0.23543E-02 ppm1      3.012 ppm2      1.653 CV     1
 OR {  129}
   (( segid "    " and resid 12   and name HE3 ))
   (( segid "    " and resid 12   and name HD3 ))
 ASSI {  130}
   (( segid "    " and resid 12   and name HE3 ))
   (( segid "    " and resid 12   and name HG2 ))
      2.500     0.800     0.800 peak   130 spectrum    1 weight  0.10000E+01 volume  0.49936E-02 ppm1      3.012 ppm2      1.507 CV     1
 OR {  130}
   (( segid "    " and resid 12   and name HE2 ))
   (( segid "    " and resid 12   and name HG2 ))
 ASSI {  131}
   (( segid "    " and resid 12   and name HE3 ))
   (( segid "    " and resid 12   and name HG3 ))
      3.300     1.400     1.400 peak   131 spectrum    1 weight  0.10000E+01 volume  0.84124E-03 ppm1      3.012 ppm2      1.467 CV     1
 OR {  131}
   (( segid "    " and resid 12   and name HE2 ))
   (( segid "    " and resid 12   and name HG3 ))
 ASSI {  132}
   (( segid "    " and resid 12   and name HB2 ))
   (( segid "    " and resid 12   and name HB3 ))
      2.200     0.600     0.600 peak   132 spectrum    1 weight  0.10000E+01 volume  0.10075E-01 ppm1      1.956 ppm2      1.843 CV     1
 ASSI {  133}
   (( segid "    " and resid 12   and name HB2 ))
   (( segid "    " and resid 12   and name HD2 ))
      4.300     2.300     1.700 peak   133 spectrum    1 weight  0.10000E+01 volume  0.16900E-03 ppm1      1.958 ppm2      1.710 CV     1
 ASSI {  134}
   (( segid "    " and resid 12   and name HB2 ))
   (( segid "    " and resid 12   and name HD3 ))
      3.300     1.300     1.300 peak   134 spectrum    1 weight  0.10000E+01 volume  0.92900E-03 ppm1      1.956 ppm2      1.653 CV     1
 ASSI {  135}
   (( segid "    " and resid 12   and name HB2 ))
   (( segid "    " and resid 12   and name HG2 ))
      2.700     0.900     0.900 peak   135 spectrum    1 weight  0.10000E+01 volume  0.26064E-02 ppm1      1.959 ppm2      1.508 CV     1
 ASSI {  136}
   (( segid "    " and resid 12   and name HB2 ))
   (( segid "    " and resid 12   and name HG3 ))
      2.600     0.800     0.800 peak   136 spectrum    1 weight  0.10000E+01 volume  0.37835E-02 ppm1      1.958 ppm2      1.466 CV     1
 ASSI {  137}
   (( segid "    " and resid 12   and name HB3 ))
   (( segid "    " and resid 12   and name HD2 ))
      6.000     4.500     0.000 peak   137 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.854 ppm2      1.710 CV     1
 ASSI {  138}
   (( segid "    " and resid 12   and name HB3 ))
   (( segid "    " and resid 12   and name HD3 ))
      6.000     4.500     0.000 peak   138 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.854 ppm2      1.654 CV     1
 ASSI {  139}
   (( segid "    " and resid 12   and name HB3 ))
   (( segid "    " and resid 12   and name HG2 ))
      2.900     1.000     1.000 peak   139 spectrum    1 weight  0.10000E+01 volume  0.18995E-02 ppm1      1.854 ppm2      1.508 CV     1
 ASSI {  140}
   (( segid "    " and resid 12   and name HB3 ))
   (( segid "    " and resid 12   and name HG3 ))
      6.000     4.500     0.000 peak   140 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.854 ppm2      1.467 CV     1
 ASSI {  141}
   (( segid "    " and resid 12   and name HD2 ))
   (( segid "    " and resid 12   and name HD3 ))
      6.000     4.500     0.000 peak   141 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.716 ppm2      1.654 CV     1
 ASSI {  142}
   (( segid "    " and resid 12   and name HD2 ))
   (( segid "    " and resid 12   and name HG2 ))
      3.000     1.100     1.100 peak   142 spectrum    1 weight  0.10000E+01 volume  0.16533E-02 ppm1      1.716 ppm2      1.508 CV     1
 ASSI {  143}
   (( segid "    " and resid 12   and name HD2 ))
   (( segid "    " and resid 12   and name HG3 ))
      6.000     4.500     0.000 peak   143 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.716 ppm2      1.466 CV     1
 ASSI {  144}
   (( segid "    " and resid 12   and name HG2 ))
   (( segid "    " and resid 12   and name HG3 ))
      1.700     0.400     0.500 peak   144 spectrum    1 weight  0.10000E+01 volume  0.46552E-01 ppm1      1.519 ppm2      1.466 CV     1
 ASSI {  145}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 18   and name HN  ))
      6.000     4.500     0.000 peak   145 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.255 ppm2      8.071 CV     1
 ASSI {  146}
   (( segid "    " and resid 18   and name HB2 ))
   (( segid "    " and resid 18   and name HN  ))
      2.500     0.800     0.800 peak   146 spectrum    1 weight  0.10000E+01 volume  0.46377E-02 ppm1      1.785 ppm2      8.071 CV     1
 ASSI {  147}
   (( segid "    " and resid 18   and name HB3 ))
   (( segid "    " and resid 18   and name HN  ))
      2.800     1.000     1.000 peak   147 spectrum    1 weight  0.10000E+01 volume  0.23659E-02 ppm1      1.742 ppm2      8.071 CV     1
 ASSI {  148}
   (( segid "    " and resid 18   and name HG  ))
   (( segid "    " and resid 18   and name HN  ))
      2.500     0.800     0.800 peak   148 spectrum    1 weight  0.10000E+01 volume  0.48103E-02 ppm1      1.705 ppm2      8.071 CV     1
 ASSI {  149}
   (  segid "    " and resid 18   and name HD1%)
   (( segid "    " and resid 18   and name HN  ))
      3.000     1.200     1.200 peak   149 spectrum    1 weight  0.10000E+01 volume  0.14186E-02 ppm1      0.956 ppm2      8.071 CV     1
 ASSI {  150}
   (  segid "    " and resid 18   and name HD2%)
   (( segid "    " and resid 18   and name HN  ))
      3.100     1.200     1.200 peak   150 spectrum    1 weight  0.10000E+01 volume  0.12372E-02 ppm1      0.910 ppm2      8.072 CV     1
 ASSI {  151}
   (  segid "    " and resid 18   and name HD1%)
   (  segid "    " and resid 18   and name HD2%)
      6.000     4.500     0.000 peak   151 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      0.944 ppm2      0.910 CV     1
 ASSI {  152}
   (( segid "    " and resid 18   and name HG  ))
   (  segid "    " and resid 18   and name HD2%)
      2.300     0.700     0.700 peak   152 spectrum    1 weight  0.10000E+01 volume  0.75766E-02 ppm1      1.704 ppm2      0.909 CV     1
 ASSI {  153}
   (( segid "    " and resid 18   and name HG  ))
   (  segid "    " and resid 18   and name HD1%)
      2.300     0.700     0.700 peak   153 spectrum    1 weight  0.10000E+01 volume  0.68902E-02 ppm1      1.709 ppm2      0.950 CV     1
 ASSI {  154}
   (( segid "    " and resid 18   and name HB3 ))
   (  segid "    " and resid 18   and name HD1%)
      2.800     1.000     1.000 peak   154 spectrum    1 weight  0.10000E+01 volume  0.24416E-02 ppm1      1.745 ppm2      0.949 CV     1
 ASSI {  155}
   (( segid "    " and resid 18   and name HB2 ))
   (  segid "    " and resid 18   and name HD1%)
      2.600     0.900     0.900 peak   155 spectrum    1 weight  0.10000E+01 volume  0.32831E-02 ppm1      1.784 ppm2      0.950 CV     1
 ASSI {  156}
   (( segid "    " and resid 18   and name HB3 ))
   (  segid "    " and resid 18   and name HD2%)
      2.300     0.700     0.700 peak   156 spectrum    1 weight  0.10000E+01 volume  0.67244E-02 ppm1      1.741 ppm2      0.909 CV     1
 ASSI {  157}
   (( segid "    " and resid 18   and name HB2 ))
   (  segid "    " and resid 18   and name HD2%)
      2.800     1.000     1.000 peak   157 spectrum    1 weight  0.10000E+01 volume  0.21050E-02 ppm1      1.784 ppm2      0.909 CV     1
 ASSI {  158}
   (( segid "    " and resid 18   and name HA  ))
   (  segid "    " and resid 18   and name HD2%)
      2.300     0.700     0.700 peak   158 spectrum    1 weight  0.11000E+01 volume  0.67234E-02 ppm1      4.254 ppm2      0.908 CV     1
 ASSI {  159}
   (( segid "    " and resid 18   and name HA  ))
   (  segid "    " and resid 18   and name HD1%)
      3.000     1.100     1.100 peak   159 spectrum    1 weight  0.10000E+01 volume  0.15718E-02 ppm1      4.254 ppm2      0.950 CV     1
 ASSI {  160}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 18   and name HB2 ))
      2.400     0.700     0.700 peak   160 spectrum    1 weight  0.10000E+01 volume  0.59467E-02 ppm1      4.254 ppm2      1.772 CV     1
 ASSI {  161}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 18   and name HB3 ))
      2.300     0.700     0.700 peak   161 spectrum    1 weight  0.10000E+01 volume  0.71791E-02 ppm1      4.252 ppm2      1.729 CV     1
 ASSI {  162}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 18   and name HG  ))
      2.700     0.900     0.900 peak   162 spectrum    1 weight  0.10000E+01 volume  0.27537E-02 ppm1      4.252 ppm2      1.693 CV     1
 ASSI {  163}
   (( segid "    " and resid 13   and name HB  ))
   (( segid "    " and resid 13   and name HA  ))
      2.700     0.900     0.900 peak   163 spectrum    1 weight  0.10000E+01 volume  0.29525E-02 ppm1      4.343 ppm2      4.209 CV     1
 ASSI {  164}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 13   and name HN  ))
      2.900     1.000     1.000 peak   164 spectrum    1 weight  0.10000E+01 volume  0.18878E-02 ppm1      4.221 ppm2      8.417 CV     1
 ASSI {  165}
   (( segid "    " and resid 13   and name HB  ))
   (( segid "    " and resid 13   and name HN  ))
      2.700     0.900     0.900 peak   165 spectrum    1 weight  0.10000E+01 volume  0.30155E-02 ppm1      4.347 ppm2      8.417 CV     1
 ASSI {  166}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 13   and name HN  ))
      3.400     1.400     1.400 peak   166 spectrum    1 weight  0.10000E+01 volume  0.76562E-03 ppm1      1.287 ppm2      8.417 CV     1
 ASSI {  167}
   (( segid "    " and resid 13   and name HB  ))
   (  segid "    " and resid 13   and name HG2%)
      2.000     0.500     0.500 peak   167 spectrum    1 weight  0.10000E+01 volume  0.15543E-01 ppm1      4.341 ppm2      1.275 CV     1
 ASSI {  168}
   (( segid "    " and resid 13   and name HA  ))
   (  segid "    " and resid 13   and name HG2%)
      2.300     0.600     0.600 peak   168 spectrum    1 weight  0.10000E+01 volume  0.82185E-02 ppm1      4.222 ppm2      1.275 CV     1
 ASSI {  169}
   (( segid "    " and resid 24   and name HA  ))
   (( segid "    " and resid 24   and name HN  ))
      2.300     0.700     0.700 peak   169 spectrum    1 weight  0.10000E+01 volume  0.78666E-02 ppm1      4.100 ppm2      8.458 CV     1
 ASSI {  170}
   (( segid "    " and resid 24   and name HB  ))
   (( segid "    " and resid 24   and name HN  ))
      6.000     4.500     0.000 peak   170 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.265 ppm2      8.458 CV     1
 ASSI {  171}
   (  segid "    " and resid 24   and name HG2%)
   (( segid "    " and resid 24   and name HN  ))
      2.500     0.800     0.800 peak   171 spectrum    1 weight  0.10000E+01 volume  0.42557E-02 ppm1      1.286 ppm2      8.458 CV     1
 ASSI {  172}
   (( segid "    " and resid 24   and name HA  ))
   (  segid "    " and resid 24   and name HG2%)
      3.200     1.300     1.300 peak   172 spectrum    1 weight  0.10000E+01 volume  0.10375E-02 ppm1      4.104 ppm2      1.276 CV     1
 ASSI {  173}
   (( segid "    " and resid 24   and name HB  ))
   (  segid "    " and resid 24   and name HG2%)
      2.000     0.500     0.500 peak   173 spectrum    1 weight  0.10000E+01 volume  0.16609E-01 ppm1      4.260 ppm2      1.276 CV     1
 ASSI {  174}
   (( segid "    " and resid 4    and name HA  ))
   (( segid "    " and resid 4    and name HN  ))
      2.500     0.800     0.800 peak   174 spectrum    1 weight  0.10000E+01 volume  0.43226E-02 ppm1      4.699 ppm2      8.545 CV     1
 ASSI {  175}
   (( segid "    " and resid 4    and name HB2 ))
   (( segid "    " and resid 4    and name HN  ))
      2.600     0.900     0.900 peak   175 spectrum    1 weight  0.10000E+01 volume  0.33452E-02 ppm1      2.835 ppm2      8.545 CV     1
 ASSI {  176}
   (( segid "    " and resid 4    and name HB3 ))
   (( segid "    " and resid 4    and name HN  ))
      3.000     1.100     1.100 peak   176 spectrum    1 weight  0.10000E+01 volume  0.14632E-02 ppm1      2.784 ppm2      8.545 CV     1
 ASSI {  177}
   (( segid "    " and resid 4    and name HA  ))
   (( segid "    " and resid 4    and name HB3 ))
      2.500     0.800     0.800 peak   177 spectrum    1 weight  0.10000E+01 volume  0.48918E-02 ppm1      4.699 ppm2      2.775 CV     1
 ASSI {  178}
   (( segid "    " and resid 4    and name HA  ))
   (( segid "    " and resid 4    and name HB2 ))
      2.400     0.700     0.700 peak   178 spectrum    1 weight  0.10000E+01 volume  0.62822E-02 ppm1      4.700 ppm2      2.836 CV     1
 ASSI {  179}
   (( segid "    " and resid 4    and name HD22))
   (( segid "    " and resid 4    and name HD21))
      1.800     0.400     0.400 peak   179 spectrum    1 weight  0.10000E+01 volume  0.37631E-01 ppm1      7.020 ppm2      7.723 CV     1
 ASSI {  180}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 16   and name HN  ))
      2.300     0.700     0.700 peak   180 spectrum    1 weight  0.10000E+01 volume  0.74603E-02 ppm1      4.479 ppm2      8.564 CV     1
 ASSI {  181}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 16   and name HN  ))
      2.400     0.700     0.700 peak   181 spectrum    1 weight  0.10000E+01 volume  0.61842E-02 ppm1      2.841 ppm2      8.564 CV     1
 ASSI {  182}
   (( segid "    " and resid 16   and name HB3 ))
   (( segid "    " and resid 16   and name HN  ))
      2.400     0.700     0.700 peak   182 spectrum    1 weight  0.10000E+01 volume  0.60388E-02 ppm1      2.700 ppm2      8.564 CV     1
 ASSI {  183}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 16   and name HB2 ))
      2.300     0.700     0.700 peak   183 spectrum    1 weight  0.10000E+01 volume  0.71257E-02 ppm1      4.478 ppm2      2.828 CV     1
 ASSI {  184}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 16   and name HB3 ))
      2.400     0.700     0.700 peak   184 spectrum    1 weight  0.10000E+01 volume  0.56336E-02 ppm1      4.476 ppm2      2.686 CV     1
 ASSI {  185}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 35   and name HN  ))
      2.900     1.100     1.100 peak   185 spectrum    1 weight  0.10000E+01 volume  0.17550E-02 ppm1      4.103 ppm2      7.828 CV     1
 ASSI {  186}
   (  segid "    " and resid 35   and name HB% )
   (( segid "    " and resid 35   and name HN  ))
      2.600     0.800     0.800 peak   186 spectrum    1 weight  0.10000E+01 volume  0.35556E-02 ppm1      1.370 ppm2      7.828 CV     1
 ASSI {  187}
   (( segid "    " and resid 35   and name HA  ))
   (  segid "    " and resid 35   and name HB% )
      3.300     1.400     1.400 peak   187 spectrum    1 weight  0.10000E+01 volume  0.86122E-03 ppm1      4.105 ppm2      1.359 CV     1
 ASSI {  188}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 19   and name HN  ))
      2.500     0.800     0.800 peak   188 spectrum    1 weight  0.10000E+01 volume  0.41160E-02 ppm1      4.145 ppm2      8.033 CV     1
 ASSI {  189}
   (  segid "    " and resid 19   and name HB% )
   (( segid "    " and resid 19   and name HN  ))
      2.400     0.700     0.700 peak   189 spectrum    1 weight  0.10000E+01 volume  0.61164E-02 ppm1      1.524 ppm2      8.033 CV     1
 ASSI {  191}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 32   and name HN  ))
      2.300     0.700     0.700 peak   191 spectrum    1 weight  0.10000E+01 volume  0.67457E-02 ppm1      4.245 ppm2      7.949 CV     1
 ASSI {  192}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 32   and name HN  ))
      2.900     1.000     1.000 peak   192 spectrum    1 weight  0.10000E+01 volume  0.20411E-02 ppm1      1.458 ppm2      7.948 CV     1
 ASSI {  194}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 6    and name HD2 ))
      3.100     1.200     1.200 peak   194 spectrum    1 weight  0.10000E+01 volume  0.12121E-02 ppm1      4.405 ppm2      3.797 CV     1
 ASSI {  195}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 6    and name HD3 ))
      3.200     1.300     1.300 peak   195 spectrum    1 weight  0.10000E+01 volume  0.11063E-02 ppm1      4.402 ppm2      3.674 CV     1
 ASSI {  196}
   (( segid "    " and resid 6    and name HD2 ))
   (( segid "    " and resid 6    and name HD3 ))
      1.800     0.400     0.400 peak   196 spectrum    1 weight  0.10000E+01 volume  0.29370E-01 ppm1      3.808 ppm2      3.675 CV     1
 ASSI {  197}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 6    and name HB2 ))
      2.200     0.600     0.600 peak   197 spectrum    1 weight  0.10000E+01 volume  0.11199E-01 ppm1      4.407 ppm2      2.312 CV     1
 ASSI {  198}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 6    and name HB3 ))
      2.500     0.800     0.800 peak   198 spectrum    1 weight  0.10000E+01 volume  0.48462E-02 ppm1      4.407 ppm2      1.889 CV     1
 ASSI {  199}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 6    and name HG2 ))
      3.000     1.100     1.100 peak   199 spectrum    1 weight  0.10000E+01 volume  0.16019E-02 ppm1      4.407 ppm2      2.053 CV     1
 ASSI {  200}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 6    and name HG3 ))
      3.100     1.200     1.200 peak   200 spectrum    1 weight  0.10000E+01 volume  0.13468E-02 ppm1      4.407 ppm2      2.002 CV     1
 ASSI {  201}
   (( segid "    " and resid 6    and name HD2 ))
   (( segid "    " and resid 6    and name HB2 ))
      2.900     1.100     1.100 peak   201 spectrum    1 weight  0.10000E+01 volume  0.18209E-02 ppm1      3.805 ppm2      2.312 CV     1
 ASSI {  202}
   (( segid "    " and resid 6    and name HD3 ))
   (( segid "    " and resid 6    and name HB2 ))
      3.100     1.200     1.200 peak   202 spectrum    1 weight  0.10000E+01 volume  0.12964E-02 ppm1      3.684 ppm2      2.312 CV     1
 ASSI {  203}
   (( segid "    " and resid 6    and name HD2 ))
   (( segid "    " and resid 6    and name HG2 ))
      2.400     0.700     0.700 peak   203 spectrum    1 weight  0.10000E+01 volume  0.54037E-02 ppm1      3.808 ppm2      2.053 CV     1
 ASSI {  204}
   (( segid "    " and resid 6    and name HD3 ))
   (( segid "    " and resid 6    and name HG2 ))
      2.500     0.800     0.800 peak   204 spectrum    1 weight  0.10000E+01 volume  0.51041E-02 ppm1      3.684 ppm2      2.053 CV     1
 ASSI {  205}
   (( segid "    " and resid 6    and name HD2 ))
   (( segid "    " and resid 6    and name HG3 ))
      2.400     0.700     0.700 peak   205 spectrum    1 weight  0.10000E+01 volume  0.56345E-02 ppm1      3.806 ppm2      2.002 CV     1
 ASSI {  206}
   (( segid "    " and resid 6    and name HD3 ))
   (( segid "    " and resid 6    and name HG3 ))
      2.500     0.800     0.800 peak   206 spectrum    1 weight  0.10000E+01 volume  0.40423E-02 ppm1      3.684 ppm2      2.002 CV     1
 ASSI {  207}
   (( segid "    " and resid 6    and name HD2 ))
   (( segid "    " and resid 6    and name HB3 ))
      2.800     1.000     1.000 peak   207 spectrum    1 weight  0.11000E+01 volume  0.22825E-02 ppm1      3.806 ppm2      1.889 CV     1
 ASSI {  208}
   (( segid "    " and resid 6    and name HD3 ))
   (( segid "    " and resid 6    and name HB3 ))
      3.000     1.100     1.100 peak   208 spectrum    1 weight  0.10000E+01 volume  0.15805E-02 ppm1      3.683 ppm2      1.889 CV     1
 ASSI {  209}
   (( segid "    " and resid 6    and name HB2 ))
   (( segid "    " and resid 6    and name HG2 ))
      2.400     0.700     0.700 peak   209 spectrum    1 weight  0.10000E+01 volume  0.51681E-02 ppm1      2.321 ppm2      2.053 CV     1
 ASSI {  210}
   (( segid "    " and resid 6    and name HB2 ))
   (( segid "    " and resid 6    and name HG3 ))
      2.400     0.700     0.700 peak   210 spectrum    1 weight  0.10000E+01 volume  0.64907E-02 ppm1      2.321 ppm2      2.004 CV     1
 ASSI {  211}
   (( segid "    " and resid 6    and name HB2 ))
   (( segid "    " and resid 6    and name HB3 ))
      1.800     0.400     0.400 peak   211 spectrum    1 weight  0.10000E+01 volume  0.29778E-01 ppm1      2.321 ppm2      1.892 CV     1
 ASSI {  212}
   (( segid "    " and resid 6    and name HG2 ))
   (( segid "    " and resid 6    and name HG3 ))
      1.800     0.400     0.400 peak   212 spectrum    1 weight  0.10000E+01 volume  0.32259E-01 ppm1      2.064 ppm2      2.004 CV     1
 ASSI {  213}
   (( segid "    " and resid 6    and name HG2 ))
   (( segid "    " and resid 6    and name HB3 ))
      2.800     1.000     1.000 peak   213 spectrum    1 weight  0.10000E+01 volume  0.21108E-02 ppm1      2.071 ppm2      1.891 CV     1
 ASSI {  214}
   (( segid "    " and resid 6    and name HG3 ))
   (( segid "    " and resid 6    and name HB3 ))
      2.400     0.700     0.700 peak   214 spectrum    1 weight  0.10000E+01 volume  0.61678E-02 ppm1      2.010 ppm2      1.892 CV     1
 ASSI {  215}
   (( segid "    " and resid 24   and name HB  ))
   (( segid "    " and resid 24   and name HA  ))
      2.300     0.600     0.600 peak   215 spectrum    1 weight  0.10000E+01 volume  0.84687E-02 ppm1      4.264 ppm2      4.088 CV     1
 ASSI {  217}
   (( segid "    " and resid 5    and name HA  ))
   (( segid "    " and resid 5    and name HN  ))
      2.400     0.700     0.700 peak   217 spectrum    1 weight  0.10000E+01 volume  0.57605E-02 ppm1      4.511 ppm2      8.486 CV     1
 ASSI {  218}
   (  segid "    " and resid 5    and name HB% )
   (( segid "    " and resid 5    and name HN  ))
      2.100     0.600     0.600 peak   218 spectrum    1 weight  0.11000E+01 volume  0.12857E-01 ppm1      1.401 ppm2      8.486 CV     1
 ASSI {  219}
   (( segid "    " and resid 5    and name HA  ))
   (  segid "    " and resid 5    and name HB% )
      2.100     0.500     0.500 peak   219 spectrum    1 weight  0.10000E+01 volume  0.14447E-01 ppm1      4.511 ppm2      1.390 CV     1
 ASSI {  220}
   (  segid "    " and resid 31   and name HB% )
   (( segid "    " and resid 31   and name HN  ))
      2.200     0.600     0.600 peak   220 spectrum    1 weight  0.10000E+01 volume  0.92182E-02 ppm1      1.453 ppm2      7.996 CV     1
 ASSI {  221}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 31   and name HN  ))
      2.400     0.700     0.700 peak   221 spectrum    1 weight  0.10000E+01 volume  0.62531E-02 ppm1      4.224 ppm2      7.996 CV     1
 ASSI {  223}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 17   and name HN  ))
      2.700     0.900     0.900 peak   223 spectrum    1 weight  0.10000E+01 volume  0.27499E-02 ppm1      4.248 ppm2      8.171 CV     1
 ASSI {  224}
   (  segid "    " and resid 17   and name HB% )
   (( segid "    " and resid 17   and name HN  ))
      2.300     0.600     0.600 peak   224 spectrum    1 weight  0.10000E+01 volume  0.81759E-02 ppm1      1.518 ppm2      8.171 CV     1
 ASSI {  226}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 11   and name HN  ))
      6.000     4.500     0.000 peak   226 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.254 ppm2      8.349 CV     1
 ASSI {  227}
   (  segid "    " and resid 11   and name HB% )
   (( segid "    " and resid 11   and name HN  ))
      2.500     0.800     0.800 peak   227 spectrum    1 weight  0.10000E+01 volume  0.50169E-02 ppm1      1.443 ppm2      8.348 CV     1
 ASSI {  229}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 34   and name HN  ))
      2.500     0.800     0.800 peak   229 spectrum    1 weight  0.10000E+01 volume  0.46203E-02 ppm1      4.324 ppm2      7.916 CV     1
 ASSI {  230}
   (  segid "    " and resid 34   and name HB% )
   (( segid "    " and resid 34   and name HN  ))
      2.900     1.000     1.000 peak   230 spectrum    1 weight  0.10000E+01 volume  0.20032E-02 ppm1      1.436 ppm2      7.916 CV     1
 ASSI {  232}
   (( segid "    " and resid 33   and name HA  ))
   (( segid "    " and resid 33   and name HN  ))
      2.400     0.700     0.700 peak   232 spectrum    1 weight  0.10000E+01 volume  0.52922E-02 ppm1      4.288 ppm2      7.905 CV     1
 ASSI {  233}
   (  segid "    " and resid 33   and name HB% )
   (( segid "    " and resid 33   and name HN  ))
      2.400     0.700     0.700 peak   233 spectrum    1 weight  0.10000E+01 volume  0.61252E-02 ppm1      1.452 ppm2      7.905 CV     1
 ASSI {  235}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 21   and name HN  ))
      2.400     0.700     0.700 peak   235 spectrum    1 weight  0.10000E+01 volume  0.52641E-02 ppm1      4.231 ppm2      8.019 CV     1
 ASSI {  236}
   (  segid "    " and resid 21   and name HB% )
   (( segid "    " and resid 21   and name HN  ))
      2.700     0.900     0.900 peak   236 spectrum    1 weight  0.10000E+01 volume  0.27537E-02 ppm1      1.543 ppm2      8.019 CV     1
 ASSI {  238}
   (( segid "    " and resid 26   and name HA  ))
   (( segid "    " and resid 26   and name HN  ))
      2.700     0.900     0.900 peak   238 spectrum    1 weight  0.10000E+01 volume  0.28119E-02 ppm1      4.249 ppm2      8.333 CV     1
 ASSI {  239}
   (  segid "    " and resid 26   and name HB% )
   (( segid "    " and resid 26   and name HN  ))
      2.500     0.800     0.800 peak   239 spectrum    1 weight  0.10000E+01 volume  0.50256E-02 ppm1      1.513 ppm2      8.333 CV     1
 ASSI {  241}
   (( segid "    " and resid 10   and name HA  ))
   (( segid "    " and resid 10   and name HN  ))
      2.900     1.100     1.100 peak   241 spectrum    1 weight  0.10000E+01 volume  0.17386E-02 ppm1      4.230 ppm2      8.375 CV     1
 ASSI {  242}
   (  segid "    " and resid 10   and name HB% )
   (( segid "    " and resid 10   and name HN  ))
      2.800     1.000     1.000 peak   242 spectrum    1 weight  0.10000E+01 volume  0.24706E-02 ppm1      1.436 ppm2      8.375 CV     1
 ASSI {  244}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 15   and name HN  ))
      2.700     0.900     0.900 peak   244 spectrum    1 weight  0.10000E+01 volume  0.27237E-02 ppm1      4.205 ppm2      8.383 CV     1
 ASSI {  245}
   (  segid "    " and resid 15   and name HB% )
   (( segid "    " and resid 15   and name HN  ))
      2.500     0.800     0.800 peak   245 spectrum    1 weight  0.10000E+01 volume  0.49480E-02 ppm1      1.497 ppm2      8.383 CV     1
 ASSI {  247}
   (  segid "    " and resid 30   and name HB% )
   (( segid "    " and resid 30   and name HN  ))
      2.500     0.800     0.800 peak   247 spectrum    1 weight  0.10000E+01 volume  0.43245E-02 ppm1      1.493 ppm2      8.078 CV     1
 ASSI {  248}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 30   and name HN  ))
      2.400     0.700     0.700 peak   248 spectrum    1 weight  0.10000E+01 volume  0.62133E-02 ppm1      4.246 ppm2      8.078 CV     1
 ASSI {  250}
   (( segid "    " and resid 25   and name HA  ))
   (( segid "    " and resid 25   and name HN  ))
      2.500     0.800     0.800 peak   250 spectrum    1 weight  0.10000E+01 volume  0.42344E-02 ppm1      4.268 ppm2      8.099 CV     1
 ASSI {  251}
   (  segid "    " and resid 25   and name HB% )
   (( segid "    " and resid 25   and name HN  ))
      2.500     0.800     0.800 peak   251 spectrum    1 weight  0.10000E+01 volume  0.46028E-02 ppm1      1.488 ppm2      8.099 CV     1
 ASSI {  257}
   (( segid "    " and resid 29   and name HA  ))
   (( segid "    " and resid 29   and name HN  ))
      2.500     0.800     0.800 peak   257 spectrum    1 weight  0.10000E+01 volume  0.43527E-02 ppm1      4.237 ppm2      8.129 CV     1
 ASSI {  258}
   (  segid "    " and resid 29   and name HB% )
   (( segid "    " and resid 29   and name HN  ))
      2.600     0.800     0.800 peak   258 spectrum    1 weight  0.10000E+01 volume  0.37990E-02 ppm1      1.492 ppm2      8.129 CV     1
 ASSI {  260}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 20   and name HN  ))
      6.000     4.500     0.000 peak   260 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.234 ppm2      8.163 CV     1
 ASSI {  261}
   (  segid "    " and resid 20   and name HB% )
   (( segid "    " and resid 20   and name HN  ))
      2.400     0.700     0.700 peak   261 spectrum    1 weight  0.10000E+01 volume  0.65091E-02 ppm1      1.497 ppm2      8.163 CV     1
 ASSI {  263}
   (( segid "    " and resid 28   and name HA  ))
   (( segid "    " and resid 28   and name HN  ))
      2.800     1.000     1.000 peak   263 spectrum    1 weight  0.10000E+01 volume  0.23213E-02 ppm1      4.249 ppm2      8.115 CV     1
 ASSI {  264}
   (  segid "    " and resid 28   and name HB% )
   (( segid "    " and resid 28   and name HN  ))
      2.800     1.000     1.000 peak   264 spectrum    1 weight  0.10000E+01 volume  0.21748E-02 ppm1      1.504 ppm2      8.115 CV     1
 ASSI {  265}
   (( segid "    " and resid 9    and name HA  ))
   (( segid "    " and resid 9    and name HN  ))
      2.500     0.800     0.800 peak   265 spectrum    1 weight  0.10000E+01 volume  0.50673E-02 ppm1      4.260 ppm2      8.441 CV     1
 ASSI {  266}
   (  segid "    " and resid 9    and name HB% )
   (( segid "    " and resid 9    and name HN  ))
      2.800     1.000     1.000 peak   266 spectrum    1 weight  0.10000E+01 volume  0.22932E-02 ppm1      1.426 ppm2      8.442 CV     1
 ASSI {  268}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 7    and name HN  ))
      2.800     1.000     1.000 peak   268 spectrum    1 weight  0.10000E+01 volume  0.24143E-02 ppm1      4.243 ppm2      8.423 CV     1
 ASSI {  269}
   (  segid "    " and resid 7    and name HB% )
   (( segid "    " and resid 7    and name HN  ))
      2.600     0.800     0.800 peak   269 spectrum    1 weight  0.10000E+01 volume  0.37030E-02 ppm1      1.422 ppm2      8.422 CV     1
 ASSI {  271}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 14   and name HN  ))
      2.900     1.000     1.000 peak   271 spectrum    1 weight  0.10000E+01 volume  0.19693E-02 ppm1      4.254 ppm2      8.434 CV     1
 ASSI {  272}
   (  segid "    " and resid 14   and name HB% )
   (( segid "    " and resid 14   and name HN  ))
      2.600     0.900     0.900 peak   272 spectrum    1 weight  0.10000E+01 volume  0.32831E-02 ppm1      1.467 ppm2      8.434 CV     1
 ASSI {  274}
   (( segid "    " and resid 2    and name HA  ))
   (( segid "    " and resid 3    and name HN  ))
      2.600     0.800     0.800 peak   274 spectrum    1 weight  0.10000E+01 volume  0.37796E-02 ppm1      4.501 ppm2      8.744 CV     1
 ASSI {  275}
   (( segid "    " and resid 2    and name HB2 ))
   (( segid "    " and resid 3    and name HN  ))
      3.200     1.300     1.300 peak   275 spectrum    1 weight  0.10000E+01 volume  0.10356E-02 ppm1      3.872 ppm2      8.744 CV     1
 OR {  275}
   (( segid "    " and resid 2    and name HB3 ))
   (( segid "    " and resid 3    and name HN  ))
 ASSI {  276}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 28   and name HN  ))
      3.000     1.100     1.100 peak   276 spectrum    1 weight  0.10000E+01 volume  0.15824E-02 ppm1      4.463 ppm2      8.115 CV     1
 ASSI {  277}
   (( segid "    " and resid 27   and name HB2 ))
   (( segid "    " and resid 28   and name HN  ))
      2.600     0.900     0.900 peak   277 spectrum    1 weight  0.11000E+01 volume  0.34034E-02 ppm1      2.817 ppm2      8.115 CV     1
 ASSI {  278}
   (( segid "    " and resid 27   and name HB3 ))
   (( segid "    " and resid 28   and name HN  ))
      2.500     0.800     0.800 peak   278 spectrum    1 weight  0.10000E+01 volume  0.44050E-02 ppm1      2.697 ppm2      8.114 CV     1
 ASSI {  279}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 27   and name HN  ))
      2.200     0.600     0.600 peak   279 spectrum    1 weight  0.10000E+01 volume  0.97253E-02 ppm1      8.126 ppm2      8.724 CV     1
 ASSI {  280}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 16   and name HB3 ))
      2.000     0.500     0.500 peak   280 spectrum    1 weight  0.10000E+01 volume  0.15097E-01 ppm1      2.840 ppm2      2.685 CV     1
 ASSI {  281}
   (( segid "    " and resid 16   and name HB3 ))
   (( segid "    " and resid 17   and name HN  ))
      2.600     0.800     0.800 peak   281 spectrum    1 weight  0.11000E+01 volume  0.39231E-02 ppm1      2.700 ppm2      8.170 CV     1
 ASSI {  282}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 17   and name HN  ))
      2.700     0.900     0.900 peak   282 spectrum    1 weight  0.11000E+01 volume  0.28720E-02 ppm1      2.841 ppm2      8.170 CV     1
 ASSI {  283}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 17   and name HN  ))
      3.000     1.100     1.100 peak   283 spectrum    1 weight  0.10000E+01 volume  0.15630E-02 ppm1      4.479 ppm2      8.170 CV     1
 ASSI {  285}
   (( segid "    " and resid 3    and name HG2 ))
   (( segid "    " and resid 4    and name HN  ))
      4.800     2.900     1.200 peak   285 spectrum    1 weight  0.10000E+01 volume  0.90951E-04 ppm1      2.613 ppm2      8.545 CV     1
 ASSI {  286}
   (( segid "    " and resid 3    and name HG3 ))
   (( segid "    " and resid 4    and name HN  ))
      4.700     2.700     1.300 peak   286 spectrum    1 weight  0.10000E+01 volume  0.10695E-03 ppm1      2.557 ppm2      8.545 CV     1
 ASSI {  287}
   (( segid "    " and resid 3    and name HB2 ))
   (( segid "    " and resid 4    and name HN  ))
      3.100     1.200     1.200 peak   287 spectrum    1 weight  0.10000E+01 volume  0.12896E-02 ppm1      2.091 ppm2      8.546 CV     1
 ASSI {  288}
   (( segid "    " and resid 3    and name HB3 ))
   (( segid "    " and resid 4    and name HN  ))
      3.500     1.500     1.500 peak   288 spectrum    1 weight  0.10000E+01 volume  0.62677E-03 ppm1      2.015 ppm2      8.547 CV     1
 ASSI {  289}
   (( segid "    " and resid 3    and name HA  ))
   (( segid "    " and resid 4    and name HN  ))
      3.100     1.200     1.200 peak   289 spectrum    1 weight  0.10000E+01 volume  0.11703E-02 ppm1      4.519 ppm2      8.546 CV     1
 ASSI {  290}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 3    and name HN  ))
      3.400     1.400     1.400 peak   290 spectrum    1 weight  0.10000E+01 volume  0.75718E-03 ppm1      8.558 ppm2      8.744 CV     1
 ASSI {  291}
   (( segid "    " and resid 4    and name HA  ))
   (( segid "    " and resid 5    and name HN  ))
      2.100     0.600     0.600 peak   291 spectrum    1 weight  0.10000E+01 volume  0.12169E-01 ppm1      4.699 ppm2      8.486 CV     1
 ASSI {  292}
   (( segid "    " and resid 4    and name HB2 ))
   (( segid "    " and resid 5    and name HN  ))
      2.800     1.000     1.000 peak   292 spectrum    1 weight  0.11000E+01 volume  0.24396E-02 ppm1      2.838 ppm2      8.486 CV     1
 ASSI {  293}
   (( segid "    " and resid 4    and name HB3 ))
   (( segid "    " and resid 5    and name HN  ))
      3.000     1.100     1.100 peak   293 spectrum    1 weight  0.10000E+01 volume  0.16445E-02 ppm1      2.784 ppm2      8.486 CV     1
 ASSI {  294}
   (( segid "    " and resid 4    and name HA  ))
   (( segid "    " and resid 4    and name HD21))
      4.100     2.100     1.900 peak   294 spectrum    1 weight  0.10000E+01 volume  0.24532E-03 ppm1      4.700 ppm2      7.724 CV     1
 ASSI {  295}
   (( segid "    " and resid 4    and name HB2 ))
   (( segid "    " and resid 4    and name HD21))
      2.800     1.000     1.000 peak   295 spectrum    1 weight  0.10000E+01 volume  0.21448E-02 ppm1      2.837 ppm2      7.725 CV     1
 ASSI {  296}
   (( segid "    " and resid 4    and name HB3 ))
   (( segid "    " and resid 4    and name HD21))
      3.200     1.300     1.300 peak   296 spectrum    1 weight  0.10000E+01 volume  0.10346E-02 ppm1      2.784 ppm2      7.725 CV     1
 ASSI {  297}
   (( segid "    " and resid 4    and name HB2 ))
   (( segid "    " and resid 4    and name HD22))
      3.400     1.500     1.500 peak   297 spectrum    1 weight  0.10000E+01 volume  0.69997E-03 ppm1      2.837 ppm2      7.014 CV     1
 ASSI {  298}
   (( segid "    " and resid 4    and name HB3 ))
   (( segid "    " and resid 4    and name HD22))
      3.400     1.500     1.500 peak   298 spectrum    1 weight  0.10000E+01 volume  0.70133E-03 ppm1      2.786 ppm2      7.014 CV     1
 ASSI {  299}
   (( segid "    " and resid 4    and name HD21))
   (( segid "    " and resid 4    and name HN  ))
      4.100     2.100     1.900 peak   299 spectrum    1 weight  0.10000E+01 volume  0.25113E-03 ppm1      7.735 ppm2      8.545 CV     1
 ASSI {  300}
   (( segid "    " and resid 4    and name HD22))
   (( segid "    " and resid 4    and name HN  ))
      4.100     2.100     1.900 peak   300 spectrum    1 weight  0.10000E+01 volume  0.23707E-03 ppm1      7.029 ppm2      8.545 CV     1
 ASSI {  301}
   (( segid "    " and resid 5    and name HA  ))
   (( segid "    " and resid 6    and name HD2 ))
      2.900     1.100     1.100 peak   301 spectrum    1 weight  0.10000E+01 volume  0.17037E-02 ppm1      4.511 ppm2      3.797 CV     1
 ASSI {  302}
   (( segid "    " and resid 5    and name HA  ))
   (( segid "    " and resid 6    and name HD3 ))
      3.000     1.200     1.200 peak   302 spectrum    1 weight  0.10000E+01 volume  0.13847E-02 ppm1      4.511 ppm2      3.674 CV     1
 ASSI {  303}
   (( segid "    " and resid 6    and name HD2 ))
   (  segid "    " and resid 5    and name HB% )
      2.300     0.700     0.700 peak   303 spectrum    1 weight  0.11000E+01 volume  0.71267E-02 ppm1      3.806 ppm2      1.389 CV     1
 ASSI {  304}
   (( segid "    " and resid 6    and name HD3 ))
   (  segid "    " and resid 5    and name HB% )
      2.600     0.800     0.800 peak   304 spectrum    1 weight  0.11000E+01 volume  0.39803E-02 ppm1      3.683 ppm2      1.389 CV     1
 ASSI {  307}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 7    and name HN  ))
      2.600     0.900     0.900 peak   307 spectrum    1 weight  0.10000E+01 volume  0.32482E-02 ppm1      4.403 ppm2      8.422 CV     1
 ASSI {  308}
   (( segid "    " and resid 6    and name HD2 ))
   (( segid "    " and resid 7    and name HN  ))
      3.400     1.400     1.400 peak   308 spectrum    1 weight  0.10000E+01 volume  0.78190E-03 ppm1      3.805 ppm2      8.422 CV     1
 ASSI {  309}
   (( segid "    " and resid 6    and name HD3 ))
   (( segid "    " and resid 7    and name HN  ))
      2.800     1.000     1.000 peak   309 spectrum    1 weight  0.10000E+01 volume  0.21894E-02 ppm1      3.687 ppm2      8.422 CV     1
 ASSI {  310}
   (( segid "    " and resid 6    and name HD2 ))
   (( segid "    " and resid 5    and name HN  ))
      2.800     1.000     1.000 peak   310 spectrum    1 weight  0.10000E+01 volume  0.22980E-02 ppm1      3.805 ppm2      8.486 CV     1
 ASSI {  311}
   (( segid "    " and resid 6    and name HD3 ))
   (( segid "    " and resid 5    and name HN  ))
      2.800     1.000     1.000 peak   311 spectrum    1 weight  0.10000E+01 volume  0.22670E-02 ppm1      3.687 ppm2      8.486 CV     1
 ASSI {  312}
   (( segid "    " and resid 6    and name HB2 ))
   (( segid "    " and resid 7    and name HN  ))
      2.900     1.000     1.000 peak   312 spectrum    1 weight  0.11000E+01 volume  0.19344E-02 ppm1      2.319 ppm2      8.423 CV     1
 ASSI {  313}
   (( segid "    " and resid 6    and name HG2 ))
   (( segid "    " and resid 7    and name HN  ))
      3.500     1.500     1.500 peak   313 spectrum    1 weight  0.10000E+01 volume  0.60437E-03 ppm1      2.064 ppm2      8.422 CV     1
 ASSI {  314}
   (( segid "    " and resid 6    and name HG3 ))
   (( segid "    " and resid 7    and name HN  ))
      3.800     1.800     1.800 peak   314 spectrum    1 weight  0.10000E+01 volume  0.39241E-03 ppm1      2.016 ppm2      8.423 CV     1
 ASSI {  315}
   (( segid "    " and resid 6    and name HB3 ))
   (( segid "    " and resid 7    and name HN  ))
      3.200     1.300     1.300 peak   315 spectrum    1 weight  0.10000E+01 volume  0.99969E-03 ppm1      1.903 ppm2      8.418 CV     1
 ASSI {  316}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 8    and name HN  ))
      2.500     0.800     0.800 peak   316 spectrum    1 weight  0.11000E+01 volume  0.41073E-02 ppm1      4.242 ppm2      8.454 CV     1
 ASSI {  317}
   (  segid "    " and resid 7    and name HB% )
   (( segid "    " and resid 8    and name HN  ))
      2.400     0.700     0.700 peak   317 spectrum    1 weight  0.10000E+01 volume  0.60301E-02 ppm1      1.419 ppm2      8.454 CV     1
 ASSI {  318}
   (  segid "    " and resid 7    and name HB% )
   (( segid "    " and resid 8    and name HE  ))
      3.700     1.800     1.800 peak   318 spectrum    1 weight  0.10000E+01 volume  0.40278E-03 ppm1      1.423 ppm2      7.261 CV     1
 ASSI {  320}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 24   and name HN  ))
      6.000     4.500     0.000 peak   320 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.259 ppm2      8.458 CV     1
 ASSI {  321}
   (( segid "    " and resid 23   and name HB2 ))
   (( segid "    " and resid 24   and name HN  ))
      2.700     0.900     0.900 peak   321 spectrum    1 weight  0.10000E+01 volume  0.25996E-02 ppm1      2.028 ppm2      8.458 CV     1
 ASSI {  322}
   (( segid "    " and resid 23   and name HB3 ))
   (( segid "    " and resid 24   and name HN  ))
      2.600     0.800     0.800 peak   322 spectrum    1 weight  0.11000E+01 volume  0.37253E-02 ppm1      1.897 ppm2      8.457 CV     1
 ASSI {  323}
   (( segid "    " and resid 23   and name HG2 ))
   (( segid "    " and resid 24   and name HN  ))
      2.900     1.100     1.100 peak   323 spectrum    1 weight  0.10000E+01 volume  0.18607E-02 ppm1      1.486 ppm2      8.458 CV     1
 OR {  323}
   (( segid "    " and resid 23   and name HG3 ))
   (( segid "    " and resid 24   and name HN  ))
 ASSI {  324}
   (  segid "    " and resid 24   and name HG2%)
   (( segid "    " and resid 23   and name HN  ))
      3.800     1.800     1.800 peak   324 spectrum    1 weight  0.10000E+01 volume  0.37583E-03 ppm1      1.286 ppm2      8.053 CV     1
 ASSI {  326}
   (( segid "    " and resid 22   and name HE2 ))
   (( segid "    " and resid 22   and name HN  ))
      4.400     2.500     1.600 peak   326 spectrum    1 weight  0.10000E+01 volume  0.14467E-03 ppm1      2.969 ppm2      8.197 CV     1
 OR {  326}
   (( segid "    " and resid 22   and name HE3 ))
   (( segid "    " and resid 22   and name HN  ))
 ASSI {  327}
   (( segid "    " and resid 22   and name HG3 ))
   (( segid "    " and resid 23   and name HN  ))
      3.600     1.600     1.600 peak   327 spectrum    1 weight  0.10000E+01 volume  0.50857E-03 ppm1      1.446 ppm2      8.054 CV     1
 ASSI {  328}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 23   and name HN  ))
      3.400     1.400     1.400 peak   328 spectrum    1 weight  0.10000E+01 volume  0.75796E-03 ppm1      1.911 ppm2      8.054 CV     1
 OR {  328}
   (( segid "    " and resid 22   and name HB3 ))
   (( segid "    " and resid 23   and name HN  ))
 ASSI {  329}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 23   and name HN  ))
      2.600     0.900     0.900 peak   329 spectrum    1 weight  0.10000E+01 volume  0.33268E-02 ppm1      4.149 ppm2      8.054 CV     1
 ASSI {  331}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 22   and name HN  ))
      3.400     1.500     1.500 peak   331 spectrum    1 weight  0.10000E+01 volume  0.68077E-03 ppm1      4.234 ppm2      8.197 CV     1
 ASSI {  332}
   (  segid "    " and resid 21   and name HB% )
   (( segid "    " and resid 22   and name HN  ))
      2.300     0.700     0.700 peak   332 spectrum    1 weight  0.10000E+01 volume  0.72179E-02 ppm1      1.543 ppm2      8.197 CV     1
 ASSI {  334}
   (  segid "    " and resid 26   and name HB% )
   (( segid "    " and resid 27   and name HN  ))
      2.500     0.800     0.800 peak   334 spectrum    1 weight  0.10000E+01 volume  0.50673E-02 ppm1      1.513 ppm2      8.724 CV     1
 ASSI {  335}
   (( segid "    " and resid 26   and name HA  ))
   (( segid "    " and resid 27   and name HN  ))
      2.600     0.900     0.900 peak   335 spectrum    1 weight  0.10000E+01 volume  0.33947E-02 ppm1      4.249 ppm2      8.724 CV     1
 ASSI {  336}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 27   and name HN  ))
      2.300     0.700     0.700 peak   336 spectrum    1 weight  0.10000E+01 volume  0.73575E-02 ppm1      8.346 ppm2      8.724 CV     1
 ASSI {  337}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 26   and name HN  ))
      3.800     1.800     1.800 peak   337 spectrum    1 weight  0.10000E+01 volume  0.37069E-03 ppm1      4.464 ppm2      8.334 CV     1
 ASSI {  339}
   (( segid "    " and resid 27   and name HB3 ))
   (( segid "    " and resid 26   and name HN  ))
      4.500     2.600     1.500 peak   339 spectrum    1 weight  0.10000E+01 volume  0.12916E-03 ppm1      2.697 ppm2      8.332 CV     1
 ASSI {  340}
   (( segid "    " and resid 24   and name HA  ))
   (( segid "    " and resid 25   and name HN  ))
      3.000     1.200     1.200 peak   340 spectrum    1 weight  0.10000E+01 volume  0.14030E-02 ppm1      4.105 ppm2      8.099 CV     1
 ASSI {  341}
   (  segid "    " and resid 24   and name HG2%)
   (( segid "    " and resid 25   and name HN  ))
      2.700     0.900     0.900 peak   341 spectrum    1 weight  0.11000E+01 volume  0.29370E-02 ppm1      1.286 ppm2      8.099 CV     1
 ASSI {  343}
   (  segid "    " and resid 24   and name HG2%)
   (( segid "    " and resid 26   and name HN  ))
      3.400     1.500     1.500 peak   343 spectrum    1 weight  0.11000E+01 volume  0.68591E-03 ppm1      1.286 ppm2      8.334 CV     1
 ASSI {  344}
   (  segid "    " and resid 25   and name HB% )
   (( segid "    " and resid 26   and name HN  ))
      2.900     1.000     1.000 peak   344 spectrum    1 weight  0.10000E+01 volume  0.20343E-02 ppm1      1.488 ppm2      8.333 CV     1
 ASSI {  345}
   (( segid "    " and resid 25   and name HA  ))
   (( segid "    " and resid 26   and name HN  ))
      6.000     4.500     0.000 peak   345 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.268 ppm2      8.333 CV     1
 ASSI {  346}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 26   and name HN  ))
      2.200     0.600     0.600 peak   346 spectrum    1 weight  0.10000E+01 volume  0.85715E-02 ppm1      8.109 ppm2      8.333 CV     1
 ASSI {  347}
   (  segid "    " and resid 18   and name HD2%)
   (( segid "    " and resid 19   and name HN  ))
      3.500     1.600     1.600 peak   347 spectrum    1 weight  0.10000E+01 volume  0.56519E-03 ppm1      0.915 ppm2      8.033 CV     1
 ASSI {  348}
   (  segid "    " and resid 18   and name HD1%)
   (( segid "    " and resid 19   and name HN  ))
      3.600     1.600     1.600 peak   348 spectrum    1 weight  0.10000E+01 volume  0.49713E-03 ppm1      0.953 ppm2      8.032 CV     1
 ASSI {  349}
   (( segid "    " and resid 18   and name HG  ))
   (( segid "    " and resid 19   and name HN  ))
      3.200     1.300     1.300 peak   349 spectrum    1 weight  0.10000E+01 volume  0.96914E-03 ppm1      1.705 ppm2      8.032 CV     1
 ASSI {  350}
   (( segid "    " and resid 18   and name HB3 ))
   (( segid "    " and resid 19   and name HN  ))
      3.200     1.300     1.300 peak   350 spectrum    1 weight  0.10000E+01 volume  0.10724E-02 ppm1      1.742 ppm2      8.033 CV     1
 ASSI {  351}
   (( segid "    " and resid 18   and name HB2 ))
   (( segid "    " and resid 19   and name HN  ))
      3.300     1.300     1.300 peak   351 spectrum    1 weight  0.10000E+01 volume  0.91154E-03 ppm1      1.785 ppm2      8.033 CV     1
 ASSI {  352}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 19   and name HN  ))
      2.700     0.900     0.900 peak   352 spectrum    1 weight  0.10000E+01 volume  0.26596E-02 ppm1      4.255 ppm2      8.032 CV     1
 ASSI {  353}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 18   and name HN  ))
      6.000     4.500     0.000 peak   353 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      8.045 ppm2      8.071 CV     1
 ASSI {  354}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 19   and name HN  ))
      4.800     2.800     1.200 peak   354 spectrum    1 weight  0.10000E+01 volume  0.96283E-04 ppm1      2.841 ppm2      8.033 CV     1
 ASSI {  355}
   (( segid "    " and resid 16   and name HB3 ))
   (( segid "    " and resid 19   and name HN  ))
      4.200     2.200     1.800 peak   355 spectrum    1 weight  0.10000E+01 volume  0.20847E-03 ppm1      2.700 ppm2      8.032 CV     1
 ASSI {  356}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 20   and name HN  ))
      2.800     1.000     1.000 peak   356 spectrum    1 weight  0.10000E+01 volume  0.25006E-02 ppm1      4.145 ppm2      8.163 CV     1
 ASSI {  357}
   (  segid "    " and resid 19   and name HB% )
   (( segid "    " and resid 20   and name HN  ))
      3.000     1.100     1.100 peak   357 spectrum    1 weight  0.10000E+01 volume  0.15447E-02 ppm1      1.524 ppm2      8.163 CV     1
 ASSI {  359}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 19   and name HN  ))
      2.800     1.000     1.000 peak   359 spectrum    1 weight  0.10000E+01 volume  0.24900E-02 ppm1      4.479 ppm2      8.033 CV     1
 ASSI {  360}
   (  segid "    " and resid 20   and name HB% )
   (( segid "    " and resid 21   and name HN  ))
      2.600     0.900     0.900 peak   360 spectrum    1 weight  0.10000E+01 volume  0.33268E-02 ppm1      1.497 ppm2      8.019 CV     1
 ASSI {  362}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 13   and name HN  ))
      6.000     4.500     0.000 peak   362 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.341 ppm2      8.417 CV     1
 ASSI {  363}
   (( segid "    " and resid 12   and name HB2 ))
   (( segid "    " and resid 13   and name HN  ))
      3.100     1.200     1.200 peak   363 spectrum    1 weight  0.10000E+01 volume  0.13662E-02 ppm1      1.958 ppm2      8.418 CV     1
 ASSI {  364}
   (( segid "    " and resid 12   and name HB3 ))
   (( segid "    " and resid 13   and name HN  ))
      3.000     1.100     1.100 peak   364 spectrum    1 weight  0.10000E+01 volume  0.16242E-02 ppm1      1.855 ppm2      8.418 CV     1
 ASSI {  365}
   (( segid "    " and resid 12   and name HD2 ))
   (( segid "    " and resid 13   and name HN  ))
      4.000     2.000     2.000 peak   365 spectrum    1 weight  0.10000E+01 volume  0.27799E-03 ppm1      1.721 ppm2      8.418 CV     1
 ASSI {  366}
   (( segid "    " and resid 12   and name HD3 ))
   (( segid "    " and resid 13   and name HN  ))
      4.300     2.300     1.700 peak   366 spectrum    1 weight  0.10000E+01 volume  0.18123E-03 ppm1      1.665 ppm2      8.418 CV     1
 ASSI {  367}
   (( segid "    " and resid 12   and name HG2 ))
   (( segid "    " and resid 13   and name HN  ))
      3.700     1.700     1.700 peak   367 spectrum    1 weight  0.10000E+01 volume  0.45107E-03 ppm1      1.514 ppm2      8.417 CV     1
 ASSI {  368}
   (( segid "    " and resid 12   and name HG3 ))
   (( segid "    " and resid 13   and name HN  ))
      3.600     1.600     1.600 peak   368 spectrum    1 weight  0.10000E+01 volume  0.48792E-03 ppm1      1.477 ppm2      8.417 CV     1
 ASSI {  369}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 13   and name HN  ))
      2.800     1.000     1.000 peak   369 spectrum    1 weight  0.11000E+01 volume  0.22592E-02 ppm1      8.333 ppm2      8.417 CV     1
 ASSI {  370}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 16   and name HN  ))
      2.900     1.100     1.100 peak   370 spectrum    1 weight  0.10000E+01 volume  0.16978E-02 ppm1      4.208 ppm2      8.564 CV     1
 ASSI {  371}
   (  segid "    " and resid 15   and name HB% )
   (( segid "    " and resid 16   and name HN  ))
      2.500     0.800     0.800 peak   371 spectrum    1 weight  0.10000E+01 volume  0.48985E-02 ppm1      1.497 ppm2      8.565 CV     1
 ASSI {  373}
   (( segid "    " and resid 13   and name HB  ))
   (( segid "    " and resid 14   and name HN  ))
      2.600     0.800     0.800 peak   373 spectrum    1 weight  0.10000E+01 volume  0.38872E-02 ppm1      4.345 ppm2      8.434 CV     1
 ASSI {  374}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 14   and name HN  ))
      2.700     0.900     0.900 peak   374 spectrum    1 weight  0.10000E+01 volume  0.26703E-02 ppm1      4.220 ppm2      8.434 CV     1
 ASSI {  375}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 14   and name HN  ))
      3.000     1.100     1.100 peak   375 spectrum    1 weight  0.10000E+01 volume  0.16387E-02 ppm1      1.287 ppm2      8.434 CV     1
 ASSI {  376}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 15   and name HN  ))
      6.000     4.500     0.000 peak   376 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.254 ppm2      8.383 CV     1
 ASSI {  377}
   (  segid "    " and resid 14   and name HB% )
   (( segid "    " and resid 15   and name HN  ))
      2.500     0.800     0.800 peak   377 spectrum    1 weight  0.10000E+01 volume  0.46397E-02 ppm1      1.467 ppm2      8.383 CV     1
 ASSI {  378}
   (  segid "    " and resid 17   and name HB% )
   (( segid "    " and resid 18   and name HN  ))
      2.400     0.700     0.700 peak   378 spectrum    1 weight  0.10000E+01 volume  0.51438E-02 ppm1      1.518 ppm2      8.071 CV     1
 ASSI {  379}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 18   and name HN  ))
      6.000     4.500     0.000 peak   379 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.248 ppm2      8.071 CV     1
 ASSI {  381}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 18   and name HN  ))
      4.100     2.100     1.900 peak   381 spectrum    1 weight  0.10000E+01 volume  0.21894E-03 ppm1      2.841 ppm2      8.073 CV     1
 ASSI {  382}
   (( segid "    " and resid 16   and name HB3 ))
   (( segid "    " and resid 18   and name HN  ))
      4.400     2.400     1.600 peak   382 spectrum    1 weight  0.10000E+01 volume  0.15834E-03 ppm1      2.700 ppm2      8.073 CV     1
 ASSI {  383}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 15   and name HN  ))
      4.100     2.100     1.900 peak   383 spectrum    1 weight  0.10000E+01 volume  0.24589E-03 ppm1      2.841 ppm2      8.383 CV     1
 ASSI {  384}
   (( segid "    " and resid 16   and name HB3 ))
   (( segid "    " and resid 15   and name HN  ))
      3.600     1.600     1.600 peak   384 spectrum    1 weight  0.11000E+01 volume  0.55443E-03 ppm1      2.700 ppm2      8.384 CV     1
 ASSI {  385}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 30   and name HN  ))
      2.800     1.000     1.000 peak   385 spectrum    1 weight  0.11000E+01 volume  0.22176E-02 ppm1      8.008 ppm2      8.078 CV     1
 ASSI {  386}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 31   and name HN  ))
      2.700     0.900     0.900 peak   386 spectrum    1 weight  0.10000E+01 volume  0.29806E-02 ppm1      4.246 ppm2      7.996 CV     1
 ASSI {  387}
   (  segid "    " and resid 30   and name HB% )
   (( segid "    " and resid 31   and name HN  ))
      3.000     1.100     1.100 peak   387 spectrum    1 weight  0.10000E+01 volume  0.16260E-02 ppm1      1.493 ppm2      7.996 CV     1
 ASSI {  388}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 32   and name HN  ))
      2.400     0.700     0.700 peak   388 spectrum    1 weight  0.10000E+01 volume  0.59166E-02 ppm1      4.224 ppm2      7.949 CV     1
 ASSI {  389}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 31   and name HN  ))
      3.300     1.300     1.300 peak   389 spectrum    1 weight  0.10000E+01 volume  0.91658E-03 ppm1      7.957 ppm2      7.996 CV     1
 ASSI {  390}
   (  segid "    " and resid 31   and name HB% )
   (( segid "    " and resid 32   and name HN  ))
      2.700     0.900     0.900 peak   390 spectrum    1 weight  0.10000E+01 volume  0.26325E-02 ppm1      1.453 ppm2      7.948 CV     1
 ASSI {  391}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 32   and name HN  ))
      6.000     4.500     0.000 peak   391 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      7.917 ppm2      7.948 CV     1
 ASSI {  392}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 33   and name HN  ))
      2.200     0.600     0.600 peak   392 spectrum    1 weight  0.10000E+01 volume  0.85783E-02 ppm1      4.245 ppm2      7.905 CV     1
 ASSI {  393}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 33   and name HN  ))
      6.000     4.500     0.000 peak   393 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.457 ppm2      7.905 CV     1
 ASSI {  394}
   (  segid "    " and resid 34   and name HB% )
   (( segid "    " and resid 35   and name HN  ))
      2.800     1.000     1.000 peak   394 spectrum    1 weight  0.10000E+01 volume  0.23775E-02 ppm1      1.430 ppm2      7.828 CV     1
 ASSI {  395}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 35   and name HN  ))
      2.500     0.800     0.800 peak   395 spectrum    1 weight  0.10000E+01 volume  0.46552E-02 ppm1      4.320 ppm2      7.829 CV     1
 ASSI {  397}
   (( segid "    " and resid 33   and name HA  ))
   (( segid "    " and resid 34   and name HN  ))
      3.200     1.200     1.200 peak   397 spectrum    1 weight  0.10000E+01 volume  0.11277E-02 ppm1      4.288 ppm2      7.916 CV     1
 ASSI {  398}
   (  segid "    " and resid 33   and name HB% )
   (( segid "    " and resid 34   and name HN  ))
      2.400     0.700     0.700 peak   398 spectrum    1 weight  0.10000E+01 volume  0.52534E-02 ppm1      1.452 ppm2      7.916 CV     1
 ASSI {  399}
   (( segid "    " and resid 4    and name HB2 ))
   (( segid "    " and resid 7    and name HN  ))
      2.600     0.900     0.900 peak   399 spectrum    1 weight  0.10000E+01 volume  0.35294E-02 ppm1      2.837 ppm2      8.419 CV     1
 ASSI {  400}
   (( segid "    " and resid 16   and name HB3 ))
   (( segid "    " and resid 13   and name HN  ))
      3.000     1.100     1.100 peak   400 spectrum    1 weight  0.11000E+01 volume  0.15156E-02 ppm1      2.700 ppm2      8.419 CV     1
 ASSI {  401}
   (( segid "    " and resid 27   and name HB2 ))
   (( segid "    " and resid 24   and name HN  ))
      4.000     2.000     2.000 peak   401 spectrum    1 weight  0.10000E+01 volume  0.25443E-03 ppm1      2.817 ppm2      8.457 CV     1
 ASSI {  402}
   (( segid "    " and resid 27   and name HB3 ))
   (( segid "    " and resid 24   and name HN  ))
      4.400     2.400     1.600 peak   402 spectrum    1 weight  0.10000E+01 volume  0.16280E-03 ppm1      2.697 ppm2      8.457 CV     1
 ASSI {  403}
   (( segid "    " and resid 22   and name HE2 ))
   (  segid "    " and resid 18   and name HD1%)
      3.000     1.100     1.100 peak   403 spectrum    1 weight  0.11000E+01 volume  0.15873E-02 ppm1      2.969 ppm2      0.952 CV     1
 OR {  403}
   (( segid "    " and resid 22   and name HE3 ))
   (  segid "    " and resid 18   and name HD1%)
 ASSI {  404}
   (( segid "    " and resid 22   and name HE2 ))
   (  segid "    " and resid 18   and name HD2%)
      2.900     1.000     1.000 peak   404 spectrum    1 weight  0.11000E+01 volume  0.19111E-02 ppm1      2.969 ppm2      0.910 CV     1
 OR {  404}
   (( segid "    " and resid 22   and name HE3 ))
   (  segid "    " and resid 18   and name HD2%)
 ASSI {  405}
   (( segid "    " and resid 24   and name HA  ))
   (( segid "    " and resid 28   and name HN  ))
      3.200     1.200     1.200 peak   405 spectrum    1 weight  0.10000E+01 volume  0.11199E-02 ppm1      4.101 ppm2      8.115 CV     1
 ASSI {  406}
   (( segid "    " and resid 24   and name HA  ))
   (( segid "    " and resid 27   and name HN  ))
      2.800     1.000     1.000 peak   406 spectrum    1 weight  0.10000E+01 volume  0.21632E-02 ppm1      4.100 ppm2      8.724 CV     1
 ASSI {  409}
   (  segid "    " and resid 7    and name HB% )
   (( segid "    " and resid 4    and name HD21))
      3.800     1.800     1.800 peak   409 spectrum    1 weight  0.11000E+01 volume  0.36758E-03 ppm1      1.423 ppm2      7.724 CV     1
 ASSI {  410}
   (( segid "    " and resid 6    and name HD3 ))
   (( segid "    " and resid 4    and name HB3 ))
      4.200     2.300     1.800 peak   410 spectrum    1 weight  0.10000E+01 volume  0.18986E-03 ppm1      3.687 ppm2      2.782 CV     1
 ASSI {  411}
   (( segid "    " and resid 6    and name HD3 ))
   (( segid "    " and resid 4    and name HB2 ))
      3.400     1.400     1.400 peak   411 spectrum    1 weight  0.10000E+01 volume  0.75137E-03 ppm1      3.686 ppm2      2.829 CV     1
 ASSI {  412}
   (( segid "    " and resid 6    and name HD2 ))
   (( segid "    " and resid 4    and name HB3 ))
      4.300     2.300     1.700 peak   412 spectrum    1 weight  0.10000E+01 volume  0.18006E-03 ppm1      3.803 ppm2      2.781 CV     1
 ASSI {  413}
   (( segid "    " and resid 6    and name HD2 ))
   (( segid "    " and resid 4    and name HB2 ))
      4.700     2.700     1.300 peak   413 spectrum    1 weight  0.10000E+01 volume  0.10511E-03 ppm1      3.803 ppm2      2.829 CV     1
 ASSI {  414}
   (( segid "    " and resid 16   and name HB2 ))
   (  segid "    " and resid 13   and name HG2%)
      3.700     1.700     1.700 peak   414 spectrum    1 weight  0.10000E+01 volume  0.43139E-03 ppm1      2.830 ppm2      1.276 CV     1
 ASSI {  415}
   (( segid "    " and resid 16   and name HB3 ))
   (  segid "    " and resid 13   and name HG2%)
      3.300     1.400     1.400 peak   415 spectrum    1 weight  0.10000E+01 volume  0.80595E-03 ppm1      2.699 ppm2      1.275 CV     1
 ASSI {  416}
   (( segid "    " and resid 13   and name HB  ))
   (( segid "    " and resid 16   and name HB2 ))
      4.600     2.700     1.400 peak   416 spectrum    1 weight  0.10000E+01 volume  0.11228E-03 ppm1      4.337 ppm2      2.831 CV     1
 ASSI {  418}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 16   and name HB2 ))
      3.200     1.300     1.300 peak   418 spectrum    1 weight  0.10000E+01 volume  0.10123E-02 ppm1      4.226 ppm2      2.832 CV     1
 ASSI {  419}
   (( segid "    " and resid 24   and name HB  ))
   (( segid "    " and resid 27   and name HB2 ))
      3.800     1.800     1.800 peak   419 spectrum    1 weight  0.10000E+01 volume  0.38630E-03 ppm1      4.255 ppm2      2.808 CV     1
 ASSI {  420}
   (( segid "    " and resid 24   and name HB  ))
   (( segid "    " and resid 27   and name HB3 ))
      3.700     1.700     1.700 peak   420 spectrum    1 weight  0.10000E+01 volume  0.46435E-03 ppm1      4.255 ppm2      2.686 CV     1
 ASSI {  421}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 16   and name HB3 ))
      3.500     1.500     1.500 peak   421 spectrum    1 weight  0.10000E+01 volume  0.59700E-03 ppm1      4.224 ppm2      2.690 CV     1
 ASSI {  422}
   (( segid "    " and resid 24   and name HA  ))
   (( segid "    " and resid 27   and name HB2 ))
      2.800     1.000     1.000 peak   422 spectrum    1 weight  0.10000E+01 volume  0.22989E-02 ppm1      4.099 ppm2      2.807 CV     1
 ASSI {  423}
   (( segid "    " and resid 24   and name HA  ))
   (( segid "    " and resid 27   and name HB3 ))
      2.600     0.800     0.800 peak   423 spectrum    1 weight  0.10000E+01 volume  0.35382E-02 ppm1      4.100 ppm2      2.686 CV     1
 ASSI {  424}
   (( segid "    " and resid 5    and name HA  ))
   (( segid "    " and resid 8    and name HB2 ))
      3.000     1.100     1.100 peak   424 spectrum    1 weight  0.11000E+01 volume  0.16250E-02 ppm1      4.504 ppm2      1.827 CV     1
 ASSI {  426}
   (( segid "    " and resid 24   and name HA  ))
   (( segid "    " and resid 26   and name HN  ))
      3.900     1.900     1.900 peak   426 spectrum    1 weight  0.10000E+01 volume  0.30310E-03 ppm1      4.106 ppm2      8.333 CV     1
 ASSI {  427}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 26   and name HN  ))
      4.000     2.000     2.000 peak   427 spectrum    1 weight  0.10000E+01 volume  0.27450E-03 ppm1      4.149 ppm2      8.333 CV     1
 ASSI {  429}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 16   and name HN  ))
      3.700     1.700     1.700 peak   429 spectrum    1 weight  0.10000E+01 volume  0.45524E-03 ppm1      1.285 ppm2      8.564 CV     1
 ASSI {  431}
   (( segid "    " and resid 2    and name HA  ))
   (( segid "    " and resid 4    and name HN  ))
      3.000     1.100     1.100 peak   431 spectrum    1 weight  0.10000E+01 volume  0.16726E-02 ppm1      4.501 ppm2      8.546 CV     1
 ASSI {  432}
   (( segid "    " and resid 5    and name HA  ))
   (( segid "    " and resid 8    and name HN  ))
      3.500     1.500     1.500 peak   432 spectrum    1 weight  0.10000E+01 volume  0.60912E-03 ppm1      4.510 ppm2      8.455 CV     1
 ASSI {  433}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 10   and name HN  ))
      3.900     1.900     1.900 peak   433 spectrum    1 weight  0.11000E+01 volume  0.30136E-03 ppm1      4.407 ppm2      8.375 CV     1
 ASSI {  434}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 9    and name HN  ))
      3.400     1.400     1.400 peak   434 spectrum    1 weight  0.10000E+01 volume  0.76843E-03 ppm1      8.369 ppm2      8.441 CV     1
 ASSI {  435}
   (( segid "    " and resid 8    and name HB2 ))
   (( segid "    " and resid 9    and name HN  ))
      2.800     1.000     1.000 peak   435 spectrum    1 weight  0.10000E+01 volume  0.21516E-02 ppm1      1.840 ppm2      8.440 CV     1
 OR {  435}
   (( segid "    " and resid 8    and name HB3 ))
   (( segid "    " and resid 9    and name HN  ))
 ASSI {  436}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 12   and name HN  ))
      2.900     1.000     1.000 peak   436 spectrum    1 weight  0.10000E+01 volume  0.19354E-02 ppm1      4.254 ppm2      8.320 CV     1
 ASSI {  438}
   (( segid "    " and resid 10   and name HA  ))
   (( segid "    " and resid 11   and name HN  ))
      2.900     1.100     1.100 peak   438 spectrum    1 weight  0.10000E+01 volume  0.18249E-02 ppm1      4.230 ppm2      8.349 CV     1
 ASSI {  439}
   (  segid "    " and resid 11   and name HB% )
   (( segid "    " and resid 12   and name HN  ))
      3.200     1.200     1.200 peak   439 spectrum    1 weight  0.10000E+01 volume  0.11199E-02 ppm1      1.443 ppm2      8.320 CV     1
 ASSI {  441}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 15   and name HN  ))
      6.000     4.500     0.000 peak   441 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.341 ppm2      8.383 CV     1
 ASSI {  442}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 12   and name HG3 ))
      2.300     0.600     0.600 peak   442 spectrum    1 weight  0.10000E+01 volume  0.80178E-02 ppm1      4.340 ppm2      1.476 CV     1
 ASSI {  443}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 16   and name HN  ))
      3.300     1.400     1.400 peak   443 spectrum    1 weight  0.11000E+01 volume  0.87082E-03 ppm1      4.339 ppm2      8.564 CV     1
 ASSI {  445}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 30   and name HN  ))
      3.000     1.200     1.200 peak   445 spectrum    1 weight  0.10000E+01 volume  0.14147E-02 ppm1      4.463 ppm2      8.078 CV     1
 ASSI {  446}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 18   and name HN  ))
      3.700     1.700     1.700 peak   446 spectrum    1 weight  0.10000E+01 volume  0.43478E-03 ppm1      4.479 ppm2      8.071 CV     1
 ASSI {  447}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 31   and name HN  ))
      3.400     1.500     1.500 peak   447 spectrum    1 weight  0.11000E+01 volume  0.66226E-03 ppm1      4.466 ppm2      8.000 CV     1
 ASSI {  452}
   (( segid "    " and resid 6    and name HA  ))
   (  segid "    " and resid 9    and name HB% )
      2.600     0.800     0.800 peak   452 spectrum    1 weight  0.11000E+01 volume  0.36302E-02 ppm1      4.402 ppm2      1.418 CV     1
 ASSI {  453}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 20   and name HN  ))
      3.900     1.900     1.900 peak   453 spectrum    1 weight  0.10000E+01 volume  0.31426E-03 ppm1      4.479 ppm2      8.163 CV     1
 ASSI {  455}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 22   and name HN  ))
      3.800     1.800     1.800 peak   455 spectrum    1 weight  0.10000E+01 volume  0.35740E-03 ppm1      4.255 ppm2      8.197 CV     1
 ASSI {  456}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 21   and name HN  ))
      3.600     1.700     1.700 peak   456 spectrum    1 weight  0.10000E+01 volume  0.47754E-03 ppm1      4.145 ppm2      8.019 CV     1
 ASSI {  457}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 25   and name HN  ))
      6.000     4.500     0.000 peak   457 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.231 ppm2      8.099 CV     1
 ASSI {  461}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 27   and name HN  ))
      4.100     2.100     1.900 peak   461 spectrum    1 weight  0.10000E+01 volume  0.22321E-03 ppm1      4.270 ppm2      8.724 CV     1
 ASSI {  462}
   (( segid "    " and resid 5    and name HA  ))
   (( segid "    " and resid 8    and name HE  ))
      4.200     2.200     1.800 peak   462 spectrum    1 weight  0.10000E+01 volume  0.20983E-03 ppm1      4.511 ppm2      7.260 CV     1
 ASSI {  464}
   (( segid "    " and resid 32   and name HA  ))
   (  segid "    " and resid 35   and name HB% )
      2.700     0.900     0.900 peak   464 spectrum    1 weight  0.11000E+01 volume  0.29205E-02 ppm1      4.251 ppm2      1.364 CV     1
 ASSI {  465}
   (( segid "    " and resid 4    and name HB2 ))
   (  segid "    " and resid 7    and name HB% )
      3.100     1.200     1.200 peak   465 spectrum    1 weight  0.11000E+01 volume  0.12964E-02 ppm1      2.832 ppm2      1.413 CV     1
 ASSI {  475}
   (( segid "    " and resid 6    and name HB2 ))
   (  segid "    " and resid 9    and name HB% )
      3.100     1.200     1.200 peak   475 spectrum    1 weight  0.11000E+01 volume  0.12237E-02 ppm1      2.316 ppm2      1.412 CV     1
 ASSI {  476}
   (  segid "    " and resid 24   and name HG2%)
   (( segid "    " and resid 27   and name HN  ))
      3.800     1.800     1.800 peak   476 spectrum    1 weight  0.10000E+01 volume  0.37040E-03 ppm1      1.285 ppm2      8.725 CV     1
 ASSI {  477}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 17   and name HN  ))
      3.500     1.500     1.500 peak   477 spectrum    1 weight  0.10000E+01 volume  0.60941E-03 ppm1      1.286 ppm2      8.171 CV     1
 ASSI {  478}
   (  segid "    " and resid 18   and name HD2%)
   (( segid "    " and resid 17   and name HN  ))
      4.200     2.200     1.800 peak   478 spectrum    1 weight  0.10000E+01 volume  0.20799E-03 ppm1      0.917 ppm2      8.169 CV     1
 ASSI {  479}
   (  segid "    " and resid 18   and name HD1%)
   (( segid "    " and resid 22   and name HN  ))
      4.200     2.200     1.800 peak   479 spectrum    1 weight  0.10000E+01 volume  0.21477E-03 ppm1      0.953 ppm2      8.197 CV     1
 ASSI {  480}
   (  segid "    " and resid 18   and name HD2%)
   (( segid "    " and resid 22   and name HN  ))
      4.100     2.100     1.900 peak   480 spectrum    1 weight  0.10000E+01 volume  0.23882E-03 ppm1      0.917 ppm2      8.197 CV     1
 ASSI {  481}
   (  segid "    " and resid 18   and name HD1%)
   (( segid "    " and resid 17   and name HN  ))
      4.300     2.300     1.700 peak   481 spectrum    1 weight  0.10000E+01 volume  0.17356E-03 ppm1      0.953 ppm2      8.168 CV     1
 ASSI {  482}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 15   and name HN  ))
      4.000     2.000     2.000 peak   482 spectrum    1 weight  0.10000E+01 volume  0.26180E-03 ppm1      1.284 ppm2      8.382 CV     1
 ASSI {  483}
   (  segid "    " and resid 24   and name HG2%)
   (( segid "    " and resid 28   and name HN  ))
      4.000     2.000     2.000 peak   483 spectrum    1 weight  0.10000E+01 volume  0.27819E-03 ppm1      1.287 ppm2      8.116 CV     1
 ASSI {  484}
   (  segid "    " and resid 18   and name HD1%)
   (( segid "    " and resid 15   and name HN  ))
      4.200     2.200     1.800 peak   484 spectrum    1 weight  0.10000E+01 volume  0.21070E-03 ppm1      0.953 ppm2      8.385 CV     1
 ASSI {  486}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 35   and name HN  ))
      3.700     1.700     1.700 peak   486 spectrum    1 weight  0.10000E+01 volume  0.42838E-03 ppm1      4.251 ppm2      7.828 CV     1
 ASSI {  487}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 15   and name HN  ))
      3.900     1.900     1.900 peak   487 spectrum    1 weight  0.10000E+01 volume  0.29254E-03 ppm1      4.478 ppm2      8.384 CV     1
 ASSI {  494}
   (( segid "    " and resid 23   and name HB2 ))
   (( segid "    " and resid 20   and name HN  ))
      4.300     2.300     1.700 peak   494 spectrum    1 weight  0.10000E+01 volume  0.17802E-03 ppm1      2.018 ppm2      8.163 CV     1
 ASSI {  495}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 20   and name HN  ))
      3.900     1.900     1.900 peak   495 spectrum    1 weight  0.10000E+01 volume  0.31745E-03 ppm1      1.906 ppm2      8.163 CV     1
 OR {  495}
   (( segid "    " and resid 22   and name HB3 ))
   (( segid "    " and resid 20   and name HN  ))
 ASSI {  497}
   (( segid "    " and resid 18   and name HG  ))
   (( segid "    " and resid 17   and name HN  ))
      3.200     1.300     1.300 peak   497 spectrum    1 weight  0.10000E+01 volume  0.10782E-02 ppm1      1.706 ppm2      8.167 CV     1
 ASSI {  501}
   (( segid "    " and resid 23   and name HB2 ))
   (( segid "    " and resid 25   and name HN  ))
      4.200     2.200     1.800 peak   501 spectrum    1 weight  0.10000E+01 volume  0.20158E-03 ppm1      2.023 ppm2      8.095 CV     1
 ASSI {  504}
   (( segid "    " and resid 23   and name HB2 ))
   (( segid "    " and resid 21   and name HN  ))
      4.000     2.000     2.000 peak   504 spectrum    1 weight  0.10000E+01 volume  0.28682E-03 ppm1      2.025 ppm2      8.025 CV     1
 ASSI {  509}
   (( segid "    " and resid 4    and name HB2 ))
   (( segid "    " and resid 4    and name HB3 ))
      1.800     0.400     0.400 peak   509 spectrum    1 weight  0.10000E+01 volume  0.32638E-01 ppm1      2.845 ppm2      2.775 CV     1
 ASSI {  513}
   (( segid "    " and resid 6    and name HA  ))
   (  segid "    " and resid 5    and name HB% )
      4.200     2.200     1.800 peak   513 spectrum    1 weight  0.10000E+01 volume  0.20081E-03 ppm1      4.399 ppm2      1.386 CV     1
 ASSI {  514}
   (( segid "    " and resid 16   and name HA  ))
   (  segid "    " and resid 19   and name HB% )
      2.300     0.700     0.700 peak   514 spectrum    1 weight  0.10000E+01 volume  0.76271E-02 ppm1      4.474 ppm2      1.513 CV     1
 ASSI {  515}
   (( segid "    " and resid 27   and name HA  ))
   (  segid "    " and resid 30   and name HB% )
      2.300     0.700     0.700 peak   515 spectrum    1 weight  0.10000E+01 volume  0.67922E-02 ppm1      4.468 ppm2      1.483 CV     1
 ASSI {  516}
   (( segid "    " and resid 34   and name HA  ))
   (  segid "    " and resid 34   and name HB% )
      2.500     0.800     0.800 peak   516 spectrum    1 weight  0.11000E+01 volume  0.46096E-02 ppm1      4.330 ppm2      1.421 CV     1
 ASSI {  517}
   (( segid "    " and resid 19   and name HA  ))
   (  segid "    " and resid 19   and name HB% )
      2.100     0.500     0.500 peak   517 spectrum    1 weight  0.10000E+01 volume  0.13391E-01 ppm1      4.140 ppm2      1.514 CV     1
 ASSI {  518}
   (( segid "    " and resid 22   and name HA  ))
   (  segid "    " and resid 25   and name HB% )
      2.400     0.700     0.700 peak   518 spectrum    1 weight  0.10000E+01 volume  0.63239E-02 ppm1      4.153 ppm2      1.482 CV     1
 ASSI {  519}
   (( segid "    " and resid 21   and name HA  ))
   (  segid "    " and resid 21   and name HB% )
      2.300     0.700     0.700 peak   519 spectrum    1 weight  0.10000E+01 volume  0.72353E-02 ppm1      4.230 ppm2      1.534 CV     1
 ASSI {  536}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 25   and name HN  ))
      2.600     0.800     0.800 peak   536 spectrum    1 weight  0.10000E+01 volume  0.39968E-02 ppm1      8.463 ppm2      8.097 CV     1
 ASSI {  537}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 23   and name HN  ))
      2.600     0.800     0.800 peak   537 spectrum    1 weight  0.10000E+01 volume  0.39774E-02 ppm1      8.464 ppm2      8.055 CV     1
 ASSI {  538}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 21   and name HN  ))
      3.800     1.800     1.800 peak   538 spectrum    1 weight  0.10000E+01 volume  0.38028E-03 ppm1      8.466 ppm2      8.022 CV     1
 ASSI {  539}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 22   and name HN  ))
      3.900     1.900     1.900 peak   539 spectrum    1 weight  0.10000E+01 volume  0.31173E-03 ppm1      8.466 ppm2      8.197 CV     1
 ASSI {  540}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 13   and name HN  ))
      3.400     1.400     1.400 peak   540 spectrum    1 weight  0.10000E+01 volume  0.72616E-03 ppm1      8.565 ppm2      8.413 CV     1
 ASSI {  541}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 15   and name HN  ))
      3.000     1.100     1.100 peak   541 spectrum    1 weight  0.10000E+01 volume  0.14660E-02 ppm1      8.571 ppm2      8.378 CV     1
 ASSI {  542}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 17   and name HN  ))
      2.400     0.700     0.700 peak   542 spectrum    1 weight  0.10000E+01 volume  0.56490E-02 ppm1      8.570 ppm2      8.172 CV     1
 ASSI {  543}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 18   and name HN  ))
      3.300     1.300     1.300 peak   543 spectrum    1 weight  0.10000E+01 volume  0.88507E-03 ppm1      8.570 ppm2      8.076 CV     1
 ASSI {  544}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 19   and name HN  ))
      3.400     1.400     1.400 peak   544 spectrum    1 weight  0.10000E+01 volume  0.71500E-03 ppm1      8.570 ppm2      8.030 CV     1
 ASSI {  545}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 30   and name HN  ))
      3.900     1.900     1.900 peak   545 spectrum    1 weight  0.10000E+01 volume  0.32618E-03 ppm1      8.728 ppm2      8.078 CV     1
 ASSI {  546}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 24   and name HN  ))
      4.100     2.100     1.900 peak   546 spectrum    1 weight  0.10000E+01 volume  0.23019E-03 ppm1      8.732 ppm2      8.460 CV     1
 ASSI {  547}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 22   and name HN  ))
      2.500     0.800     0.800 peak   547 spectrum    1 weight  0.10000E+01 volume  0.48802E-02 ppm1      8.027 ppm2      8.195 CV     1
 ASSI {  548}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 22   and name HN  ))
      2.700     0.900     0.900 peak   548 spectrum    1 weight  0.10000E+01 volume  0.28071E-02 ppm1      8.061 ppm2      8.197 CV     1
 ASSI {  549}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 17   and name HN  ))
      2.500     0.800     0.800 peak   549 spectrum    1 weight  0.10000E+01 volume  0.48462E-02 ppm1      8.075 ppm2      8.168 CV     1
 ASSI {  550}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 20   and name HN  ))
      2.700     0.900     0.900 peak   550 spectrum    1 weight  0.10000E+01 volume  0.31668E-02 ppm1      8.010 ppm2      8.164 CV     1
 ASSI {  551}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 20   and name HN  ))
      2.300     0.700     0.700 peak   551 spectrum    1 weight  0.10000E+01 volume  0.72295E-02 ppm1      8.043 ppm2      8.165 CV     1
 ASSI {  555}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 15   and name HN  ))
      5.200     3.400     0.800 peak   555 spectrum    1 weight  0.10000E+01 volume  0.54202E-04 ppm1      8.070 ppm2      8.385 CV     1
 ASSI {  561}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 25   and name HN  ))
      3.700     1.800     1.800 peak   561 spectrum    1 weight  0.10000E+01 volume  0.39909E-03 ppm1      4.146 ppm2      8.099 CV     1
 ASSI {  562}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name HG3 ))
      6.000     4.500     0.000 peak   562 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      4.148 ppm2      1.438 CV     1
 ASSI {  563}
   (( segid "    " and resid 12   and name HA  ))
   (  segid "    " and resid 15   and name HB% )
      3.900     1.900     1.900 peak   563 spectrum    1 weight  0.10000E+01 volume  0.32793E-03 ppm1      4.340 ppm2      1.501 CV     1
 ASSI {  565}
   (( segid "    " and resid 22   and name HB2 ))
   (  segid "    " and resid 18   and name HD2%)
      6.000     4.500     0.000 peak   565 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.907 ppm2      0.909 CV     1
 OR {  565}
   (( segid "    " and resid 22   and name HB3 ))
   (  segid "    " and resid 18   and name HD2%)
 ASSI {  566}
   (( segid "    " and resid 22   and name HB2 ))
   (  segid "    " and resid 18   and name HD1%)
      6.000     4.500     0.000 peak   566 spectrum    1 weight  0.10000E+01 volume  0.00000E+00 ppm1      1.909 ppm2      0.951 CV     1
 OR {  566}
   (( segid "    " and resid 22   and name HB3 ))
   (  segid "    " and resid 18   and name HD1%)

 ASSI {  437}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 15   and name HN  ))
      3.900     1.900     1.900 peak   437 spectrum    1 weight  0.10000E+01 volume  0.33375E-03 ppm1      4.340 ppm2      8.375 CV     1
 OR {  437}
   (( segid "    " and resid 13   and name HB  ))
   (( segid "    " and resid 15   and name HN  ))
 ASSI {  463}
   (( segid "    " and resid 16   and name HB2 ))
   (  segid "    " and resid 17   and name HB% )
      2.900     1.100     1.100 peak   463 spectrum    1 weight  0.10000E+01 volume  0.18384E-02 ppm1      2.828 ppm2      1.507 CV     1
 OR {  463}
   (( segid "    " and resid 27   and name HB2 ))
   (  segid "    " and resid 26   and name HB% )
 OR {  463}
   (( segid "    " and resid 27   and name HB2 ))
   (  segid "    " and resid 30   and name HB% )
 OR {  463}
   (( segid "    " and resid 27   and name HB2 ))
   (  segid "    " and resid 28   and name HB% )
 ASSI {  490}
   (( segid "    " and resid 12   and name HB2 ))
   (( segid "    " and resid 10   and name HN  ))
      4.100     2.200     1.900 peak   490 spectrum    1 weight  0.10000E+01 volume  0.21730E-03 ppm1      1.958 ppm2      8.379 CV     1
 OR {  490}
   (( segid "    " and resid 12   and name HB2 ))
   (( segid "    " and resid 15   and name HN  ))
 ASSI {  491}
   (( segid "    " and resid 8    and name HB3 ))
   (( segid "    " and resid 10   and name HN  ))
      3.500     1.500     1.500 peak   491 spectrum    1 weight  0.10000E+01 volume  0.58604E-03 ppm1      1.848 ppm2      8.379 CV     1
 OR {  491}
   (( segid "    " and resid 8    and name HB2 ))
   (( segid "    " and resid 10   and name HN  ))
 OR {  491}
   (( segid "    " and resid 12   and name HB3 ))
   (( segid "    " and resid 15   and name HN  ))
 ASSI {  496}
   (( segid "    " and resid 18   and name HB2 ))
   (( segid "    " and resid 17   and name HN  ))
      3.600     1.700     1.700 peak   496 spectrum    1 weight  0.10000E+01 volume  0.47104E-03 ppm1      1.781 ppm2      8.167 CV     1
 OR {  496}
   (( segid "    " and resid 18   and name HB2 ))
   (( segid "    " and resid 20   and name HN  ))
 ASSI {  499}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 21   and name HN  ))
      3.000     1.100     1.100 peak   499 spectrum    1 weight  0.10000E+01 volume  0.14544E-02 ppm1      1.900 ppm2      8.024 CV     1
 OR {  499}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 19   and name HN  ))
 OR {  499}
   (( segid "    " and resid 23   and name HB3 ))
   (( segid "    " and resid 21   and name HN  ))
 ASSI {  500}
   (( segid "    " and resid 23   and name HB3 ))
   (( segid "    " and resid 25   and name HN  ))
      4.300     2.400     1.700 peak   500 spectrum    1 weight  0.10000E+01 volume  0.16387E-03 ppm1      1.895 ppm2      8.092 CV     1
 OR {  500}
   (( segid "    " and resid 22   and name HB3 ))
   (( segid "    " and resid 25   and name HN  ))
 OR {  500}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 25   and name HN  ))
 ASSI {  506}
   (( segid "    " and resid 5    and name HA  ))
   (( segid "    " and resid 8    and name HD3 ))
      4.000     2.000     2.000 peak   506 spectrum    1 weight  0.10000E+01 volume  0.28973E-03 ppm1      4.510 ppm2      3.207 CV     1
 OR {  506}
   (( segid "    " and resid 5    and name HA  ))
   (( segid "    " and resid 8    and name HD2 ))
 OR {  506}
   (( segid "    " and resid 3    and name HA  ))
   (( segid "    " and resid 8    and name HD2 ))
 ASSI {  510}
   (( segid "    " and resid 16   and name HB3 ))
   (  segid "    " and resid 15   and name HB% )
      3.000     1.100     1.100 peak   510 spectrum    1 weight  0.10000E+01 volume  0.14942E-02 ppm1      2.694 ppm2      1.484 CV     1
 OR {  510}
   (( segid "    " and resid 27   and name HB3 ))
   (  segid "    " and resid 30   and name HB% )
 OR {  510}
   (( segid "    " and resid 27   and name HB3 ))
   (( segid "    " and resid 23   and name HG2 ))
 ASSI {  511}
   (  segid "    " and resid 17   and name HB% )
   (  segid "    " and resid 18   and name HD2%)
      2.800     1.000     1.000 peak   511 spectrum    1 weight  0.10000E+01 volume  0.25229E-02 ppm1      1.510 ppm2      0.910 CV     1
 OR {  511}
   (  segid "    " and resid 15   and name HB% )
   (  segid "    " and resid 18   and name HD2%)
 ASSI {  512}
   (  segid "    " and resid 15   and name HB% )
   (  segid "    " and resid 18   and name HD1%)
      2.600     0.900     0.900 peak   512 spectrum    1 weight  0.10000E+01 volume  0.32948E-02 ppm1      1.511 ppm2      0.949 CV     1
 OR {  512}
   (  segid "    " and resid 17   and name HB% )
   (  segid "    " and resid 18   and name HD1%)
 OR {  512}
   (  segid "    " and resid 19   and name HB% )
   (  segid "    " and resid 18   and name HD1%)
 ASSI {  520}
   (( segid "    " and resid 17   and name HA  ))
   (  segid "    " and resid 17   and name HB% )
      1.900     0.400     0.400 peak   520 spectrum    1 weight  0.10000E+01 volume  0.25385E-01 ppm1      4.243 ppm2      1.513 CV     1
 OR {  520}
   (( segid "    " and resid 26   and name HA  ))
   (  segid "    " and resid 26   and name HB% )
 OR {  520}
   (( segid "    " and resid 28   and name HA  ))
   (  segid "    " and resid 28   and name HB% )
 ASSI {  521}
   (( segid "    " and resid 14   and name HA  ))
   (  segid "    " and resid 14   and name HB% )
      1.800     0.400     0.400 peak   521 spectrum    1 weight  0.10000E+01 volume  0.32647E-01 ppm1      4.253 ppm2      1.479 CV     1
 OR {  521}
   (( segid "    " and resid 30   and name HA  ))
   (  segid "    " and resid 30   and name HB% )
 OR {  521}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 23   and name HG3 ))
 ASSI {  522}
   (( segid "    " and resid 9    and name HA  ))
   (  segid "    " and resid 9    and name HB% )
      1.900     0.500     0.500 peak   522 spectrum    1 weight  0.10000E+01 volume  0.21545E-01 ppm1      4.254 ppm2      1.414 CV     1
 OR {  522}
   (( segid "    " and resid 7    and name HA  ))
   (  segid "    " and resid 7    and name HB% )
 ASSI {  526}
   (( segid "    " and resid 10   and name HA  ))
   (  segid "    " and resid 10   and name HB% )
      1.800     0.400     0.400 peak   526 spectrum    1 weight  0.10000E+01 volume  0.34577E-01 ppm1      4.226 ppm2      1.441 CV     1
 OR {  526}
   (( segid "    " and resid 31   and name HA  ))
   (  segid "    " and resid 31   and name HB% )
 ASSI {  534}
   (( segid "    " and resid 6    and name HB3 ))
   (  segid "    " and resid 7    and name HB% )
      3.100     1.200     1.200 peak   534 spectrum    1 weight  0.10000E+01 volume  0.12984E-02 ppm1      1.885 ppm2      1.430 CV     1
 OR {  534}
   (( segid "    " and resid 6    and name HB3 ))
   (  segid "    " and resid 9    and name HB% )
 ASSI {  535}
   (( segid "    " and resid 27   and name HB2 ))
   (( segid "    " and resid 23   and name HG2 ))
      3.100     1.200     1.200 peak   535 spectrum    1 weight  0.10000E+01 volume  0.13614E-02 ppm1      2.827 ppm2      1.482 CV     1
 OR {  535}
   (( segid "    " and resid 27   and name HB2 ))
   (  segid "    " and resid 30   and name HB% )
 OR {  535}
   (( segid "    " and resid 27   and name HB2 ))
   (( segid "    " and resid 23   and name HG3 ))
 OR {  535}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 12   and name HG3 ))
 ASSI {  568}
   (( segid "    " and resid 27   and name HB3 ))
   (  segid "    " and resid 28   and name HB% )
      3.200     1.300     1.300 peak   568 spectrum    1 weight  0.10000E+01 volume  0.95566E-03 ppm1      2.694 ppm2      1.507 CV     1
 OR {  568}
   (( segid "    " and resid 16   and name HB3 ))
   (  segid "    " and resid 15   and name HB% )
 OR {  568}
   (( segid "    " and resid 27   and name HB3 ))
   (  segid "    " and resid 30   and name HB% )
 OR {  568}
   (( segid "    " and resid 16   and name HB3 ))
   (  segid "    " and resid 17   and name HB% )

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    GLY   1          1H        GLY   1  21.503 -12.958   4.170
    2   2H    GLY   1          2H        GLY   1  21.068 -11.624   5.122
    3   3H    GLY   1          3H        GLY   1  22.704 -11.980   4.862
    4   1HA   GLY   1          2HA       GLY   1  21.584 -10.096   3.517
    5   2HA   GLY   1          1HA       GLY   1  22.710 -11.193   2.729
    6    H    SER   2           H        SER   2  19.306 -10.479   3.264
    7    HA   SER   2           HA       SER   2  18.694 -11.962   0.798
    8   1HB   SER   2          1HB       SER   2  16.388 -12.017   2.432
    9   2HB   SER   2          2HB       SER   2  17.403 -13.377   1.953
   10    HG   SER   2           HG       SER   2  17.859 -13.515   3.992
   11    H    MET   3           H        MET   3  18.760  -9.986  -0.329
   12    HA   MET   3           HA       MET   3  16.387  -8.303   0.141
   13   1HB   MET   3          1HB       MET   3  19.160  -7.538  -0.004
   14   2HB   MET   3          2HB       MET   3  18.273  -6.802  -1.331
   15   1HG   MET   3          1HG       MET   3  17.086  -6.639   1.381
   16   2HG   MET   3          2HG       MET   3  18.496  -5.641   1.030
   17   1HE   MET   3          1HE       MET   3  18.306  -3.503   0.541
   18   2HE   MET   3          2HE       MET   3  18.349  -3.679  -1.216
   19   3HE   MET   3          3HE       MET   3  17.123  -2.660  -0.461
   20    H    ASN   4           H        ASN   4  17.122 -10.699  -1.553
   21    HA   ASN   4           HA       ASN   4  17.080  -9.710  -4.267
   22   1HB   ASN   4          1HB       ASN   4  16.705 -12.597  -3.570
   23   2HB   ASN   4          2HB       ASN   4  17.561 -11.884  -4.929
   24   1HD2  ASN   4          1HD2      ASN   4  19.687 -11.800  -4.829
   25   2HD2  ASN   4          2HD2      ASN   4  20.640 -12.042  -3.401
   26    H    ALA   5           H        ALA   5  15.559 -11.173  -5.741
   27    HA   ALA   5           HA       ALA   5  12.961 -10.209  -5.360
   28   1HB   ALA   5          1HB       ALA   5  14.377 -11.645  -7.375
   29   2HB   ALA   5          2HB       ALA   5  12.794 -12.386  -7.131
   30   3HB   ALA   5          3HB       ALA   5  12.914 -10.670  -7.517
   31    HA   PRO   6           HA       PRO   6  11.601 -14.720  -4.180
   32   1HB   PRO   6          1HB       PRO   6  13.526 -16.286  -3.026
   33   2HB   PRO   6          2HB       PRO   6  13.115 -16.340  -4.743
   34   1HG   PRO   6          1HG       PRO   6  15.368 -14.927  -3.378
   35   2HG   PRO   6          2HG       PRO   6  15.378 -15.858  -4.890
   36   1HD   PRO   6          1HD       PRO   6  15.317 -13.171  -4.871
   37   2HD   PRO   6          2HD       PRO   6  14.473 -14.108  -6.107
   38    H    ALA   7           H        ALA   7  13.999 -12.932  -2.425
   39    HA   ALA   7           HA       ALA   7  13.110 -13.691   0.185
   40   1HB   ALA   7          1HB       ALA   7  14.446 -11.131   0.110
   41   2HB   ALA   7          2HB       ALA   7  14.952 -12.642   0.863
   42   3HB   ALA   7          3HB       ALA   7  15.311 -12.342  -0.836
   43    H    ARG   8           H        ARG   8  12.240 -11.334  -2.137
   44    HA   ARG   8           HA       ARG   8  10.759  -9.661  -0.313
   45   1HB   ARG   8          1HB       ARG   8  11.571  -9.579  -3.132
   46   2HB   ARG   8          2HB       ARG   8   9.962  -8.932  -2.841
   47   1HG   ARG   8          1HG       ARG   8  10.801  -7.302  -1.328
   48   2HG   ARG   8          2HG       ARG   8  12.398  -8.059  -1.310
   49   1HD   ARG   8          1HD       ARG   8  11.646  -7.456  -4.005
   50   2HD   ARG   8          2HD       ARG   8  11.462  -6.016  -3.006
   51    HE   ARG   8           HE       ARG   8  13.965  -7.446  -2.698
   52   1HH1  ARG   8          2HH1      ARG   8  12.252  -4.867  -4.330
   53   2HH1  ARG   8          1HH1      ARG   8  13.692  -3.987  -4.736
   54   1HH2  ARG   8          2HH2      ARG   8  15.862  -6.300  -3.219
   55   2HH2  ARG   8          1HH2      ARG   8  15.756  -4.796  -4.090
   56    H    ALA   9           H        ALA   9  10.202 -12.475  -2.157
   57    HA   ALA   9           HA       ALA   9   7.434 -12.164  -2.679
   58   1HB   ALA   9          1HB       ALA   9   7.669 -14.803  -2.734
   59   2HB   ALA   9          2HB       ALA   9   8.298 -13.776  -4.023
   60   3HB   ALA   9          3HB       ALA   9   9.383 -14.391  -2.774
   61    H    ALA  10           H        ALA  10   9.169 -12.913   0.172
   62    HA   ALA  10           HA       ALA  10   7.117 -14.421   1.481
   63   1HB   ALA  10          1HB       ALA  10   9.143 -14.885   2.431
   64   2HB   ALA  10          2HB       ALA  10   9.718 -13.225   2.283
   65   3HB   ALA  10          3HB       ALA  10   8.566 -13.649   3.549
   66    H    ALA  11           H        ALA  11   7.682 -11.092   0.910
   67    HA   ALA  11           HA       ALA  11   6.019 -10.222   3.148
   68   1HB   ALA  11          1HB       ALA  11   7.479  -8.599   1.064
   69   2HB   ALA  11          2HB       ALA  11   6.650  -7.961   2.485
   70   3HB   ALA  11          3HB       ALA  11   8.075  -8.983   2.681
   71    H    LYS  12           H        LYS  12   5.252 -11.614   0.462
   72    HA   LYS  12           HA       LYS  12   3.740  -9.940  -1.144
   73   1HB   LYS  12          1HB       LYS  12   4.319 -12.313  -1.636
   74   2HB   LYS  12          2HB       LYS  12   3.106 -12.812  -0.467
   75   1HG   LYS  12          1HG       LYS  12   1.890 -11.014  -2.314
   76   2HG   LYS  12          2HG       LYS  12   2.765 -12.255  -3.213
   77   1HD   LYS  12          1HD       LYS  12   1.635 -13.929  -1.652
   78   2HD   LYS  12          2HD       LYS  12   0.571 -12.600  -1.194
   79   1HE   LYS  12          2HE       LYS  12   0.652 -12.572  -3.987
   80   2HE   LYS  12          1HE       LYS  12   0.504 -14.272  -3.536
   81   1HZ   LYS  12          1HZ       LYS  12  -1.287 -12.039  -2.728
   82   2HZ   LYS  12          2HZ       LYS  12  -1.388 -13.616  -2.100
   83   3HZ   LYS  12          3HZ       LYS  12  -1.668 -13.341  -3.751
   84    H    THR  13           H        THR  13   2.356 -12.127   1.314
   85    HA   THR  13           HA       THR  13  -0.210 -11.223   1.347
   86    HB   THR  13           HB       THR  13   0.780 -11.834   4.028
   87    HG1  THR  13           1HG      THR  13   1.507 -13.930   3.454
   88   1HG2  THR  13          1HG2      THR  13  -1.087 -13.271   2.139
   89   2HG2  THR  13          2HG2      THR  13  -1.564 -12.056   3.325
   90   3HG2  THR  13          3HG2      THR  13  -0.896 -13.599   3.861
   91    H    ALA  14           H        ALA  14   2.536  -9.736   2.968
   92    HA   ALA  14           HA       ALA  14   1.071  -8.018   4.669
   93   1HB   ALA  14          1HB       ALA  14   3.089  -7.450   5.411
   94   2HB   ALA  14          2HB       ALA  14   3.760  -8.573   4.230
   95   3HB   ALA  14          3HB       ALA  14   3.582  -6.869   3.819
   96    H    ALA  15           H        ALA  15   2.723  -7.341   1.584
   97    HA   ALA  15           HA       ALA  15   1.535  -4.792   1.221
   98   1HB   ALA  15          1HB       ALA  15   3.441  -4.978  -0.026
   99   2HB   ALA  15          2HB       ALA  15   3.124  -6.654  -0.466
  100   3HB   ALA  15          3HB       ALA  15   2.246  -5.352  -1.264
  101    H    ASP  16           H        ASP  16   0.444  -8.000   0.617
  102    HA   ASP  16           HA       ASP  16  -1.482  -7.417  -1.403
  103   1HB   ASP  16          1HB       ASP  16  -0.444  -9.716  -0.527
  104   2HB   ASP  16          2HB       ASP  16  -1.891  -9.696   0.472
  105    H    ALA  17           H        ALA  17  -1.621  -7.814   2.108
  106    HA   ALA  17           HA       ALA  17  -4.388  -7.410   2.420
  107   1HB   ALA  17          1HB       ALA  17  -2.106  -7.729   4.107
  108   2HB   ALA  17          2HB       ALA  17  -3.074  -6.378   4.694
  109   3HB   ALA  17          3HB       ALA  17  -3.810  -7.969   4.496
  110    H    LEU  18           H        LEU  18  -1.654  -5.188   2.348
  111    HA   LEU  18           HA       LEU  18  -3.100  -2.850   3.015
  112   1HB   LEU  18          1HB       LEU  18  -0.513  -3.249   1.523
  113   2HB   LEU  18          2HB       LEU  18  -1.147  -1.671   1.955
  114    HG   LEU  18           HG       LEU  18  -0.283  -3.846   3.863
  115   1HD1  LEU  18          1HD1      LEU  18   1.652  -2.830   3.098
  116   2HD1  LEU  18          2HD1      LEU  18   0.878  -1.253   2.938
  117   3HD1  LEU  18          3HD1      LEU  18   1.265  -1.885   4.538
  118   1HD2  LEU  18          1HD2      LEU  18  -0.711  -2.108   5.609
  119   2HD2  LEU  18          2HD2      LEU  18  -1.549  -1.158   4.383
  120   3HD2  LEU  18          3HD2      LEU  18  -2.167  -2.743   4.845
  121    H    ALA  19           H        ALA  19  -2.215  -4.343  -0.061
  122    HA   ALA  19           HA       ALA  19  -3.177  -2.427  -1.819
  123   1HB   ALA  19          1HB       ALA  19  -3.762  -5.130  -2.717
  124   2HB   ALA  19          2HB       ALA  19  -2.650  -3.932  -3.379
  125   3HB   ALA  19          3HB       ALA  19  -2.137  -4.973  -2.050
  126    H    ALA  20           H        ALA  20  -4.929  -5.123  -0.306
  127    HA   ALA  20           HA       ALA  20  -7.428  -4.545  -1.507
  128   1HB   ALA  20          1HB       ALA  20  -7.729  -5.806   1.060
  129   2HB   ALA  20          2HB       ALA  20  -8.000  -6.470  -0.551
  130   3HB   ALA  20          3HB       ALA  20  -6.391  -6.532   0.169
  131    H    ALA  21           H        ALA  21  -6.019  -3.708   1.634
  132    HA   ALA  21           HA       ALA  21  -8.254  -2.409   2.721
  133   1HB   ALA  21          1HB       ALA  21  -6.746  -1.479   4.343
  134   2HB   ALA  21          2HB       ALA  21  -6.253  -3.136   3.999
  135   3HB   ALA  21          3HB       ALA  21  -5.362  -1.787   3.296
  136    H    LYS  22           H        LYS  22  -5.551  -1.159   0.794
  137    HA   LYS  22           HA       LYS  22  -6.299   1.573   1.007
  138   1HB   LYS  22          1HB       LYS  22  -4.338  -0.028  -0.497
  139   2HB   LYS  22          2HB       LYS  22  -4.864   1.436  -1.313
  140   1HG   LYS  22          1HG       LYS  22  -2.779   1.551   0.160
  141   2HG   LYS  22          2HG       LYS  22  -3.991   2.822   0.339
  142   1HD   LYS  22          1HD       LYS  22  -4.928   1.544   2.272
  143   2HD   LYS  22          2HD       LYS  22  -3.564   0.434   2.135
  144   1HE   LYS  22          2HE       LYS  22  -3.097   2.065   3.840
  145   2HE   LYS  22          1HE       LYS  22  -2.028   2.336   2.465
  146   1HZ   LYS  22          1HZ       LYS  22  -3.586   4.093   1.726
  147   2HZ   LYS  22          2HZ       LYS  22  -2.856   4.425   3.222
  148   3HZ   LYS  22          3HZ       LYS  22  -4.463   3.886   3.165
  149    H    LYS  23           H        LYS  23  -6.932  -0.974  -1.329
  150    HA   LYS  23           HA       LYS  23  -8.184   0.564  -3.315
  151   1HB   LYS  23          1HB       LYS  23  -7.513  -1.682  -3.813
  152   2HB   LYS  23          2HB       LYS  23  -8.498  -2.330  -2.516
  153   1HG   LYS  23          1HG       LYS  23  -9.557  -2.782  -4.624
  154   2HG   LYS  23          2HG       LYS  23 -10.524  -1.614  -3.723
  155   1HD   LYS  23          1HD       LYS  23  -9.537   0.206  -5.059
  156   2HD   LYS  23          2HD       LYS  23  -8.608  -0.985  -5.975
  157   1HE   LYS  23          2HE       LYS  23 -10.362  -1.512  -7.261
  158   2HE   LYS  23          1HE       LYS  23 -11.450  -1.610  -5.877
  159   1HZ   LYS  23          1HZ       LYS  23 -10.631   1.068  -6.658
  160   2HZ   LYS  23          2HZ       LYS  23 -12.156   0.495  -6.166
  161   3HZ   LYS  23          3HZ       LYS  23 -11.631   0.256  -7.764
  162    H    THR  24           H        THR  24  -9.576  -1.403  -0.735
  163    HA   THR  24           HA       THR  24 -12.230  -0.766  -1.226
  164    HB   THR  24           HB       THR  24 -10.719  -1.873   1.085
  165    HG1  THR  24           1HG      THR  24 -12.685  -2.863  -0.727
  166   1HG2  THR  24          1HG2      THR  24 -12.647  -0.455   1.876
  167   2HG2  THR  24          2HG2      THR  24 -12.645  -2.139   2.393
  168   3HG2  THR  24          3HG2      THR  24 -13.702  -1.620   1.078
  169    H    ALA  25           H        ALA  25  -9.854   0.759   0.944
  170    HA   ALA  25           HA       ALA  25 -11.592   2.477   2.300
  171   1HB   ALA  25          1HB       ALA  25  -8.733   2.213   1.957
  172   2HB   ALA  25          2HB       ALA  25  -9.218   3.909   2.001
  173   3HB   ALA  25          3HB       ALA  25  -9.649   2.835   3.331
  174    H    ALA  26           H        ALA  26  -9.634   3.115  -0.594
  175    HA   ALA  26           HA       ALA  26 -10.770   5.652  -1.140
  176   1HB   ALA  26          1HB       ALA  26  -9.899   4.738  -3.579
  177   2HB   ALA  26          2HB       ALA  26  -8.923   5.600  -2.390
  178   3HB   ALA  26          3HB       ALA  26  -8.901   3.837  -2.438
  179    H    ASP  27           H        ASP  27 -11.613   2.391  -2.098
  180    HA   ASP  27           HA       ASP  27 -13.505   2.907  -4.076
  181   1HB   ASP  27          1HB       ASP  27 -12.547   0.670  -2.825
  182   2HB   ASP  27          2HB       ASP  27 -14.192   0.735  -2.204
  183    H    ALA  28           H        ALA  28 -13.970   2.530  -0.579
  184    HA   ALA  28           HA       ALA  28 -16.725   3.163  -0.572
  185   1HB   ALA  28          1HB       ALA  28 -14.854   2.305   1.294
  186   2HB   ALA  28          2HB       ALA  28 -15.402   3.868   1.897
  187   3HB   ALA  28          3HB       ALA  28 -16.572   2.589   1.570
  188    H    ALA  29           H        ALA  29 -13.821   5.126  -0.303
  189    HA   ALA  29           HA       ALA  29 -15.121   7.525   0.508
  190   1HB   ALA  29          1HB       ALA  29 -12.633   6.912   0.695
  191   2HB   ALA  29          2HB       ALA  29 -12.522   7.441  -0.985
  192   3HB   ALA  29          3HB       ALA  29 -13.048   8.572   0.262
  193    H    ALA  30           H        ALA  30 -14.254   6.113  -2.593
  194    HA   ALA  30           HA       ALA  30 -14.894   8.314  -4.228
  195   1HB   ALA  30          1HB       ALA  30 -15.454   6.109  -5.771
  196   2HB   ALA  30          2HB       ALA  30 -13.871   6.868  -5.590
  197   3HB   ALA  30          3HB       ALA  30 -14.307   5.484  -4.586
  198    H    ALA  31           H        ALA  31 -16.809   5.689  -2.897
  199    HA   ALA  31           HA       ALA  31 -19.211   6.524  -4.284
  200   1HB   ALA  31          1HB       ALA  31 -18.721   4.380  -2.218
  201   2HB   ALA  31          2HB       ALA  31 -20.279   4.687  -2.988
  202   3HB   ALA  31          3HB       ALA  31 -18.903   4.165  -3.961
  203    H    ALA  32           H        ALA  32 -17.665   8.037  -2.015
  204    HA   ALA  32           HA       ALA  32 -19.995   8.599  -0.326
  205   1HB   ALA  32          1HB       ALA  32 -18.071   8.154   0.992
  206   2HB   ALA  32          2HB       ALA  32 -17.077   9.239   0.021
  207   3HB   ALA  32          3HB       ALA  32 -18.340   9.895   1.061
  208    H    ALA  33           H        ALA  33 -19.831   9.457  -3.073
  209    HA   ALA  33           HA       ALA  33 -19.277  12.318  -2.954
  210   1HB   ALA  33          1HB       ALA  33 -20.191  12.048  -5.424
  211   2HB   ALA  33          2HB       ALA  33 -18.540  11.599  -4.992
  212   3HB   ALA  33          3HB       ALA  33 -19.786  10.360  -5.127
  213    H    ALA  34           H        ALA  34 -21.945  10.083  -3.166
  214    HA   ALA  34           HA       ALA  34 -23.841  12.321  -3.012
  215   1HB   ALA  34          1HB       ALA  34 -25.570  10.545  -3.409
  216   2HB   ALA  34          2HB       ALA  34 -24.429  10.776  -4.733
  217   3HB   ALA  34          3HB       ALA  34 -24.249   9.401  -3.644
  218    H    ALA  35           H        ALA  35 -22.710  12.449  -0.785
  219    HA   ALA  35           HA       ALA  35 -24.433  11.066   1.144
  220   1HB   ALA  35          1HB       ALA  35 -22.423   9.770   1.211
  221   2HB   ALA  35          2HB       ALA  35 -21.426  11.223   1.269
  222   3HB   ALA  35          3HB       ALA  35 -22.439  10.797   2.647
  Start of MODEL    2
    1   1H    GLY   1          1H        GLY   1  19.057 -20.591  -2.871
    2   2H    GLY   1          2H        GLY   1  18.508 -19.491  -1.700
    3   3H    GLY   1          3H        GLY   1  18.730 -18.988  -3.301
    4   1HA   GLY   1          2HA       GLY   1  16.960 -20.443  -4.047
    5   2HA   GLY   1          1HA       GLY   1  16.731 -20.977  -2.386
    6    H    SER   2           H        SER   2  17.417 -17.690  -3.479
    7    HA   SER   2           HA       SER   2  15.220 -16.695  -1.918
    8   1HB   SER   2          1HB       SER   2  16.641 -14.896  -3.797
    9   2HB   SER   2          2HB       SER   2  16.260 -14.670  -2.089
   10    HG   SER   2           HG       SER   2  18.083 -15.613  -1.532
   11    H    MET   3           H        MET   3  15.754 -17.555  -5.203
   12    HA   MET   3           HA       MET   3  13.443 -16.066  -6.166
   13   1HB   MET   3          1HB       MET   3  15.592 -16.405  -7.508
   14   2HB   MET   3          2HB       MET   3  15.076 -18.073  -7.715
   15   1HG   MET   3          1HG       MET   3  14.531 -16.601  -9.628
   16   2HG   MET   3          2HG       MET   3  13.130 -17.399  -8.919
   17   1HE   MET   3          1HE       MET   3  13.408 -15.224 -10.898
   18   2HE   MET   3          2HE       MET   3  11.802 -14.618 -10.495
   19   3HE   MET   3          3HE       MET   3  13.198 -13.549 -10.387
   20    H    ASN   4           H        ASN   4  12.317 -17.407  -4.405
   21    HA   ASN   4           HA       ASN   4  11.199 -19.823  -5.662
   22   1HB   ASN   4          1HB       ASN   4  12.731 -19.962  -3.458
   23   2HB   ASN   4          2HB       ASN   4  11.184 -19.622  -2.695
   24   1HD2  ASN   4          1HD2      ASN   4  12.917 -22.023  -2.751
   25   2HD2  ASN   4          2HD2      ASN   4  11.885 -23.311  -3.269
   26    H    ALA   5           H        ALA   5   8.985 -20.286  -5.058
   27    HA   ALA   5           HA       ALA   5   7.353 -18.018  -5.290
   28   1HB   ALA   5          1HB       ALA   5   6.482 -20.779  -4.483
   29   2HB   ALA   5          2HB       ALA   5   5.478 -19.511  -5.184
   30   3HB   ALA   5          3HB       ALA   5   6.762 -20.252  -6.142
   31    HA   PRO   6           HA       PRO   6   5.952 -18.669  -0.731
   32   1HB   PRO   6          1HB       PRO   6   7.574 -20.133   0.904
   33   2HB   PRO   6          2HB       PRO   6   6.190 -20.804   0.038
   34   1HG   PRO   6          1HG       PRO   6   9.091 -20.954  -0.620
   35   2HG   PRO   6          2HG       PRO   6   7.830 -22.185  -0.805
   36   1HD   PRO   6          1HD       PRO   6   8.788 -20.690  -2.870
   37   2HD   PRO   6          2HD       PRO   6   7.142 -21.342  -2.834
   38    H    ALA   7           H        ALA   7   9.314 -18.392  -1.576
   39    HA   ALA   7           HA       ALA   7  10.173 -16.925   0.683
   40   1HB   ALA   7          1HB       ALA   7  11.290 -17.710  -1.884
   41   2HB   ALA   7          2HB       ALA   7  11.829 -16.116  -1.357
   42   3HB   ALA   7          3HB       ALA   7  12.080 -17.518  -0.319
   43    H    ARG   8           H        ARG   8   8.546 -16.091  -2.230
   44    HA   ARG   8           HA       ARG   8   8.796 -13.234  -1.723
   45   1HB   ARG   8          1HB       ARG   8   8.025 -14.911  -3.990
   46   2HB   ARG   8          2HB       ARG   8   6.973 -13.517  -3.773
   47   1HG   ARG   8          1HG       ARG   8   8.877 -12.025  -3.885
   48   2HG   ARG   8          2HG       ARG   8   9.974 -13.403  -3.992
   49   1HD   ARG   8          1HD       ARG   8   7.782 -13.101  -6.000
   50   2HD   ARG   8          2HD       ARG   8   9.247 -12.133  -6.153
   51    HE   ARG   8           HE       ARG   8  10.341 -14.509  -5.912
   52   1HH1  ARG   8          2HH1      ARG   8   7.552 -13.557  -7.806
   53   2HH1  ARG   8          1HH1      ARG   8   7.767 -14.814  -8.985
   54   1HH2  ARG   8          2HH2      ARG   8  10.615 -16.167  -7.468
   55   2HH2  ARG   8          1HH2      ARG   8   9.497 -16.301  -8.791
   56    H    ALA   9           H        ALA   9   6.393 -15.807  -1.661
   57    HA   ALA   9           HA       ALA   9   4.102 -14.268  -1.223
   58   1HB   ALA   9          1HB       ALA   9   4.856 -17.067  -1.003
   59   2HB   ALA   9          2HB       ALA   9   3.615 -16.592   0.156
   60   3HB   ALA   9          3HB       ALA   9   3.351 -16.341  -1.570
   61    H    ALA  10           H        ALA  10   6.589 -15.330   0.989
   62    HA   ALA  10           HA       ALA  10   5.217 -14.868   3.411
   63   1HB   ALA  10          1HB       ALA  10   7.183 -15.381   4.453
   64   2HB   ALA  10          2HB       ALA  10   7.501 -16.073   2.860
   65   3HB   ALA  10          3HB       ALA  10   8.161 -14.495   3.283
   66    H    ALA  11           H        ALA  11   6.721 -12.698   1.164
   67    HA   ALA  11           HA       ALA  11   6.525 -10.507   3.126
   68   1HB   ALA  11          1HB       ALA  11   7.982 -10.360   0.499
   69   2HB   ALA  11          2HB       ALA  11   8.161  -9.319   1.912
   70   3HB   ALA  11          3HB       ALA  11   8.742 -10.984   1.962
   71    H    LYS  12           H        LYS  12   5.065 -11.862   0.417
   72    HA   LYS  12           HA       LYS  12   4.055  -9.459  -0.761
   73   1HB   LYS  12          1HB       LYS  12   4.419 -11.727  -1.896
   74   2HB   LYS  12          2HB       LYS  12   2.893 -12.199  -1.155
   75   1HG   LYS  12          1HG       LYS  12   2.150  -9.881  -2.287
   76   2HG   LYS  12          2HG       LYS  12   3.421 -10.377  -3.410
   77   1HD   LYS  12          1HD       LYS  12   2.332 -12.529  -3.706
   78   2HD   LYS  12          2HD       LYS  12   1.078 -12.069  -2.556
   79   1HE   LYS  12          2HE       LYS  12   0.787 -10.026  -4.184
   80   2HE   LYS  12          1HE       LYS  12   1.536 -11.123  -5.346
   81   1HZ   LYS  12          1HZ       LYS  12  -0.202 -12.759  -4.792
   82   2HZ   LYS  12          2HZ       LYS  12  -0.836 -11.337  -5.459
   83   3HZ   LYS  12          3HZ       LYS  12  -0.945 -11.610  -3.786
   84    H    THR  13           H        THR  13   2.764 -11.939   1.395
   85    HA   THR  13           HA       THR  13   0.132 -11.453   1.536
   86    HB   THR  13           HB       THR  13   0.878 -11.663   4.236
   87    HG1  THR  13           1HG      THR  13   2.498 -13.435   2.724
   88   1HG2  THR  13          1HG2      THR  13  -0.471 -13.427   4.042
   89   2HG2  THR  13          2HG2      THR  13   0.626 -14.216   2.906
   90   3HG2  THR  13          3HG2      THR  13  -0.581 -13.070   2.320
   91    H    ALA  14           H        ALA  14   2.561  -9.520   3.314
   92    HA   ALA  14           HA       ALA  14   0.707  -7.898   4.670
   93   1HB   ALA  14          1HB       ALA  14   2.717  -6.276   4.746
   94   2HB   ALA  14          2HB       ALA  14   2.856  -7.841   5.546
   95   3HB   ALA  14          3HB       ALA  14   3.602  -7.587   3.968
   96    H    ALA  15           H        ALA  15   2.524  -7.314   1.666
   97    HA   ALA  15           HA       ALA  15   1.350  -4.780   1.151
   98   1HB   ALA  15          1HB       ALA  15   3.356  -6.422   0.000
   99   2HB   ALA  15          2HB       ALA  15   2.223  -5.970  -1.273
  100   3HB   ALA  15          3HB       ALA  15   3.014  -4.720  -0.315
  101    H    ASP  16           H        ASP  16   0.439  -8.052   0.481
  102    HA   ASP  16           HA       ASP  16  -1.420  -7.558  -1.611
  103   1HB   ASP  16          1HB       ASP  16  -0.337  -9.806  -0.394
  104   2HB   ASP  16          2HB       ASP  16  -2.026  -9.851   0.105
  105    H    ALA  17           H        ALA  17  -1.675  -7.901   1.891
  106    HA   ALA  17           HA       ALA  17  -4.491  -7.517   2.011
  107   1HB   ALA  17          1HB       ALA  17  -2.805  -6.799   4.340
  108   2HB   ALA  17          2HB       ALA  17  -4.278  -7.762   4.266
  109   3HB   ALA  17          3HB       ALA  17  -2.736  -8.465   3.773
  110    H    LEU  18           H        LEU  18  -1.688  -5.400   2.234
  111    HA   LEU  18           HA       LEU  18  -3.002  -3.050   3.044
  112   1HB   LEU  18          1HB       LEU  18  -0.477  -3.518   1.469
  113   2HB   LEU  18          2HB       LEU  18  -1.031  -1.908   1.885
  114    HG   LEU  18           HG       LEU  18  -0.056  -4.076   3.721
  115   1HD1  LEU  18          1HD1      LEU  18   1.730  -2.777   3.045
  116   2HD1  LEU  18          2HD1      LEU  18   0.763  -1.303   2.976
  117   3HD1  LEU  18          3HD1      LEU  18   1.230  -1.977   4.538
  118   1HD2  LEU  18          1HD2      LEU  18  -1.248  -1.515   4.726
  119   2HD2  LEU  18          2HD2      LEU  18  -2.250  -2.947   4.491
  120   3HD2  LEU  18          3HD2      LEU  18  -0.887  -2.996   5.612
  121    H    ALA  19           H        ALA  19  -2.091  -4.151  -0.212
  122    HA   ALA  19           HA       ALA  19  -3.165  -2.090  -1.699
  123   1HB   ALA  19          1HB       ALA  19  -3.688  -4.333  -3.233
  124   2HB   ALA  19          2HB       ALA  19  -2.200  -3.387  -3.221
  125   3HB   ALA  19          3HB       ALA  19  -2.340  -4.817  -2.200
  126    H    ALA  20           H        ALA  20  -4.826  -4.956  -0.432
  127    HA   ALA  20           HA       ALA  20  -7.327  -4.370  -1.659
  128   1HB   ALA  20          1HB       ALA  20  -8.185  -6.182  -0.459
  129   2HB   ALA  20          2HB       ALA  20  -6.495  -6.607  -0.728
  130   3HB   ALA  20          3HB       ALA  20  -7.012  -5.994   0.844
  131    H    ALA  21           H        ALA  21  -5.961  -3.744   1.549
  132    HA   ALA  21           HA       ALA  21  -8.269  -2.625   2.708
  133   1HB   ALA  21          1HB       ALA  21  -6.560  -3.273   4.181
  134   2HB   ALA  21          2HB       ALA  21  -5.341  -2.338   3.316
  135   3HB   ALA  21          3HB       ALA  21  -6.581  -1.512   4.258
  136    H    LYS  22           H        LYS  22  -5.594  -1.165   0.910
  137    HA   LYS  22           HA       LYS  22  -6.460   1.522   1.318
  138   1HB   LYS  22          1HB       LYS  22  -4.359   0.150  -0.229
  139   2HB   LYS  22          2HB       LYS  22  -4.929   1.660  -0.929
  140   1HG   LYS  22          1HG       LYS  22  -3.231   2.434   0.377
  141   2HG   LYS  22          2HG       LYS  22  -4.574   2.549   1.521
  142   1HD   LYS  22          1HD       LYS  22  -3.948   0.388   2.476
  143   2HD   LYS  22          2HD       LYS  22  -2.613   0.260   1.331
  144   1HE   LYS  22          2HE       LYS  22  -2.753   2.698   3.017
  145   2HE   LYS  22          1HE       LYS  22  -2.282   1.188   3.797
  146   1HZ   LYS  22          1HZ       LYS  22  -0.845   2.805   1.866
  147   2HZ   LYS  22          2HZ       LYS  22  -0.755   1.130   1.618
  148   3HZ   LYS  22          3HZ       LYS  22  -0.250   1.796   3.093
  149    H    LYS  23           H        LYS  23  -6.785  -0.834  -1.270
  150    HA   LYS  23           HA       LYS  23  -8.223   0.630  -3.139
  151   1HB   LYS  23          1HB       LYS  23  -7.470  -1.998  -2.867
  152   2HB   LYS  23          2HB       LYS  23  -9.217  -2.102  -2.725
  153   1HG   LYS  23          1HG       LYS  23  -7.608  -1.057  -5.025
  154   2HG   LYS  23          2HG       LYS  23  -8.692  -2.446  -4.984
  155   1HD   LYS  23          1HD       LYS  23 -10.233  -0.234  -4.196
  156   2HD   LYS  23          2HD       LYS  23  -9.278   0.304  -5.581
  157   1HE   LYS  23          2HE       LYS  23 -10.052  -1.704  -6.822
  158   2HE   LYS  23          1HE       LYS  23 -11.092  -2.104  -5.453
  159   1HZ   LYS  23          1HZ       LYS  23 -12.109  -0.835  -7.403
  160   2HZ   LYS  23          2HZ       LYS  23 -11.284   0.523  -6.808
  161   3HZ   LYS  23          3HZ       LYS  23 -12.438  -0.260  -5.838
  162    H    THR  24           H        THR  24  -9.531  -1.461  -0.587
  163    HA   THR  24           HA       THR  24 -12.215  -0.866  -0.968
  164    HB   THR  24           HB       THR  24 -10.575  -2.173   1.068
  165    HG1  THR  24           1HG      THR  24 -12.661  -3.478   0.982
  166   1HG2  THR  24          1HG2      THR  24 -11.667  -0.588   2.550
  167   2HG2  THR  24          2HG2      THR  24 -12.311  -2.212   2.799
  168   3HG2  THR  24          3HG2      THR  24 -13.243  -1.024   1.885
  169    H    ALA  25           H        ALA  25  -9.798   0.765   1.061
  170    HA   ALA  25           HA       ALA  25 -11.538   2.549   2.355
  171   1HB   ALA  25          1HB       ALA  25  -9.389   2.397   3.258
  172   2HB   ALA  25          2HB       ALA  25  -8.613   2.660   1.695
  173   3HB   ALA  25          3HB       ALA  25  -9.423   3.996   2.512
  174    H    ALA  26           H        ALA  26  -9.565   3.021  -0.580
  175    HA   ALA  26           HA       ALA  26 -10.621   5.555  -1.235
  176   1HB   ALA  26          1HB       ALA  26  -8.790   3.675  -2.399
  177   2HB   ALA  26          2HB       ALA  26  -9.871   4.316  -3.635
  178   3HB   ALA  26          3HB       ALA  26  -8.911   5.416  -2.647
  179    H    ASP  27           H        ASP  27 -11.617   2.287  -1.988
  180    HA   ASP  27           HA       ASP  27 -13.596   2.802  -3.900
  181   1HB   ASP  27          1HB       ASP  27 -12.608   0.549  -2.835
  182   2HB   ASP  27          2HB       ASP  27 -14.096   0.656  -1.903
  183    H    ALA  28           H        ALA  28 -13.724   2.798  -0.378
  184    HA   ALA  28           HA       ALA  28 -16.473   3.231  -0.064
  185   1HB   ALA  28          1HB       ALA  28 -14.581   2.749   1.687
  186   2HB   ALA  28          2HB       ALA  28 -14.535   4.508   1.809
  187   3HB   ALA  28          3HB       ALA  28 -16.031   3.639   2.152
  188    H    ALA  29           H        ALA  29 -13.804   5.564  -0.330
  189    HA   ALA  29           HA       ALA  29 -15.388   7.890  -0.229
  190   1HB   ALA  29          1HB       ALA  29 -12.629   7.241  -1.113
  191   2HB   ALA  29          2HB       ALA  29 -13.323   8.778  -1.631
  192   3HB   ALA  29          3HB       ALA  29 -13.192   8.404   0.088
  193    H    ALA  30           H        ALA  30 -14.500   5.751  -2.848
  194    HA   ALA  30           HA       ALA  30 -15.507   7.440  -4.928
  195   1HB   ALA  30          1HB       ALA  30 -14.216   6.061  -6.099
  196   2HB   ALA  30          2HB       ALA  30 -14.097   4.941  -4.743
  197   3HB   ALA  30          3HB       ALA  30 -15.438   4.809  -5.880
  198    H    ALA  31           H        ALA  31 -16.963   5.423  -2.628
  199    HA   ALA  31           HA       ALA  31 -19.293   4.822  -4.251
  200   1HB   ALA  31          1HB       ALA  31 -18.107   3.641  -2.009
  201   2HB   ALA  31          2HB       ALA  31 -19.659   4.270  -1.457
  202   3HB   ALA  31          3HB       ALA  31 -19.594   3.149  -2.818
  203    H    ALA  32           H        ALA  32 -18.205   7.490  -2.867
  204    HA   ALA  32           HA       ALA  32 -20.635   8.387  -1.576
  205   1HB   ALA  32          1HB       ALA  32 -17.897   9.243  -1.650
  206   2HB   ALA  32          2HB       ALA  32 -18.965  10.592  -2.032
  207   3HB   ALA  32          3HB       ALA  32 -19.178   9.697  -0.527
  208    H    ALA  33           H        ALA  33 -21.845   7.870  -3.586
  209    HA   ALA  33           HA       ALA  33 -21.552   9.509  -5.892
  210   1HB   ALA  33          1HB       ALA  33 -23.138   7.292  -5.102
  211   2HB   ALA  33          2HB       ALA  33 -24.217   8.561  -5.680
  212   3HB   ALA  33          3HB       ALA  33 -22.920   7.967  -6.718
  213    H    ALA  34           H        ALA  34 -22.550  11.372  -6.450
  214    HA   ALA  34           HA       ALA  34 -23.605  13.360  -6.266
  215   1HB   ALA  34          1HB       ALA  34 -25.259  12.195  -4.035
  216   2HB   ALA  34          2HB       ALA  34 -25.640  13.582  -5.053
  217   3HB   ALA  34          3HB       ALA  34 -25.612  11.962  -5.748
  218    H    ALA  35           H        ALA  35 -21.280  12.533  -4.584
  219    HA   ALA  35           HA       ALA  35 -21.487  14.714  -2.616
  220   1HB   ALA  35          1HB       ALA  35 -19.372  13.372  -1.694
  221   2HB   ALA  35          2HB       ALA  35 -21.024  13.004  -1.199
  222   3HB   ALA  35          3HB       ALA  35 -20.239  12.032  -2.445
  Start of MODEL    3
    1   1H    GLY   1          1H        GLY   1  25.635  -8.372   2.090
    2   2H    GLY   1          2H        GLY   1  24.229  -8.045   1.199
    3   3H    GLY   1          3H        GLY   1  24.489  -9.595   1.834
    4   1HA   GLY   1          2HA       GLY   1  24.522  -8.469   4.105
    5   2HA   GLY   1          1HA       GLY   1  23.784  -7.111   3.267
    6    H    SER   2           H        SER   2  22.269  -8.036   5.182
    7    HA   SER   2           HA       SER   2  20.578 -10.210   4.516
    8   1HB   SER   2          1HB       SER   2  19.327  -8.160   6.173
    9   2HB   SER   2          2HB       SER   2  19.749  -9.828   6.573
   10    HG   SER   2           HG       SER   2  21.670  -9.203   7.303
   11    H    MET   3           H        MET   3  19.821 -10.016   2.446
   12    HA   MET   3           HA       MET   3  17.592  -8.245   2.028
   13   1HB   MET   3          1HB       MET   3  20.099  -7.283   1.271
   14   2HB   MET   3          2HB       MET   3  19.400  -7.891  -0.223
   15   1HG   MET   3          1HG       MET   3  17.809  -6.294  -0.298
   16   2HG   MET   3          2HG       MET   3  17.638  -6.224   1.455
   17   1HE   MET   3          1HE       MET   3  18.701  -4.064   2.857
   18   2HE   MET   3          2HE       MET   3  19.702  -5.518   2.902
   19   3HE   MET   3          3HE       MET   3  20.445  -3.942   2.624
   20    H    ASN   4           H        ASN   4  17.837 -11.004   2.144
   21    HA   ASN   4           HA       ASN   4  18.025 -12.123  -0.487
   22   1HB   ASN   4          1HB       ASN   4  18.418 -13.243   1.860
   23   2HB   ASN   4          2HB       ASN   4  16.690 -13.567   1.769
   24   1HD2  ASN   4          1HD2      ASN   4  18.157 -15.718   1.916
   25   2HD2  ASN   4          2HD2      ASN   4  18.322 -16.508   0.382
   26    H    ALA   5           H        ALA   5  16.385 -12.988  -1.735
   27    HA   ALA   5           HA       ALA   5  14.085 -11.398  -1.941
   28   1HB   ALA   5          1HB       ALA   5  13.942 -12.300  -3.956
   29   2HB   ALA   5          2HB       ALA   5  15.381 -13.234  -3.551
   30   3HB   ALA   5          3HB       ALA   5  13.781 -13.926  -3.295
   31    HA   PRO   6           HA       PRO   6  11.667 -15.432  -0.229
   32   1HB   PRO   6          1HB       PRO   6  13.825 -16.044   1.744
   33   2HB   PRO   6          2HB       PRO   6  12.650 -17.130   0.995
   34   1HG   PRO   6          1HG       PRO   6  15.148 -17.083   0.133
   35   2HG   PRO   6          2HG       PRO   6  13.803 -17.194  -1.021
   36   1HD   PRO   6          1HD       PRO   6  15.541 -14.867  -0.346
   37   2HD   PRO   6          2HD       PRO   6  14.812 -15.325  -1.895
   38    H    ALA   7           H        ALA   7  13.881 -13.500   1.756
   39    HA   ALA   7           HA       ALA   7  12.212 -13.238   3.996
   40   1HB   ALA   7          1HB       ALA   7  13.628 -11.304   4.591
   41   2HB   ALA   7          2HB       ALA   7  14.568 -12.730   4.145
   42   3HB   ALA   7          3HB       ALA   7  14.380 -11.401   2.999
   43    H    ARG   8           H        ARG   8  12.358 -11.528   0.999
   44    HA   ARG   8           HA       ARG   8  10.506  -9.467   1.868
   45   1HB   ARG   8          1HB       ARG   8  11.384  -9.980  -0.967
   46   2HB   ARG   8          2HB       ARG   8  10.807  -8.475  -0.263
   47   1HG   ARG   8          1HG       ARG   8  13.326  -9.738   0.734
   48   2HG   ARG   8          2HG       ARG   8  13.326  -8.780  -0.748
   49   1HD   ARG   8          1HD       ARG   8  11.935  -7.175   0.965
   50   2HD   ARG   8          2HD       ARG   8  13.102  -7.935   2.046
   51    HE   ARG   8           HE       ARG   8  14.439  -7.044  -0.262
   52   1HH1  ARG   8          2HH1      ARG   8  12.849  -5.769   2.589
   53   2HH1  ARG   8          1HH1      ARG   8  13.799  -4.314   2.624
   54   1HH2  ARG   8          2HH2      ARG   8  15.651  -5.109  -0.255
   55   2HH2  ARG   8          1HH2      ARG   8  15.403  -3.940   1.014
   56    H    ALA   9           H        ALA   9  10.533 -12.395  -0.060
   57    HA   ALA   9           HA       ALA   9   7.945 -12.201  -1.155
   58   1HB   ALA   9          1HB       ALA   9   8.129 -14.605  -1.550
   59   2HB   ALA   9          2HB       ALA   9   9.606 -13.761  -2.007
   60   3HB   ALA   9          3HB       ALA   9   9.542 -14.672  -0.499
   61    H    ALA  10           H        ALA  10   9.086 -13.233   1.975
   62    HA   ALA  10           HA       ALA  10   6.725 -14.471   2.892
   63   1HB   ALA  10          1HB       ALA  10   7.928 -14.781   4.743
   64   2HB   ALA  10          2HB       ALA  10   9.247 -13.944   3.926
   65   3HB   ALA  10          3HB       ALA  10   8.149 -13.047   4.973
   66    H    ALA  11           H        ALA  11   7.683 -11.130   2.576
   67    HA   ALA  11           HA       ALA  11   5.467 -10.182   4.206
   68   1HB   ALA  11          1HB       ALA  11   8.004  -9.200   3.659
   69   2HB   ALA  11          2HB       ALA  11   6.916  -8.123   2.786
   70   3HB   ALA  11          3HB       ALA  11   6.711  -8.364   4.521
   71    H    LYS  12           H        LYS  12   5.527 -11.427   1.288
   72    HA   LYS  12           HA       LYS  12   4.394  -9.571  -0.469
   73   1HB   LYS  12          1HB       LYS  12   5.094 -12.184  -0.643
   74   2HB   LYS  12          2HB       LYS  12   3.340 -12.315  -0.627
   75   1HG   LYS  12          1HG       LYS  12   4.004 -10.232  -2.409
   76   2HG   LYS  12          2HG       LYS  12   5.061 -11.601  -2.771
   77   1HD   LYS  12          1HD       LYS  12   3.380 -12.555  -3.847
   78   2HD   LYS  12          2HD       LYS  12   2.506 -12.675  -2.322
   79   1HE   LYS  12          2HE       LYS  12   1.773 -10.273  -2.763
   80   2HE   LYS  12          1HE       LYS  12   2.357 -10.517  -4.407
   81   1HZ   LYS  12          1HZ       LYS  12   0.813 -12.699  -3.969
   82   2HZ   LYS  12          2HZ       LYS  12   0.324 -11.305  -4.800
   83   3HZ   LYS  12          3HZ       LYS  12  -0.041 -11.484  -3.150
   84    H    THR  13           H        THR  13   2.960 -11.514   2.068
   85    HA   THR  13           HA       THR  13   0.251 -11.081   1.355
   86    HB   THR  13           HB       THR  13   0.715 -11.635   4.170
   87    HG1  THR  13           1HG      THR  13   2.256 -13.080   4.011
   88   1HG2  THR  13          1HG2      THR  13  -0.457 -13.794   3.387
   89   2HG2  THR  13          2HG2      THR  13  -0.617 -12.965   1.840
   90   3HG2  THR  13          3HG2      THR  13  -1.346 -12.274   3.290
   91    H    ALA  14           H        ALA  14   2.583  -9.361   3.265
   92    HA   ALA  14           HA       ALA  14   0.809  -7.753   4.771
   93   1HB   ALA  14          1HB       ALA  14   2.680  -6.902   5.656
   94   2HB   ALA  14          2HB       ALA  14   3.541  -8.091   4.676
   95   3HB   ALA  14          3HB       ALA  14   3.319  -6.447   4.074
   96    H    ALA  15           H        ALA  15   2.667  -7.035   1.813
   97    HA   ALA  15           HA       ALA  15   1.345  -4.586   1.279
   98   1HB   ALA  15          1HB       ALA  15   3.284  -4.610   0.108
   99   2HB   ALA  15          2HB       ALA  15   3.226  -6.354  -0.161
  100   3HB   ALA  15          3HB       ALA  15   2.245  -5.274  -1.154
  101    H    ASP  16           H        ASP  16   0.595  -7.899   0.638
  102    HA   ASP  16           HA       ASP  16  -1.262  -7.532  -1.473
  103   1HB   ASP  16          1HB       ASP  16  -0.148  -9.702  -0.103
  104   2HB   ASP  16          2HB       ASP  16  -1.874  -9.788   0.246
  105    H    ALA  17           H        ALA  17  -1.661  -7.968   2.020
  106    HA   ALA  17           HA       ALA  17  -4.463  -7.618   2.063
  107   1HB   ALA  17          1HB       ALA  17  -4.158  -8.240   4.173
  108   2HB   ALA  17          2HB       ALA  17  -2.413  -8.114   3.948
  109   3HB   ALA  17          3HB       ALA  17  -3.331  -6.720   4.520
  110    H    LEU  18           H        LEU  18  -1.772  -5.381   2.176
  111    HA   LEU  18           HA       LEU  18  -3.256  -3.086   2.924
  112   1HB   LEU  18          1HB       LEU  18  -0.624  -3.442   1.510
  113   2HB   LEU  18          2HB       LEU  18  -1.284  -1.861   1.878
  114    HG   LEU  18           HG       LEU  18  -0.580  -3.985   3.899
  115   1HD1  LEU  18          1HD1      LEU  18   1.484  -3.206   3.806
  116   2HD1  LEU  18          2HD1      LEU  18   1.017  -2.097   2.514
  117   3HD1  LEU  18          3HD1      LEU  18   0.895  -1.590   4.200
  118   1HD2  LEU  18          1HD2      LEU  18  -1.640  -2.798   5.448
  119   2HD2  LEU  18          2HD2      LEU  18  -0.903  -1.293   4.896
  120   3HD2  LEU  18          3HD2      LEU  18  -2.382  -1.882   4.137
  121    H    ALA  19           H        ALA  19  -2.312  -4.440  -0.207
  122    HA   ALA  19           HA       ALA  19  -3.228  -2.420  -1.877
  123   1HB   ALA  19          1HB       ALA  19  -3.566  -5.291  -2.641
  124   2HB   ALA  19          2HB       ALA  19  -3.039  -3.927  -3.625
  125   3HB   ALA  19          3HB       ALA  19  -1.953  -4.616  -2.419
  126    H    ALA  20           H        ALA  20  -4.972  -5.170  -0.503
  127    HA   ALA  20           HA       ALA  20  -7.455  -4.585  -1.742
  128   1HB   ALA  20          1HB       ALA  20  -7.359  -6.011   0.866
  129   2HB   ALA  20          2HB       ALA  20  -8.282  -6.379  -0.590
  130   3HB   ALA  20          3HB       ALA  20  -6.559  -6.748  -0.523
  131    H    ALA  21           H        ALA  21  -6.152  -3.919   1.489
  132    HA   ALA  21           HA       ALA  21  -8.425  -2.674   2.554
  133   1HB   ALA  21          1HB       ALA  21  -5.511  -2.524   3.236
  134   2HB   ALA  21          2HB       ALA  21  -6.715  -1.583   4.114
  135   3HB   ALA  21          3HB       ALA  21  -6.810  -3.343   4.103
  136    H    LYS  22           H        LYS  22  -5.642  -1.322   0.805
  137    HA   LYS  22           HA       LYS  22  -6.449   1.384   1.170
  138   1HB   LYS  22          1HB       LYS  22  -4.311  -0.047  -0.224
  139   2HB   LYS  22          2HB       LYS  22  -4.859   1.387  -1.079
  140   1HG   LYS  22          1HG       LYS  22  -3.374   2.448   0.202
  141   2HG   LYS  22          2HG       LYS  22  -4.627   2.346   1.444
  142   1HD   LYS  22          1HD       LYS  22  -3.602   0.513   2.480
  143   2HD   LYS  22          2HD       LYS  22  -2.613   0.152   1.064
  144   1HE   LYS  22          2HE       LYS  22  -2.244   2.806   2.321
  145   2HE   LYS  22          1HE       LYS  22  -1.658   1.409   3.223
  146   1HZ   LYS  22          1HZ       LYS  22  -0.691   0.872   0.804
  147   2HZ   LYS  22          2HZ       LYS  22   0.168   1.751   1.972
  148   3HZ   LYS  22          3HZ       LYS  22  -0.672   2.566   0.745
  149    H    LYS  23           H        LYS  23  -7.041  -1.071  -1.255
  150    HA   LYS  23           HA       LYS  23  -8.199   0.628  -3.208
  151   1HB   LYS  23          1HB       LYS  23  -7.372  -1.818  -3.435
  152   2HB   LYS  23          2HB       LYS  23  -8.970  -2.253  -2.845
  153   1HG   LYS  23          1HG       LYS  23  -9.912  -0.874  -4.735
  154   2HG   LYS  23          2HG       LYS  23  -8.269  -0.791  -5.373
  155   1HD   LYS  23          1HD       LYS  23  -8.925  -2.652  -6.479
  156   2HD   LYS  23          2HD       LYS  23  -8.462  -3.439  -4.969
  157   1HE   LYS  23          2HE       LYS  23 -10.529  -4.254  -4.870
  158   2HE   LYS  23          1HE       LYS  23 -11.072  -2.612  -4.533
  159   1HZ   LYS  23          1HZ       LYS  23 -11.866  -4.125  -6.634
  160   2HZ   LYS  23          2HZ       LYS  23 -10.684  -3.136  -7.340
  161   3HZ   LYS  23          3HZ       LYS  23 -12.008  -2.438  -6.538
  162    H    THR  24           H        THR  24  -9.578  -1.372  -0.633
  163    HA   THR  24           HA       THR  24 -12.259  -0.774  -1.169
  164    HB   THR  24           HB       THR  24 -10.743  -1.921   1.120
  165    HG1  THR  24           1HG      THR  24 -12.600  -3.523   0.532
  166   1HG2  THR  24          1HG2      THR  24 -13.414  -0.705   1.260
  167   2HG2  THR  24          2HG2      THR  24 -12.239  -1.020   2.535
  168   3HG2  THR  24          3HG2      THR  24 -13.267  -2.324   1.943
  169    H    ALA  25           H        ALA  25  -9.885   0.704   1.017
  170    HA   ALA  25           HA       ALA  25 -11.545   2.615   2.205
  171   1HB   ALA  25          1HB       ALA  25  -9.387   2.336   3.118
  172   2HB   ALA  25          2HB       ALA  25  -8.604   2.647   1.571
  173   3HB   ALA  25          3HB       ALA  25  -9.403   3.960   2.434
  174    H    ALA  26           H        ALA  26  -9.591   2.826  -0.747
  175    HA   ALA  26           HA       ALA  26 -10.367   5.418  -1.509
  176   1HB   ALA  26          1HB       ALA  26  -9.732   4.585  -3.846
  177   2HB   ALA  26          2HB       ALA  26  -8.484   4.566  -2.599
  178   3HB   ALA  26          3HB       ALA  26  -9.307   3.072  -3.046
  179    H    ASP  27           H        ASP  27 -11.790   2.262  -2.160
  180    HA   ASP  27           HA       ASP  27 -13.762   3.055  -3.992
  181   1HB   ASP  27          1HB       ASP  27 -13.021   0.678  -3.262
  182   2HB   ASP  27          2HB       ASP  27 -14.205   0.865  -1.975
  183    H    ALA  28           H        ALA  28 -13.983   2.597  -0.465
  184    HA   ALA  28           HA       ALA  28 -16.650   3.391  -0.180
  185   1HB   ALA  28          1HB       ALA  28 -14.319   3.275   1.693
  186   2HB   ALA  28          2HB       ALA  28 -15.861   3.949   2.221
  187   3HB   ALA  28          3HB       ALA  28 -15.776   2.282   1.654
  188    H    ALA  29           H        ALA  29 -13.670   5.284  -0.153
  189    HA   ALA  29           HA       ALA  29 -14.912   7.728   0.619
  190   1HB   ALA  29          1HB       ALA  29 -12.344   6.880   0.479
  191   2HB   ALA  29          2HB       ALA  29 -12.433   7.916  -0.946
  192   3HB   ALA  29          3HB       ALA  29 -12.829   8.568   0.645
  193    H    ALA  30           H        ALA  30 -14.334   6.139  -2.445
  194    HA   ALA  30           HA       ALA  30 -14.736   8.406  -4.110
  195   1HB   ALA  30          1HB       ALA  30 -13.927   5.791  -4.489
  196   2HB   ALA  30          2HB       ALA  30 -15.463   5.889  -5.349
  197   3HB   ALA  30          3HB       ALA  30 -14.159   7.008  -5.744
  198    H    ALA  31           H        ALA  31 -16.868   6.020  -2.696
  199    HA   ALA  31           HA       ALA  31 -19.148   7.044  -4.208
  200   1HB   ALA  31          1HB       ALA  31 -18.530   4.564  -2.772
  201   2HB   ALA  31          2HB       ALA  31 -20.178   5.149  -2.543
  202   3HB   ALA  31          3HB       ALA  31 -19.573   4.838  -4.168
  203    H    ALA  32           H        ALA  32 -17.589   8.229  -1.753
  204    HA   ALA  32           HA       ALA  32 -19.809   8.590   0.104
  205   1HB   ALA  32          1HB       ALA  32 -18.272   9.101   1.682
  206   2HB   ALA  32          2HB       ALA  32 -17.176   8.273   0.577
  207   3HB   ALA  32          3HB       ALA  32 -17.275  10.033   0.563
  208    H    ALA  33           H        ALA  33 -20.761   9.695  -1.989
  209    HA   ALA  33           HA       ALA  33 -19.934  12.389  -2.465
  210   1HB   ALA  33          1HB       ALA  33 -21.670  10.543  -3.689
  211   2HB   ALA  33          2HB       ALA  33 -22.643  11.952  -3.266
  212   3HB   ALA  33          3HB       ALA  33 -21.203  12.143  -4.267
  213    H    ALA  34           H        ALA  34 -22.163  10.824  -0.300
  214    HA   ALA  34           HA       ALA  34 -22.950  13.469   0.727
  215   1HB   ALA  34          1HB       ALA  34 -25.065  12.559   1.402
  216   2HB   ALA  34          2HB       ALA  34 -24.814  12.193  -0.305
  217   3HB   ALA  34          3HB       ALA  34 -24.575  10.939   0.909
  218    H    ALA  35           H        ALA  35 -20.798  13.035   1.826
  219    HA   ALA  35           HA       ALA  35 -21.318  12.154   4.511
  220   1HB   ALA  35          1HB       ALA  35 -18.889  10.825   3.688
  221   2HB   ALA  35          2HB       ALA  35 -20.300  10.166   4.513
  222   3HB   ALA  35          3HB       ALA  35 -20.269  10.254   2.752
  Start of MODEL    4
    1   1H    GLY   1          1H        GLY   1  -6.156 -27.104  10.970
    2   2H    GLY   1          2H        GLY   1  -5.730 -25.718  10.088
    3   3H    GLY   1          3H        GLY   1  -4.599 -26.452  11.113
    4   1HA   GLY   1          2HA       GLY   1  -4.580 -28.433   9.728
    5   2HA   GLY   1          1HA       GLY   1  -5.751 -27.664   8.663
    6    H    SER   2           H        SER   2  -5.012 -25.341   8.020
    7    HA   SER   2           HA       SER   2  -3.604 -24.027   6.834
    8   1HB   SER   2          1HB       SER   2  -1.370 -25.246   8.464
    9   2HB   SER   2          2HB       SER   2  -1.408 -23.648   7.717
   10    HG   SER   2           HG       SER   2  -3.139 -23.121   9.150
   11    H    MET   3           H        MET   3  -0.639 -25.116   6.527
   12    HA   MET   3           HA       MET   3   0.561 -26.132   4.905
   13   1HB   MET   3          1HB       MET   3  -1.191 -28.082   5.868
   14   2HB   MET   3          2HB       MET   3  -1.315 -28.201   4.118
   15   1HG   MET   3          1HG       MET   3   0.467 -29.580   5.439
   16   2HG   MET   3          2HG       MET   3   0.848 -28.881   3.867
   17   1HE   MET   3          1HE       MET   3   1.776 -27.463   7.982
   18   2HE   MET   3          2HE       MET   3   1.050 -28.980   7.445
   19   3HE   MET   3          3HE       MET   3   2.803 -28.845   7.593
   20    H    ASN   4           H        ASN   4  -1.051 -23.989   4.166
   21    HA   ASN   4           HA       ASN   4  -1.827 -24.705   1.420
   22   1HB   ASN   4          1HB       ASN   4  -2.930 -22.214   1.855
   23   2HB   ASN   4          2HB       ASN   4  -3.794 -23.740   1.941
   24   1HD2  ASN   4          1HD2      ASN   4  -5.168 -23.532   3.554
   25   2HD2  ASN   4          2HD2      ASN   4  -4.773 -23.006   5.162
   26    H    ALA   5           H        ALA   5  -1.177 -23.383  -0.268
   27    HA   ALA   5           HA       ALA   5   1.420 -22.401  -0.128
   28   1HB   ALA   5          1HB       ALA   5  -0.566 -21.587  -2.229
   29   2HB   ALA   5          2HB       ALA   5   1.184 -21.742  -2.381
   30   3HB   ALA   5          3HB       ALA   5   0.185 -23.183  -2.170
   31    HA   PRO   6           HA       PRO   6  -0.651 -17.827  -0.252
   32   1HB   PRO   6          1HB       PRO   6  -2.813 -18.690   1.626
   33   2HB   PRO   6          2HB       PRO   6  -2.802 -17.369   0.457
   34   1HG   PRO   6          1HG       PRO   6  -4.053 -19.620  -0.124
   35   2HG   PRO   6          2HG       PRO   6  -3.075 -18.801  -1.360
   36   1HD   PRO   6          1HD       PRO   6  -2.469 -21.261   0.206
   37   2HD   PRO   6          2HD       PRO   6  -2.020 -20.837  -1.451
   38    H    ALA   7           H        ALA   7  -0.723 -20.047   2.496
   39    HA   ALA   7           HA       ALA   7  -0.135 -18.126   4.478
   40   1HB   ALA   7          1HB       ALA   7  -0.627 -20.920   4.388
   41   2HB   ALA   7          2HB       ALA   7   0.846 -20.641   5.315
   42   3HB   ALA   7          3HB       ALA   7  -0.652 -19.841   5.784
   43    H    ARG   8           H        ARG   8   1.846 -20.121   2.445
   44    HA   ARG   8           HA       ARG   8   4.314 -19.419   3.765
   45   1HB   ARG   8          1HB       ARG   8   3.731 -20.855   1.172
   46   2HB   ARG   8          2HB       ARG   8   5.359 -20.546   1.759
   47   1HG   ARG   8          1HG       ARG   8   4.778 -21.808   3.826
   48   2HG   ARG   8          2HG       ARG   8   3.245 -22.242   3.064
   49   1HD   ARG   8          1HD       ARG   8   5.974 -22.840   1.924
   50   2HD   ARG   8          2HD       ARG   8   4.984 -23.987   2.826
   51    HE   ARG   8           HE       ARG   8   3.409 -23.989   1.026
   52   1HH1  ARG   8          2HH1      ARG   8   6.422 -22.316   0.335
   53   2HH1  ARG   8          1HH1      ARG   8   6.207 -22.385  -1.393
   54   1HH2  ARG   8          2HH2      ARG   8   3.131 -24.067  -1.248
   55   2HH2  ARG   8          1HH2      ARG   8   4.362 -23.410  -2.284
   56    H    ALA   9           H        ALA   9   2.317 -18.141   1.310
   57    HA   ALA   9           HA       ALA   9   4.402 -16.411   0.233
   58   1HB   ALA   9          1HB       ALA   9   3.164 -16.889  -1.583
   59   2HB   ALA   9          2HB       ALA   9   1.733 -17.286  -0.629
   60   3HB   ALA   9          3HB       ALA   9   2.115 -15.602  -0.989
   61    H    ALA  10           H        ALA  10   3.218 -16.281   3.019
   62    HA   ALA  10           HA       ALA  10   1.504 -14.138   3.383
   63   1HB   ALA  10          1HB       ALA  10   2.998 -15.856   5.009
   64   2HB   ALA  10          2HB       ALA  10   3.439 -14.221   5.500
   65   3HB   ALA  10          3HB       ALA  10   1.748 -14.718   5.511
   66    H    ALA  11           H        ALA  11   4.911 -14.091   2.631
   67    HA   ALA  11           HA       ALA  11   5.568 -11.481   3.381
   68   1HB   ALA  11          1HB       ALA  11   6.792 -13.552   1.957
   69   2HB   ALA  11          2HB       ALA  11   6.771 -12.174   0.859
   70   3HB   ALA  11          3HB       ALA  11   7.516 -12.021   2.450
   71    H    LYS  12           H        LYS  12   3.982 -12.739   0.493
   72    HA   LYS  12           HA       LYS  12   3.785 -10.143  -0.751
   73   1HB   LYS  12          1HB       LYS  12   3.834 -12.599  -1.793
   74   2HB   LYS  12          2HB       LYS  12   2.090 -12.435  -1.625
   75   1HG   LYS  12          1HG       LYS  12   3.317 -10.094  -2.826
   76   2HG   LYS  12          2HG       LYS  12   3.620 -11.572  -3.743
   77   1HD   LYS  12          1HD       LYS  12   1.342 -11.971  -4.078
   78   2HD   LYS  12          2HD       LYS  12   0.867 -10.877  -2.777
   79   1HE   LYS  12          2HE       LYS  12   1.997  -9.059  -4.249
   80   2HE   LYS  12          1HE       LYS  12   1.802 -10.238  -5.544
   81   1HZ   LYS  12          1HZ       LYS  12  -0.341  -9.745  -5.710
   82   2HZ   LYS  12          2HZ       LYS  12  -0.089  -8.453  -4.638
   83   3HZ   LYS  12          3HZ       LYS  12  -0.601  -9.957  -4.046
   84    H    THR  13           H        THR  13   1.641 -12.398   0.939
   85    HA   THR  13           HA       THR  13  -0.761 -11.025   0.589
   86    HB   THR  13           HB       THR  13  -0.260 -12.526   3.123
   87    HG1  THR  13           1HG      THR  13  -0.114 -14.441   2.037
   88   1HG2  THR  13          1HG2      THR  13  -2.495 -12.866   1.140
   89   2HG2  THR  13          2HG2      THR  13  -2.504 -11.554   2.315
   90   3HG2  THR  13          3HG2      THR  13  -2.483 -13.226   2.868
   91    H    ALA  14           H        ALA  14   1.898 -10.319   2.688
   92    HA   ALA  14           HA       ALA  14   0.541  -8.699   4.572
   93   1HB   ALA  14          1HB       ALA  14   3.375  -8.250   3.676
   94   2HB   ALA  14          2HB       ALA  14   2.658  -7.933   5.256
   95   3HB   ALA  14          3HB       ALA  14   2.919  -9.593   4.724
   96    H    ALA  15           H        ALA  15   2.501  -7.749   1.754
   97    HA   ALA  15           HA       ALA  15   1.624  -5.060   1.725
   98   1HB   ALA  15          1HB       ALA  15   3.610  -6.411   0.481
   99   2HB   ALA  15          2HB       ALA  15   2.465  -6.209  -0.847
  100   3HB   ALA  15          3HB       ALA  15   3.067  -4.796   0.021
  101    H    ASP  16           H        ASP  16   0.345  -8.001   0.417
  102    HA   ASP  16           HA       ASP  16  -1.432  -6.907  -1.493
  103   1HB   ASP  16          1HB       ASP  16  -0.694  -9.455  -0.703
  104   2HB   ASP  16          2HB       ASP  16  -2.381  -9.351  -0.210
  105    H    ALA  17           H        ALA  17  -1.729  -7.650   1.943
  106    HA   ALA  17           HA       ALA  17  -4.487  -7.099   2.183
  107   1HB   ALA  17          1HB       ALA  17  -4.178  -7.663   4.319
  108   2HB   ALA  17          2HB       ALA  17  -2.506  -8.005   3.875
  109   3HB   ALA  17          3HB       ALA  17  -2.937  -6.433   4.550
  110    H    LEU  18           H        LEU  18  -1.615  -5.103   2.296
  111    HA   LEU  18           HA       LEU  18  -2.889  -2.718   3.157
  112   1HB   LEU  18          1HB       LEU  18  -0.346  -3.183   1.599
  113   2HB   LEU  18          2HB       LEU  18  -0.864  -1.605   2.158
  114    HG   LEU  18           HG       LEU  18   0.142  -3.933   3.754
  115   1HD1  LEU  18          1HD1      LEU  18   1.831  -2.416   3.170
  116   2HD1  LEU  18          2HD1      LEU  18   0.797  -1.017   3.464
  117   3HD1  LEU  18          3HD1      LEU  18   1.389  -1.975   4.821
  118   1HD2  LEU  18          1HD2      LEU  18  -0.561  -2.206   5.694
  119   2HD2  LEU  18          2HD2      LEU  18  -1.893  -1.950   4.566
  120   3HD2  LEU  18          3HD2      LEU  18  -1.567  -3.566   5.193
  121    H    ALA  19           H        ALA  19  -2.030  -4.016  -0.028
  122    HA   ALA  19           HA       ALA  19  -3.003  -1.944  -1.609
  123   1HB   ALA  19          1HB       ALA  19  -3.254  -4.825  -2.406
  124   2HB   ALA  19          2HB       ALA  19  -2.897  -3.423  -3.415
  125   3HB   ALA  19          3HB       ALA  19  -1.683  -4.033  -2.291
  126    H    ALA  20           H        ALA  20  -4.678  -4.811  -0.366
  127    HA   ALA  20           HA       ALA  20  -7.200  -4.220  -1.476
  128   1HB   ALA  20          1HB       ALA  20  -7.161  -6.387  -0.790
  129   2HB   ALA  20          2HB       ALA  20  -6.184  -6.035   0.638
  130   3HB   ALA  20          3HB       ALA  20  -7.910  -5.672   0.637
  131    H    ALA  21           H        ALA  21  -5.758  -3.449   1.665
  132    HA   ALA  21           HA       ALA  21  -8.018  -2.259   2.835
  133   1HB   ALA  21          1HB       ALA  21  -5.914  -2.973   4.009
  134   2HB   ALA  21          2HB       ALA  21  -5.156  -1.505   3.391
  135   3HB   ALA  21          3HB       ALA  21  -6.538  -1.389   4.482
  136    H    LYS  22           H        LYS  22  -5.385  -0.851   0.895
  137    HA   LYS  22           HA       LYS  22  -6.340   1.815   1.247
  138   1HB   LYS  22          1HB       LYS  22  -4.100   0.492  -0.115
  139   2HB   LYS  22          2HB       LYS  22  -4.688   1.942  -0.920
  140   1HG   LYS  22          1HG       LYS  22  -3.084   2.805   0.475
  141   2HG   LYS  22          2HG       LYS  22  -4.542   2.983   1.454
  142   1HD   LYS  22          1HD       LYS  22  -3.895   1.419   2.956
  143   2HD   LYS  22          2HD       LYS  22  -3.094   0.428   1.737
  144   1HE   LYS  22          2HE       LYS  22  -1.616   1.544   3.488
  145   2HE   LYS  22          1HE       LYS  22  -1.146   1.724   1.799
  146   1HZ   LYS  22          1HZ       LYS  22  -2.129   3.922   1.777
  147   2HZ   LYS  22          2HZ       LYS  22  -0.981   3.813   3.017
  148   3HZ   LYS  22          3HZ       LYS  22  -2.633   3.751   3.386
  149    H    LYS  23           H        LYS  23  -6.645  -0.690  -1.200
  150    HA   LYS  23           HA       LYS  23  -8.062   0.824  -3.106
  151   1HB   LYS  23          1HB       LYS  23  -7.102  -1.520  -3.390
  152   2HB   LYS  23          2HB       LYS  23  -8.520  -2.101  -2.530
  153   1HG   LYS  23          1HG       LYS  23  -9.423  -0.384  -4.589
  154   2HG   LYS  23          2HG       LYS  23  -8.240  -1.490  -5.289
  155   1HD   LYS  23          1HD       LYS  23 -10.027  -2.859  -5.473
  156   2HD   LYS  23          2HD       LYS  23  -9.671  -3.207  -3.779
  157   1HE   LYS  23          2HE       LYS  23 -11.931  -2.733  -3.714
  158   2HE   LYS  23          1HE       LYS  23 -11.209  -1.181  -3.294
  159   1HZ   LYS  23          1HZ       LYS  23 -11.613  -0.353  -5.448
  160   2HZ   LYS  23          2HZ       LYS  23 -13.053  -1.121  -4.984
  161   3HZ   LYS  23          3HZ       LYS  23 -11.992  -1.887  -6.069
  162    H    THR  24           H        THR  24  -9.129  -1.171  -0.395
  163    HA   THR  24           HA       THR  24 -11.878  -0.803  -0.700
  164    HB   THR  24           HB       THR  24 -10.092  -1.940   1.273
  165    HG1  THR  24           1HG      THR  24 -12.848  -2.334   0.624
  166   1HG2  THR  24          1HG2      THR  24 -10.696  -0.532   2.976
  167   2HG2  THR  24          2HG2      THR  24 -11.982  -1.735   3.097
  168   3HG2  THR  24          3HG2      THR  24 -12.286  -0.196   2.289
  169    H    ALA  25           H        ALA  25  -9.451   1.166   0.958
  170    HA   ALA  25           HA       ALA  25 -11.152   3.022   2.163
  171   1HB   ALA  25          1HB       ALA  25  -8.354   3.228   1.103
  172   2HB   ALA  25          2HB       ALA  25  -9.165   4.607   1.838
  173   3HB   ALA  25          3HB       ALA  25  -8.900   3.140   2.778
  174    H    ALA  26           H        ALA  26  -9.587   3.190  -1.031
  175    HA   ALA  26           HA       ALA  26 -10.920   5.537  -1.882
  176   1HB   ALA  26          1HB       ALA  26 -10.335   4.247  -4.211
  177   2HB   ALA  26          2HB       ALA  26  -9.209   5.256  -3.305
  178   3HB   ALA  26          3HB       ALA  26  -9.191   3.506  -3.091
  179    H    ASP  27           H        ASP  27 -11.629   2.125  -2.192
  180    HA   ASP  27           HA       ASP  27 -13.850   2.186  -3.870
  181   1HB   ASP  27          1HB       ASP  27 -12.604   0.168  -2.977
  182   2HB   ASP  27          2HB       ASP  27 -13.510   0.364  -1.486
  183    H    ALA  28           H        ALA  28 -13.718   2.315  -0.329
  184    HA   ALA  28           HA       ALA  28 -16.491   2.600   0.090
  185   1HB   ALA  28          1HB       ALA  28 -14.501   3.765   1.988
  186   2HB   ALA  28          2HB       ALA  28 -15.988   2.880   2.325
  187   3HB   ALA  28          3HB       ALA  28 -14.561   2.019   1.744
  188    H    ALA  29           H        ALA  29 -13.965   4.915  -0.611
  189    HA   ALA  29           HA       ALA  29 -15.588   7.228  -0.091
  190   1HB   ALA  29          1HB       ALA  29 -13.702   8.402  -0.413
  191   2HB   ALA  29          2HB       ALA  29 -12.903   6.830  -0.385
  192   3HB   ALA  29          3HB       ALA  29 -13.331   7.574  -1.926
  193    H    ALA  30           H        ALA  30 -14.900   5.164  -2.806
  194    HA   ALA  30           HA       ALA  30 -15.983   6.856  -4.831
  195   1HB   ALA  30          1HB       ALA  30 -14.501   5.268  -5.649
  196   2HB   ALA  30          2HB       ALA  30 -15.214   3.964  -4.701
  197   3HB   ALA  30          3HB       ALA  30 -16.072   4.606  -6.102
  198    H    ALA  31           H        ALA  31 -17.264   4.302  -2.774
  199    HA   ALA  31           HA       ALA  31 -19.864   4.424  -4.066
  200   1HB   ALA  31          1HB       ALA  31 -20.381   2.811  -2.057
  201   2HB   ALA  31          2HB       ALA  31 -19.466   2.249  -3.457
  202   3HB   ALA  31          3HB       ALA  31 -18.624   2.705  -1.976
  203    H    ALA  32           H        ALA  32 -18.399   6.469  -2.128
  204    HA   ALA  32           HA       ALA  32 -20.616   6.904  -0.272
  205   1HB   ALA  32          1HB       ALA  32 -19.091   8.653   0.701
  206   2HB   ALA  32          2HB       ALA  32 -18.504   6.992   0.807
  207   3HB   ALA  32          3HB       ALA  32 -17.854   8.085  -0.419
  208    H    ALA  33           H        ALA  33 -21.829   7.415  -2.348
  209    HA   ALA  33           HA       ALA  33 -21.361   9.960  -3.584
  210   1HB   ALA  33          1HB       ALA  33 -23.883   8.313  -3.686
  211   2HB   ALA  33          2HB       ALA  33 -23.336   9.523  -4.846
  212   3HB   ALA  33          3HB       ALA  33 -22.471   7.995  -4.695
  213    H    ALA  34           H        ALA  34 -23.466   8.685  -1.090
  214    HA   ALA  34           HA       ALA  34 -23.924  11.389  -0.113
  215   1HB   ALA  34          1HB       ALA  34 -26.327   9.643  -0.214
  216   2HB   ALA  34          2HB       ALA  34 -26.203  11.402  -0.276
  217   3HB   ALA  34          3HB       ALA  34 -25.825  10.438  -1.704
  218    H    ALA  35           H        ALA  35 -22.318  10.333   1.349
  219    HA   ALA  35           HA       ALA  35 -23.292   8.230   3.085
  220   1HB   ALA  35          1HB       ALA  35 -20.726   9.684   2.724
  221   2HB   ALA  35          2HB       ALA  35 -21.038   8.925   4.285
  222   3HB   ALA  35          3HB       ALA  35 -21.043   7.953   2.814
  Start of MODEL    5
    1   1H    GLY   1          1H        GLY   1  13.050 -15.674 -13.322
    2   2H    GLY   1          2H        GLY   1  13.118 -15.852 -11.638
    3   3H    GLY   1          3H        GLY   1  14.399 -15.111 -12.463
    4   1HA   GLY   1          2HA       GLY   1  12.997 -13.493 -11.314
    5   2HA   GLY   1          1HA       GLY   1  13.040 -13.251 -13.055
    6    H    SER   2           H        SER   2  11.114 -12.718 -13.838
    7    HA   SER   2           HA       SER   2   8.698 -13.252 -12.413
    8   1HB   SER   2          1HB       SER   2   8.296 -12.483 -15.186
    9   2HB   SER   2          2HB       SER   2   7.912 -11.592 -13.712
   10    HG   SER   2           HG       SER   2   9.474 -10.339 -14.362
   11    H    MET   3           H        MET   3   8.652 -15.494 -12.250
   12    HA   MET   3           HA       MET   3   7.252 -16.779 -14.411
   13   1HB   MET   3          1HB       MET   3   9.787 -17.095 -14.831
   14   2HB   MET   3          2HB       MET   3   9.744 -18.167 -13.440
   15   1HG   MET   3          1HG       MET   3   7.788 -18.605 -15.635
   16   2HG   MET   3          2HG       MET   3   9.467 -19.078 -15.883
   17   1HE   MET   3          1HE       MET   3   7.600 -22.089 -15.721
   18   2HE   MET   3          2HE       MET   3   6.319 -21.470 -14.677
   19   3HE   MET   3          3HE       MET   3   6.879 -20.515 -16.052
   20    H    ASN   4           H        ASN   4   9.006 -17.286 -11.373
   21    HA   ASN   4           HA       ASN   4   6.830 -19.032 -10.474
   22   1HB   ASN   4          1HB       ASN   4   8.597 -19.352  -8.507
   23   2HB   ASN   4          2HB       ASN   4   8.685 -20.286  -9.992
   24   1HD2  ASN   4          1HD2      ASN   4  10.875 -20.650  -9.698
   25   2HD2  ASN   4          2HD2      ASN   4  12.060 -19.412  -9.961
   26    H    ALA   5           H        ALA   5   5.320 -18.123  -9.317
   27    HA   ALA   5           HA       ALA   5   5.438 -15.520  -8.303
   28   1HB   ALA   5          1HB       ALA   5   3.404 -16.513  -6.881
   29   2HB   ALA   5          2HB       ALA   5   3.276 -16.085  -8.588
   30   3HB   ALA   5          3HB       ALA   5   3.536 -17.765  -8.117
   31    HA   PRO   6           HA       PRO   6   5.830 -17.685  -3.825
   32   1HB   PRO   6          1HB       PRO   6   7.669 -19.825  -4.796
   33   2HB   PRO   6          2HB       PRO   6   6.531 -19.849  -3.447
   34   1HG   PRO   6          1HG       PRO   6   5.929 -21.072  -5.713
   35   2HG   PRO   6          2HG       PRO   6   4.695 -20.146  -4.834
   36   1HD   PRO   6          1HD       PRO   6   6.186 -19.438  -7.314
   37   2HD   PRO   6          2HD       PRO   6   4.516 -19.070  -6.854
   38    H    ALA   7           H        ALA   7   8.438 -17.829  -6.213
   39    HA   ALA   7           HA       ALA   7  10.546 -17.288  -4.433
   40   1HB   ALA   7          1HB       ALA   7  10.864 -16.406  -7.226
   41   2HB   ALA   7          2HB       ALA   7  11.896 -17.439  -6.234
   42   3HB   ALA   7          3HB       ALA   7  10.441 -18.102  -6.980
   43    H    ARG   8           H        ARG   8   8.178 -15.250  -5.749
   44    HA   ARG   8           HA       ARG   8   9.707 -12.884  -4.882
   45   1HB   ARG   8          1HB       ARG   8   7.543 -12.344  -6.782
   46   2HB   ARG   8          2HB       ARG   8   9.198 -11.754  -6.766
   47   1HG   ARG   8          1HG       ARG   8   9.570 -14.340  -7.508
   48   2HG   ARG   8          2HG       ARG   8   8.005 -13.984  -8.242
   49   1HD   ARG   8          1HD       ARG   8  10.425 -12.219  -8.555
   50   2HD   ARG   8          2HD       ARG   8  10.019 -13.514  -9.680
   51    HE   ARG   8           HE       ARG   8   7.837 -12.268  -9.971
   52   1HH1  ARG   8          2HH1      ARG   8  10.876 -10.680  -9.236
   53   2HH1  ARG   8          1HH1      ARG   8  10.348  -9.120  -9.801
   54   1HH2  ARG   8          2HH2      ARG   8   7.139 -10.227 -10.728
   55   2HH2  ARG   8          1HH2      ARG   8   8.226  -8.868 -10.672
   56    H    ALA   9           H        ALA   9   7.362 -14.845  -3.933
   57    HA   ALA   9           HA       ALA   9   5.476 -12.739  -3.124
   58   1HB   ALA   9          1HB       ALA   9   4.536 -15.386  -2.541
   59   2HB   ALA   9          2HB       ALA   9   3.841 -14.159  -3.601
   60   3HB   ALA   9          3HB       ALA   9   5.053 -15.279  -4.223
   61    H    ALA  10           H        ALA  10   8.113 -13.592  -1.833
   62    HA   ALA  10           HA       ALA  10   7.579 -15.052   0.508
   63   1HB   ALA  10          1HB       ALA  10   9.827 -14.784  -0.335
   64   2HB   ALA  10          2HB       ALA  10   9.762 -13.049  -0.027
   65   3HB   ALA  10          3HB       ALA  10   9.724 -14.185   1.321
   66    H    ALA  11           H        ALA  11   7.708 -11.534  -0.030
   67    HA   ALA  11           HA       ALA  11   6.486 -11.187   2.640
   68   1HB   ALA  11          1HB       ALA  11   7.479  -9.038   2.770
   69   2HB   ALA  11          2HB       ALA  11   8.741 -10.128   2.197
   70   3HB   ALA  11          3HB       ALA  11   7.917  -9.058   1.062
   71    H    LYS  12           H        LYS  12   5.435 -11.628  -0.260
   72    HA   LYS  12           HA       LYS  12   4.169  -9.312  -1.173
   73   1HB   LYS  12          1HB       LYS  12   4.427 -11.877  -2.078
   74   2HB   LYS  12          2HB       LYS  12   2.714 -11.809  -1.682
   75   1HG   LYS  12          1HG       LYS  12   3.724  -9.509  -3.196
   76   2HG   LYS  12          2HG       LYS  12   3.778 -11.055  -4.047
   77   1HD   LYS  12          1HD       LYS  12   1.304 -10.163  -2.605
   78   2HD   LYS  12          2HD       LYS  12   1.649  -9.619  -4.247
   79   1HE   LYS  12          2HE       LYS  12   1.864 -12.019  -4.910
   80   2HE   LYS  12          1HE       LYS  12   1.303 -12.460  -3.298
   81   1HZ   LYS  12          1HZ       LYS  12  -0.558 -12.498  -4.736
   82   2HZ   LYS  12          2HZ       LYS  12  -0.195 -10.976  -5.384
   83   3HZ   LYS  12          3HZ       LYS  12  -0.722 -11.107  -3.772
   84    H    THR  13           H        THR  13   2.875 -11.938   0.826
   85    HA   THR  13           HA       THR  13   0.255 -11.271   1.003
   86    HB   THR  13           HB       THR  13   1.357 -12.082   3.592
   87    HG1  THR  13           1HG      THR  13   2.885 -13.286   2.723
   88   1HG2  THR  13          1HG2      THR  13  -0.626 -13.092   3.613
   89   2HG2  THR  13          2HG2      THR  13  -0.137 -14.097   2.248
   90   3HG2  THR  13          3HG2      THR  13  -0.924 -12.544   1.963
   91    H    ALA  14           H        ALA  14   2.858  -9.744   2.851
   92    HA   ALA  14           HA       ALA  14   1.231  -8.323   4.666
   93   1HB   ALA  14          1HB       ALA  14   3.154  -7.389   5.408
   94   2HB   ALA  14          2HB       ALA  14   3.887  -8.662   4.430
   95   3HB   ALA  14          3HB       ALA  14   3.736  -7.030   3.781
   96    H    ALA  15           H        ALA  15   2.824  -7.213   1.695
   97    HA   ALA  15           HA       ALA  15   1.454  -4.749   1.536
   98   1HB   ALA  15          1HB       ALA  15   3.400  -4.773   0.304
   99   2HB   ALA  15          2HB       ALA  15   3.073  -6.365  -0.383
  100   3HB   ALA  15          3HB       ALA  15   2.181  -4.955  -0.957
  101    H    ASP  16           H        ASP  16   0.510  -7.941   0.745
  102    HA   ASP  16           HA       ASP  16  -1.375  -7.400  -1.314
  103   1HB   ASP  16          1HB       ASP  16  -0.319  -9.672  -0.313
  104   2HB   ASP  16          2HB       ASP  16  -1.867  -9.681   0.520
  105    H    ALA  17           H        ALA  17  -1.598  -7.738   2.191
  106    HA   ALA  17           HA       ALA  17  -4.382  -7.426   2.427
  107   1HB   ALA  17          1HB       ALA  17  -2.108  -7.549   4.196
  108   2HB   ALA  17          2HB       ALA  17  -3.262  -6.331   4.738
  109   3HB   ALA  17          3HB       ALA  17  -3.786  -7.998   4.494
  110    H    LEU  18           H        LEU  18  -1.731  -5.113   2.332
  111    HA   LEU  18           HA       LEU  18  -3.289  -2.834   2.993
  112   1HB   LEU  18          1HB       LEU  18  -0.630  -3.114   1.599
  113   2HB   LEU  18          2HB       LEU  18  -1.343  -1.567   2.016
  114    HG   LEU  18           HG       LEU  18  -0.449  -3.718   3.931
  115   1HD1  LEU  18          1HD1      LEU  18   0.511  -0.888   3.824
  116   2HD1  LEU  18          2HD1      LEU  18   1.297  -2.312   4.506
  117   3HD1  LEU  18          3HD1      LEU  18   1.198  -2.112   2.757
  118   1HD2  LEU  18          1HD2      LEU  18  -1.421  -2.623   5.676
  119   2HD2  LEU  18          2HD2      LEU  18  -1.367  -1.054   4.871
  120   3HD2  LEU  18          3HD2      LEU  18  -2.597  -2.237   4.422
  121    H    ALA  19           H        ALA  19  -2.193  -4.233  -0.068
  122    HA   ALA  19           HA       ALA  19  -3.163  -2.316  -1.820
  123   1HB   ALA  19          1HB       ALA  19  -1.949  -3.806  -2.998
  124   2HB   ALA  19          2HB       ALA  19  -2.455  -5.169  -2.000
  125   3HB   ALA  19          3HB       ALA  19  -3.518  -4.564  -3.271
  126    H    ALA  20           H        ALA  20  -4.845  -5.068  -0.367
  127    HA   ALA  20           HA       ALA  20  -7.308  -4.561  -1.741
  128   1HB   ALA  20          1HB       ALA  20  -8.021  -6.095   0.393
  129   2HB   ALA  20          2HB       ALA  20  -7.407  -6.719  -1.139
  130   3HB   ALA  20          3HB       ALA  20  -6.312  -6.493   0.224
  131    H    ALA  21           H        ALA  21  -6.104  -3.911   1.535
  132    HA   ALA  21           HA       ALA  21  -8.512  -2.896   2.581
  133   1HB   ALA  21          1HB       ALA  21  -6.717  -3.630   4.022
  134   2HB   ALA  21          2HB       ALA  21  -5.673  -2.341   3.419
  135   3HB   ALA  21          3HB       ALA  21  -7.110  -1.944   4.361
  136    H    LYS  22           H        LYS  22  -5.777  -1.274   1.001
  137    HA   LYS  22           HA       LYS  22  -6.798   1.346   1.476
  138   1HB   LYS  22          1HB       LYS  22  -4.506   0.157   0.063
  139   2HB   LYS  22          2HB       LYS  22  -5.092   1.669  -0.619
  140   1HG   LYS  22          1HG       LYS  22  -3.520   2.414   0.876
  141   2HG   LYS  22          2HG       LYS  22  -4.995   2.495   1.846
  142   1HD   LYS  22          1HD       LYS  22  -4.398   0.144   2.637
  143   2HD   LYS  22          2HD       LYS  22  -2.807   0.437   1.934
  144   1HE   LYS  22          2HE       LYS  22  -4.109   2.226   3.978
  145   2HE   LYS  22          1HE       LYS  22  -2.967   0.941   4.374
  146   1HZ   LYS  22          1HZ       LYS  22  -1.694   2.880   4.253
  147   2HZ   LYS  22          2HZ       LYS  22  -2.476   3.430   2.853
  148   3HZ   LYS  22          3HZ       LYS  22  -1.414   2.111   2.762
  149    H    LYS  23           H        LYS  23  -7.078  -1.029  -1.051
  150    HA   LYS  23           HA       LYS  23  -8.248   0.560  -3.045
  151   1HB   LYS  23          1HB       LYS  23  -7.440  -1.938  -3.083
  152   2HB   LYS  23          2HB       LYS  23  -9.107  -2.279  -2.630
  153   1HG   LYS  23          1HG       LYS  23  -9.136  -0.426  -4.767
  154   2HG   LYS  23          2HG       LYS  23  -8.052  -1.749  -5.195
  155   1HD   LYS  23          1HD       LYS  23  -9.742  -3.344  -5.038
  156   2HD   LYS  23          2HD       LYS  23 -10.759  -2.299  -4.043
  157   1HE   LYS  23          2HE       LYS  23 -10.066  -1.550  -6.863
  158   2HE   LYS  23          1HE       LYS  23 -11.393  -2.659  -6.523
  159   1HZ   LYS  23          1HZ       LYS  23 -12.376  -0.561  -6.619
  160   2HZ   LYS  23          2HZ       LYS  23 -11.135   0.183  -5.738
  161   3HZ   LYS  23          3HZ       LYS  23 -12.230  -0.857  -4.958
  162    H    THR  24           H        THR  24  -9.725  -1.407  -0.496
  163    HA   THR  24           HA       THR  24 -12.376  -0.663  -1.072
  164    HB   THR  24           HB       THR  24 -11.080  -2.321   0.836
  165    HG1  THR  24           1HG      THR  24 -13.729  -1.937  -0.105
  166   1HG2  THR  24          1HG2      THR  24 -13.151  -0.494   2.063
  167   2HG2  THR  24          2HG2      THR  24 -11.462  -0.643   2.550
  168   3HG2  THR  24          3HG2      THR  24 -12.574  -1.992   2.787
  169    H    ALA  25           H        ALA  25  -9.921   0.850   0.977
  170    HA   ALA  25           HA       ALA  25 -11.556   2.779   2.183
  171   1HB   ALA  25          1HB       ALA  25  -9.636   3.679   2.969
  172   2HB   ALA  25          2HB       ALA  25  -8.932   2.186   2.349
  173   3HB   ALA  25          3HB       ALA  25  -8.856   3.661   1.386
  174    H    ALA  26           H        ALA  26  -9.597   3.026  -0.774
  175    HA   ALA  26           HA       ALA  26 -10.580   5.506  -1.646
  176   1HB   ALA  26          1HB       ALA  26  -8.564   4.487  -2.570
  177   2HB   ALA  26          2HB       ALA  26  -9.534   3.203  -3.292
  178   3HB   ALA  26          3HB       ALA  26  -9.716   4.864  -3.852
  179    H    ASP  27           H        ASP  27 -11.776   2.244  -2.052
  180    HA   ASP  27           HA       ASP  27 -13.769   2.622  -3.946
  181   1HB   ASP  27          1HB       ASP  27 -12.909   0.588  -2.212
  182   2HB   ASP  27          2HB       ASP  27 -14.610   0.819  -1.847
  183    H    ALA  28           H        ALA  28 -14.006   2.778  -0.406
  184    HA   ALA  28           HA       ALA  28 -16.719   3.597  -0.334
  185   1HB   ALA  28          1HB       ALA  28 -14.497   3.420   1.624
  186   2HB   ALA  28          2HB       ALA  28 -15.885   4.423   2.046
  187   3HB   ALA  28          3HB       ALA  28 -16.112   2.716   1.676
  188    H    ALA  29           H        ALA  29 -13.678   5.351  -0.429
  189    HA   ALA  29           HA       ALA  29 -14.735   7.913   0.160
  190   1HB   ALA  29          1HB       ALA  29 -12.258   7.023   0.078
  191   2HB   ALA  29          2HB       ALA  29 -12.333   7.642  -1.574
  192   3HB   ALA  29          3HB       ALA  29 -12.631   8.723  -0.211
  193    H    ALA  30           H        ALA  30 -14.181   6.166  -2.863
  194    HA   ALA  30           HA       ALA  30 -14.859   8.297  -4.597
  195   1HB   ALA  30          1HB       ALA  30 -14.774   5.318  -4.951
  196   2HB   ALA  30          2HB       ALA  30 -15.284   6.396  -6.249
  197   3HB   ALA  30          3HB       ALA  30 -13.660   6.535  -5.574
  198    H    ALA  31           H        ALA  31 -16.753   5.863  -2.934
  199    HA   ALA  31           HA       ALA  31 -19.146   6.384  -4.419
  200   1HB   ALA  31          1HB       ALA  31 -18.530   4.749  -1.989
  201   2HB   ALA  31          2HB       ALA  31 -20.185   4.975  -2.558
  202   3HB   ALA  31          3HB       ALA  31 -18.991   4.203  -3.603
  203    H    ALA  32           H        ALA  32 -17.574   8.110  -2.140
  204    HA   ALA  32           HA       ALA  32 -19.911   9.081  -0.705
  205   1HB   ALA  32          1HB       ALA  32 -17.748  10.701  -0.039
  206   2HB   ALA  32          2HB       ALA  32 -18.368   9.331   0.880
  207   3HB   ALA  32          3HB       ALA  32 -17.052   9.097  -0.273
  208    H    ALA  33           H        ALA  33 -20.174   9.523  -3.381
  209    HA   ALA  33           HA       ALA  33 -19.256  12.141  -4.138
  210   1HB   ALA  33          1HB       ALA  33 -21.165  10.176  -5.380
  211   2HB   ALA  33          2HB       ALA  33 -20.852  11.767  -6.076
  212   3HB   ALA  33          3HB       ALA  33 -19.537  10.603  -5.907
  213    H    ALA  34           H        ALA  34 -22.551  10.836  -3.835
  214    HA   ALA  34           HA       ALA  34 -23.375  13.377  -2.601
  215   1HB   ALA  34          1HB       ALA  34 -24.266  13.590  -4.748
  216   2HB   ALA  34          2HB       ALA  34 -24.663  11.877  -4.859
  217   3HB   ALA  34          3HB       ALA  34 -25.611  12.935  -3.813
  218    H    ALA  35           H        ALA  35 -22.624  10.692  -1.574
  219    HA   ALA  35           HA       ALA  35 -25.105  10.085  -0.134
  220   1HB   ALA  35          1HB       ALA  35 -23.743   7.654  -0.406
  221   2HB   ALA  35          2HB       ALA  35 -25.267   8.118  -1.163
  222   3HB   ALA  35          3HB       ALA  35 -23.742   8.384  -2.010
  Start of MODEL    6
    1   1H    GLY   1          1H        GLY   1  19.416 -17.171  -2.035
    2   2H    GLY   1          2H        GLY   1  17.825 -17.728  -2.248
    3   3H    GLY   1          3H        GLY   1  18.107 -16.119  -1.786
    4   1HA   GLY   1          2HA       GLY   1  19.393 -15.911  -3.960
    5   2HA   GLY   1          1HA       GLY   1  18.566 -17.398  -4.404
    6    H    SER   2           H        SER   2  18.280 -14.933  -5.751
    7    HA   SER   2           HA       SER   2  15.837 -13.687  -4.834
    8   1HB   SER   2          1HB       SER   2  16.321 -12.560  -7.258
    9   2HB   SER   2          2HB       SER   2  17.075 -12.018  -5.757
   10    HG   SER   2           HG       SER   2  18.133 -13.678  -7.786
   11    H    MET   3           H        MET   3  16.164 -16.548  -6.127
   12    HA   MET   3           HA       MET   3  14.046 -16.216  -8.141
   13   1HB   MET   3          1HB       MET   3  16.330 -17.286  -8.730
   14   2HB   MET   3          2HB       MET   3  15.734 -18.686  -7.847
   15   1HG   MET   3          1HG       MET   3  13.700 -17.907  -9.637
   16   2HG   MET   3          2HG       MET   3  15.219 -17.899 -10.531
   17   1HE   MET   3          1HE       MET   3  15.831 -21.337 -11.430
   18   2HE   MET   3          2HE       MET   3  14.655 -20.242 -12.163
   19   3HE   MET   3          3HE       MET   3  16.182 -19.610 -11.540
   20    H    ASN   4           H        ASN   4  14.415 -17.005  -4.989
   21    HA   ASN   4           HA       ASN   4  12.827 -19.392  -4.878
   22   1HB   ASN   4          1HB       ASN   4  14.552 -18.559  -3.151
   23   2HB   ASN   4          2HB       ASN   4  13.256 -17.542  -2.544
   24   1HD2  ASN   4          1HD2      ASN   4  13.630 -18.800  -0.583
   25   2HD2  ASN   4          2HD2      ASN   4  12.844 -20.329  -0.405
   26    H    ALA   5           H        ALA   5  10.706 -19.633  -4.401
   27    HA   ALA   5           HA       ALA   5   9.030 -17.398  -5.100
   28   1HB   ALA   5          1HB       ALA   5   8.835 -20.173  -5.357
   29   2HB   ALA   5          2HB       ALA   5   7.507 -19.682  -4.306
   30   3HB   ALA   5          3HB       ALA   5   7.687 -18.952  -5.902
   31    HA   PRO   6           HA       PRO   6   7.179 -18.093  -0.727
   32   1HB   PRO   6          1HB       PRO   6   8.687 -19.396   1.126
   33   2HB   PRO   6          2HB       PRO   6   7.494 -20.197   0.098
   34   1HG   PRO   6          1HG       PRO   6  10.458 -20.101  -0.158
   35   2HG   PRO   6          2HG       PRO   6   9.342 -21.430  -0.506
   36   1HD   PRO   6          1HD       PRO   6  10.457 -19.827  -2.423
   37   2HD   PRO   6          2HD       PRO   6   8.916 -20.671  -2.624
   38    H    ALA   7           H        ALA   7  10.262 -17.112  -1.555
   39    HA   ALA   7           HA       ALA   7  10.882 -15.609   0.809
   40   1HB   ALA   7          1HB       ALA   7  12.839 -15.888  -0.299
   41   2HB   ALA   7          2HB       ALA   7  12.059 -15.944  -1.880
   42   3HB   ALA   7          3HB       ALA   7  12.351 -14.391  -1.092
   43    H    ARG   8           H        ARG   8   8.781 -15.282  -1.800
   44    HA   ARG   8           HA       ARG   8   8.538 -12.370  -1.474
   45   1HB   ARG   8          1HB       ARG   8   7.147 -14.069  -3.543
   46   2HB   ARG   8          2HB       ARG   8   7.410 -12.329  -3.567
   47   1HG   ARG   8          1HG       ARG   8   9.859 -12.787  -3.746
   48   2HG   ARG   8          2HG       ARG   8   9.461 -14.495  -3.938
   49   1HD   ARG   8          1HD       ARG   8   7.856 -13.547  -5.809
   50   2HD   ARG   8          2HD       ARG   8   9.007 -12.212  -5.790
   51    HE   ARG   8           HE       ARG   8   9.405 -14.811  -6.895
   52   1HH1  ARG   8          2HH1      ARG   8  11.046 -12.167  -5.313
   53   2HH1  ARG   8          1HH1      ARG   8  12.601 -12.525  -5.995
   54   1HH2  ARG   8          2HH2      ARG   8  11.445 -15.295  -7.833
   55   2HH2  ARG   8          1HH2      ARG   8  12.827 -14.315  -7.430
   56    H    ALA   9           H        ALA   9   7.336 -15.027  -0.077
   57    HA   ALA   9           HA       ALA   9   4.542 -14.824  -0.379
   58   1HB   ALA   9          1HB       ALA   9   6.180 -16.671   0.703
   59   2HB   ALA   9          2HB       ALA   9   5.534 -15.920   2.163
   60   3HB   ALA   9          3HB       ALA   9   4.438 -16.622   0.974
   61    H    ALA  10           H        ALA  10   6.776 -13.434   1.973
   62    HA   ALA  10           HA       ALA  10   4.953 -12.410   3.802
   63   1HB   ALA  10          1HB       ALA  10   6.771 -11.544   4.765
   64   2HB   ALA  10          2HB       ALA  10   7.688 -12.301   3.461
   65   3HB   ALA  10          3HB       ALA  10   7.187 -10.616   3.325
   66    H    ALA  11           H        ALA  11   6.375 -10.757   0.984
   67    HA   ALA  11           HA       ALA  11   4.834  -8.412   1.227
   68   1HB   ALA  11          1HB       ALA  11   5.991  -9.471  -1.340
   69   2HB   ALA  11          2HB       ALA  11   5.668  -7.795  -0.901
   70   3HB   ALA  11          3HB       ALA  11   6.957  -8.683  -0.093
   71    H    LYS  12           H        LYS  12   4.284 -11.441  -0.451
   72    HA   LYS  12           HA       LYS  12   2.025 -10.602  -1.945
   73   1HB   LYS  12          1HB       LYS  12   3.530 -12.610  -2.382
   74   2HB   LYS  12          2HB       LYS  12   2.653 -13.425  -1.096
   75   1HG   LYS  12          1HG       LYS  12   1.768 -14.057  -3.233
   76   2HG   LYS  12          2HG       LYS  12   0.569 -13.123  -2.339
   77   1HD   LYS  12          1HD       LYS  12   1.325 -11.102  -3.620
   78   2HD   LYS  12          2HD       LYS  12   2.306 -12.179  -4.613
   79   1HE   LYS  12          2HE       LYS  12   0.540 -12.793  -5.828
   80   2HE   LYS  12          1HE       LYS  12  -0.409 -13.143  -4.386
   81   1HZ   LYS  12          1HZ       LYS  12  -0.379 -10.772  -6.053
   82   2HZ   LYS  12          2HZ       LYS  12  -0.450 -10.473  -4.385
   83   3HZ   LYS  12          3HZ       LYS  12  -1.636 -11.433  -5.125
   84    H    THR  13           H        THR  13   2.419 -11.179   1.338
   85    HA   THR  13           HA       THR  13  -0.475 -11.544   1.649
   86    HB   THR  13           HB       THR  13   1.478 -11.928   3.899
   87    HG1  THR  13           1HG      THR  13   2.104 -13.297   2.133
   88   1HG2  THR  13          1HG2      THR  13  -1.369 -12.294   3.442
   89   2HG2  THR  13          2HG2      THR  13  -0.468 -12.244   4.957
   90   3HG2  THR  13          3HG2      THR  13  -0.594 -13.754   4.058
   91    H    ALA  14           H        ALA  14   2.280  -9.824   3.138
   92    HA   ALA  14           HA       ALA  14   0.617  -8.198   4.773
   93   1HB   ALA  14          1HB       ALA  14   3.522  -7.904   4.024
   94   2HB   ALA  14          2HB       ALA  14   2.696  -6.954   5.260
   95   3HB   ALA  14          3HB       ALA  14   2.871  -8.699   5.457
   96    H    ALA  15           H        ALA  15   2.811  -7.149   2.151
   97    HA   ALA  15           HA       ALA  15   1.627  -4.594   1.906
   98   1HB   ALA  15          1HB       ALA  15   3.208  -4.181   0.323
   99   2HB   ALA  15          2HB       ALA  15   3.940  -5.603   1.065
  100   3HB   ALA  15          3HB       ALA  15   3.025  -5.764  -0.434
  101    H    ASP  16           H        ASP  16   0.900  -7.676   0.528
  102    HA   ASP  16           HA       ASP  16  -0.660  -6.781  -1.678
  103   1HB   ASP  16          1HB       ASP  16   0.396  -9.097  -1.259
  104   2HB   ASP  16          2HB       ASP  16  -1.023  -9.425  -0.279
  105    H    ALA  17           H        ALA  17  -1.448  -7.883   1.603
  106    HA   ALA  17           HA       ALA  17  -4.245  -7.588   1.379
  107   1HB   ALA  17          1HB       ALA  17  -4.301  -8.312   3.502
  108   2HB   ALA  17          2HB       ALA  17  -2.571  -8.583   3.286
  109   3HB   ALA  17          3HB       ALA  17  -3.142  -7.097   4.044
  110    H    LEU  18           H        LEU  18  -1.662  -5.362   2.142
  111    HA   LEU  18           HA       LEU  18  -3.223  -3.224   3.097
  112   1HB   LEU  18          1HB       LEU  18  -0.558  -3.302   1.705
  113   2HB   LEU  18          2HB       LEU  18  -1.271  -1.816   2.294
  114    HG   LEU  18           HG       LEU  18  -0.245  -4.153   3.878
  115   1HD1  LEU  18          1HD1      LEU  18   1.520  -2.792   3.943
  116   2HD1  LEU  18          2HD1      LEU  18   0.603  -1.446   3.268
  117   3HD1  LEU  18          3HD1      LEU  18   0.557  -1.759   5.002
  118   1HD2  LEU  18          1HD2      LEU  18  -1.918  -1.877   4.945
  119   2HD2  LEU  18          2HD2      LEU  18  -2.470  -3.540   4.760
  120   3HD2  LEU  18          3HD2      LEU  18  -1.168  -3.165   5.888
  121    H    ALA  19           H        ALA  19  -2.205  -4.160  -0.150
  122    HA   ALA  19           HA       ALA  19  -3.205  -1.960  -1.555
  123   1HB   ALA  19          1HB       ALA  19  -3.507  -3.843  -3.398
  124   2HB   ALA  19          2HB       ALA  19  -1.915  -3.256  -2.915
  125   3HB   ALA  19          3HB       ALA  19  -2.538  -4.766  -2.249
  126    H    ALA  20           H        ALA  20  -4.767  -4.919  -0.456
  127    HA   ALA  20           HA       ALA  20  -7.274  -4.419  -1.717
  128   1HB   ALA  20          1HB       ALA  20  -6.457  -6.228   0.550
  129   2HB   ALA  20          2HB       ALA  20  -8.105  -6.148  -0.076
  130   3HB   ALA  20          3HB       ALA  20  -6.786  -6.665  -1.128
  131    H    ALA  21           H        ALA  21  -5.966  -3.813   1.513
  132    HA   ALA  21           HA       ALA  21  -8.317  -2.773   2.666
  133   1HB   ALA  21          1HB       ALA  21  -6.451  -1.505   4.084
  134   2HB   ALA  21          2HB       ALA  21  -6.799  -3.222   4.296
  135   3HB   ALA  21          3HB       ALA  21  -5.426  -2.715   3.311
  136    H    LYS  22           H        LYS  22  -5.688  -1.233   0.851
  137    HA   LYS  22           HA       LYS  22  -6.678   1.415   1.195
  138   1HB   LYS  22          1HB       LYS  22  -4.514   0.099  -0.296
  139   2HB   LYS  22          2HB       LYS  22  -5.158   1.540  -1.073
  140   1HG   LYS  22          1HG       LYS  22  -3.523   2.475   0.198
  141   2HG   LYS  22          2HG       LYS  22  -4.867   2.554   1.341
  142   1HD   LYS  22          1HD       LYS  22  -3.934   1.055   2.727
  143   2HD   LYS  22          2HD       LYS  22  -3.348   0.044   1.406
  144   1HE   LYS  22          2HE       LYS  22  -2.092   2.603   2.391
  145   2HE   LYS  22          1HE       LYS  22  -1.490   0.971   2.675
  146   1HZ   LYS  22          1HZ       LYS  22  -1.702   2.336   0.045
  147   2HZ   LYS  22          2HZ       LYS  22  -1.215   0.725   0.260
  148   3HZ   LYS  22          3HZ       LYS  22  -0.276   1.984   0.888
  149    H    LYS  23           H        LYS  23  -7.199  -1.145  -1.132
  150    HA   LYS  23           HA       LYS  23  -8.559   0.346  -3.101
  151   1HB   LYS  23          1HB       LYS  23  -7.728  -2.038  -3.312
  152   2HB   LYS  23          2HB       LYS  23  -9.108  -2.530  -2.344
  153   1HG   LYS  23          1HG       LYS  23  -9.617  -2.889  -4.651
  154   2HG   LYS  23          2HG       LYS  23 -10.603  -1.551  -4.063
  155   1HD   LYS  23          1HD       LYS  23  -8.225  -0.411  -5.024
  156   2HD   LYS  23          2HD       LYS  23  -8.713  -1.613  -6.223
  157   1HE   LYS  23          2HE       LYS  23 -10.663   0.369  -5.092
  158   2HE   LYS  23          1HE       LYS  23  -9.622   0.784  -6.451
  159   1HZ   LYS  23          1HZ       LYS  23 -11.968  -0.899  -6.380
  160   2HZ   LYS  23          2HZ       LYS  23 -10.667  -1.591  -7.216
  161   3HZ   LYS  23          3HZ       LYS  23 -11.263  -0.072  -7.682
  162    H    THR  24           H        THR  24  -9.670  -1.419  -0.255
  163    HA   THR  24           HA       THR  24 -12.370  -0.897  -0.375
  164    HB   THR  24           HB       THR  24 -10.529  -1.152   1.984
  165    HG1  THR  24           1HG      THR  24 -10.876  -3.279   1.796
  166   1HG2  THR  24          1HG2      THR  24 -13.440  -1.736   2.046
  167   2HG2  THR  24          2HG2      THR  24 -12.850  -0.094   2.307
  168   3HG2  THR  24          3HG2      THR  24 -12.338  -1.400   3.379
  169    H    ALA  25           H        ALA  25  -9.790   0.997   1.179
  170    HA   ALA  25           HA       ALA  25 -11.367   3.070   2.181
  171   1HB   ALA  25          1HB       ALA  25  -8.945   2.624   2.692
  172   2HB   ALA  25          2HB       ALA  25  -8.554   3.399   1.154
  173   3HB   ALA  25          3HB       ALA  25  -9.359   4.318   2.425
  174    H    ALA  26           H        ALA  26  -9.724   2.781  -0.948
  175    HA   ALA  26           HA       ALA  26 -10.560   5.277  -1.985
  176   1HB   ALA  26          1HB       ALA  26  -8.787   3.481  -2.828
  177   2HB   ALA  26          2HB       ALA  26 -10.141   3.019  -3.861
  178   3HB   ALA  26          3HB       ALA  26  -9.514   4.668  -3.913
  179    H    ASP  27           H        ASP  27 -11.919   2.042  -2.163
  180    HA   ASP  27           HA       ASP  27 -14.062   2.488  -3.875
  181   1HB   ASP  27          1HB       ASP  27 -13.101   0.346  -2.559
  182   2HB   ASP  27          2HB       ASP  27 -14.479   0.712  -1.533
  183    H    ALA  28           H        ALA  28 -13.971   2.634  -0.323
  184    HA   ALA  28           HA       ALA  28 -16.611   3.561   0.014
  185   1HB   ALA  28          1HB       ALA  28 -15.378   4.482   2.233
  186   2HB   ALA  28          2HB       ALA  28 -15.882   2.806   2.012
  187   3HB   ALA  28          3HB       ALA  28 -14.211   3.275   1.697
  188    H    ALA  29           H        ALA  29 -13.550   5.239  -0.496
  189    HA   ALA  29           HA       ALA  29 -14.412   7.841   0.143
  190   1HB   ALA  29          1HB       ALA  29 -12.332   7.179  -1.929
  191   2HB   ALA  29          2HB       ALA  29 -12.442   8.621  -0.917
  192   3HB   ALA  29          3HB       ALA  29 -12.036   7.064  -0.194
  193    H    ALA  30           H        ALA  30 -14.779   5.894  -2.719
  194    HA   ALA  30           HA       ALA  30 -15.663   8.004  -4.425
  195   1HB   ALA  30          1HB       ALA  30 -14.833   6.141  -5.561
  196   2HB   ALA  30          2HB       ALA  30 -15.782   5.010  -4.594
  197   3HB   ALA  30          3HB       ALA  30 -16.579   6.033  -5.788
  198    H    ALA  31           H        ALA  31 -17.243   5.716  -2.268
  199    HA   ALA  31           HA       ALA  31 -19.877   6.484  -3.148
  200   1HB   ALA  31          1HB       ALA  31 -18.920   4.643  -0.979
  201   2HB   ALA  31          2HB       ALA  31 -20.625   4.982  -1.272
  202   3HB   ALA  31          3HB       ALA  31 -19.649   4.213  -2.526
  203    H    ALA  32           H        ALA  32 -17.640   7.724  -1.052
  204    HA   ALA  32           HA       ALA  32 -19.520   8.854   0.848
  205   1HB   ALA  32          1HB       ALA  32 -17.488   8.242   1.844
  206   2HB   ALA  32          2HB       ALA  32 -16.535   8.985   0.558
  207   3HB   ALA  32          3HB       ALA  32 -17.405   9.999   1.709
  208    H    ALA  33           H        ALA  33 -20.109   9.609  -1.732
  209    HA   ALA  33           HA       ALA  33 -19.161  12.375  -1.981
  210   1HB   ALA  33          1HB       ALA  33 -21.030  11.491  -4.023
  211   2HB   ALA  33          2HB       ALA  33 -19.392  12.127  -4.188
  212   3HB   ALA  33          3HB       ALA  33 -19.644  10.410  -3.875
  213    H    ALA  34           H        ALA  34 -21.716  10.557  -0.773
  214    HA   ALA  34           HA       ALA  34 -23.210  12.877  -0.019
  215   1HB   ALA  34          1HB       ALA  34 -24.597  12.936  -1.772
  216   2HB   ALA  34          2HB       ALA  34 -24.020  11.384  -2.381
  217   3HB   ALA  34          3HB       ALA  34 -25.282  11.434  -1.150
  218    H    ALA  35           H        ALA  35 -23.028  12.196   2.077
  219    HA   ALA  35           HA       ALA  35 -24.631   9.908   2.859
  220   1HB   ALA  35          1HB       ALA  35 -22.695   8.661   2.689
  221   2HB   ALA  35          2HB       ALA  35 -21.659  10.009   3.159
  222   3HB   ALA  35          3HB       ALA  35 -22.636   9.184   4.371
  Start of MODEL    7
    1   1H    GLY   1          1H        GLY   1   0.999  -0.317  -5.174
    2   2H    GLY   1          2H        GLY   1   2.103  -1.125  -6.171
    3   3H    GLY   1          3H        GLY   1   1.969  -1.552  -4.533
    4   1HA   GLY   1          2HA       GLY   1  -0.014  -2.643  -4.815
    5   2HA   GLY   1          1HA       GLY   1  -0.381  -1.745  -6.282
    6    H    SER   2           H        SER   2  -0.753  -3.524  -7.567
    7    HA   SER   2           HA       SER   2   1.206  -5.645  -7.726
    8   1HB   SER   2          1HB       SER   2  -0.779  -5.746  -9.812
    9   2HB   SER   2          2HB       SER   2  -0.560  -6.830  -8.437
   10    HG   SER   2           HG       SER   2  -1.958  -5.659  -7.250
   11    H    MET   3           H        MET   3   2.796  -3.838  -8.357
   12    HA   MET   3           HA       MET   3   2.687  -3.107 -11.164
   13   1HB   MET   3          1HB       MET   3   3.447  -1.483  -9.451
   14   2HB   MET   3          2HB       MET   3   4.817  -2.530  -9.100
   15   1HG   MET   3          1HG       MET   3   5.729  -2.185 -11.272
   16   2HG   MET   3          2HG       MET   3   4.280  -1.334 -11.803
   17   1HE   MET   3          1HE       MET   3   3.786   1.435  -9.957
   18   2HE   MET   3          2HE       MET   3   4.755   2.067 -11.288
   19   3HE   MET   3          3HE       MET   3   3.668   0.705 -11.560
   20    H    ASN   4           H        ASN   4   4.533  -5.199  -9.019
   21    HA   ASN   4           HA       ASN   4   5.546  -6.637 -11.333
   22   1HB   ASN   4          1HB       ASN   4   7.155  -4.739 -10.188
   23   2HB   ASN   4          2HB       ASN   4   7.634  -6.192  -9.315
   24   1HD2  ASN   4          1HD2      ASN   4   8.613  -4.378 -11.682
   25   2HD2  ASN   4          2HD2      ASN   4   9.246  -5.547 -12.788
   26    H    ALA   5           H        ALA   5   6.523  -8.703 -10.746
   27    HA   ALA   5           HA       ALA   5   4.948 -10.022  -8.782
   28   1HB   ALA   5          1HB       ALA   5   5.985 -10.902 -11.032
   29   2HB   ALA   5          2HB       ALA   5   7.309 -11.380  -9.966
   30   3HB   ALA   5          3HB       ALA   5   5.679 -11.986  -9.676
   31    HA   PRO   6           HA       PRO   6   9.095 -10.676  -6.378
   32   1HB   PRO   6          1HB       PRO   6  11.145  -8.957  -6.916
   33   2HB   PRO   6          2HB       PRO   6  10.965 -10.530  -7.697
   34   1HG   PRO   6          1HG       PRO   6  10.222  -7.819  -8.711
   35   2HG   PRO   6          2HG       PRO   6  11.011  -9.161  -9.563
   36   1HD   PRO   6          1HD       PRO   6   8.387  -8.632  -9.845
   37   2HD   PRO   6          2HD       PRO   6   9.021 -10.282  -9.899
   38    H    ALA   7           H        ALA   7   8.093  -7.510  -7.397
   39    HA   ALA   7           HA       ALA   7   8.852  -6.082  -5.077
   40   1HB   ALA   7          1HB       ALA   7   7.217  -4.370  -5.902
   41   2HB   ALA   7          2HB       ALA   7   8.441  -4.850  -7.076
   42   3HB   ALA   7          3HB       ALA   7   6.800  -5.488  -7.201
   43    H    ARG   8           H        ARG   8   6.362  -8.293  -5.684
   44    HA   ARG   8           HA       ARG   8   5.014  -7.478  -3.198
   45   1HB   ARG   8          1HB       ARG   8   3.897  -8.464  -5.798
   46   2HB   ARG   8          2HB       ARG   8   3.023  -8.760  -4.300
   47   1HG   ARG   8          1HG       ARG   8   3.430  -6.158  -3.988
   48   2HG   ARG   8          2HG       ARG   8   3.506  -6.221  -5.751
   49   1HD   ARG   8          1HD       ARG   8   1.224  -6.779  -3.919
   50   2HD   ARG   8          2HD       ARG   8   1.262  -5.864  -5.425
   51    HE   ARG   8           HE       ARG   8   1.422  -8.036  -6.588
   52   1HH1  ARG   8          2HH1      ARG   8   0.177  -7.932  -3.323
   53   2HH1  ARG   8          1HH1      ARG   8  -0.691  -9.433  -3.452
   54   1HH2  ARG   8          2HH2      ARG   8   0.290 -10.016  -6.777
   55   2HH2  ARG   8          1HH2      ARG   8  -0.636 -10.609  -5.429
   56    H    ALA   9           H        ALA   9   7.234  -9.482  -4.011
   57    HA   ALA   9           HA       ALA   9   5.964 -11.967  -3.132
   58   1HB   ALA   9          1HB       ALA   9   7.299 -12.642  -4.817
   59   2HB   ALA   9          2HB       ALA   9   8.410 -11.285  -4.623
   60   3HB   ALA   9          3HB       ALA   9   8.524 -12.678  -3.548
   61    H    ALA  10           H        ALA  10   8.685  -9.856  -2.225
   62    HA   ALA  10           HA       ALA  10   9.313 -11.296   0.147
   63   1HB   ALA  10          1HB       ALA  10  10.330  -8.811   0.597
   64   2HB   ALA  10          2HB       ALA  10  11.141 -10.077  -0.325
   65   3HB   ALA  10          3HB       ALA  10  10.214  -8.832  -1.164
   66    H    ALA  11           H        ALA  11   7.134  -8.704  -0.618
   67    HA   ALA  11           HA       ALA  11   6.432  -8.386   2.215
   68   1HB   ALA  11          1HB       ALA  11   6.698  -6.230   1.594
   69   2HB   ALA  11          2HB       ALA  11   6.426  -6.576  -0.114
   70   3HB   ALA  11          3HB       ALA  11   5.054  -6.416   0.984
   71    H    LYS  12           H        LYS  12   5.659 -10.450   0.090
   72    HA   LYS  12           HA       LYS  12   3.401 -10.499  -1.169
   73   1HB   LYS  12          1HB       LYS  12   4.910 -12.456  -0.267
   74   2HB   LYS  12          2HB       LYS  12   3.572 -12.679   0.851
   75   1HG   LYS  12          1HG       LYS  12   2.794 -12.389  -1.961
   76   2HG   LYS  12          2HG       LYS  12   3.749 -13.827  -1.587
   77   1HD   LYS  12          1HD       LYS  12   1.481 -13.135   0.212
   78   2HD   LYS  12          2HD       LYS  12   1.112 -13.818  -1.374
   79   1HE   LYS  12          2HE       LYS  12   3.063 -15.492  -0.560
   80   2HE   LYS  12          1HE       LYS  12   2.346 -15.066   0.994
   81   1HZ   LYS  12          1HZ       LYS  12   0.771 -16.541   0.565
   82   2HZ   LYS  12          2HZ       LYS  12   1.364 -16.818  -1.000
   83   3HZ   LYS  12          3HZ       LYS  12   0.236 -15.579  -0.724
   84    H    THR  13           H        THR  13   2.968 -11.535   2.229
   85    HA   THR  13           HA       THR  13   0.183 -11.381   2.116
   86    HB   THR  13           HB       THR  13   1.156 -11.082   4.806
   87    HG1  THR  13           1HG      THR  13   2.749 -12.569   4.861
   88   1HG2  THR  13          1HG2      THR  13   0.257 -13.411   4.969
   89   2HG2  THR  13          2HG2      THR  13  -0.037 -13.359   3.230
   90   3HG2  THR  13          3HG2      THR  13  -0.879 -12.238   4.300
   91    H    ALA  14           H        ALA  14   2.599  -9.101   3.300
   92    HA   ALA  14           HA       ALA  14   0.783  -7.351   4.601
   93   1HB   ALA  14          1HB       ALA  14   3.170  -7.366   5.132
   94   2HB   ALA  14          2HB       ALA  14   3.540  -6.785   3.508
   95   3HB   ALA  14          3HB       ALA  14   2.645  -5.760   4.630
   96    H    ALA  15           H        ALA  15   2.460  -7.158   1.468
   97    HA   ALA  15           HA       ALA  15   1.119  -4.809   0.611
   98   1HB   ALA  15          1HB       ALA  15   2.831  -4.919  -0.804
   99   2HB   ALA  15          2HB       ALA  15   3.110  -6.621  -0.432
  100   3HB   ALA  15          3HB       ALA  15   1.946  -6.169  -1.679
  101    H    ASP  16           H        ASP  16   0.404  -8.204   0.450
  102    HA   ASP  16           HA       ASP  16  -1.617  -8.138  -1.524
  103   1HB   ASP  16          1HB       ASP  16  -0.372 -10.126  -0.084
  104   2HB   ASP  16          2HB       ASP  16  -1.969 -10.082   0.666
  105    H    ALA  17           H        ALA  17  -1.747  -8.024   2.000
  106    HA   ALA  17           HA       ALA  17  -4.555  -7.696   2.185
  107   1HB   ALA  17          1HB       ALA  17  -3.073  -8.524   4.011
  108   2HB   ALA  17          2HB       ALA  17  -2.491  -6.871   4.218
  109   3HB   ALA  17          3HB       ALA  17  -4.189  -7.252   4.509
  110    H    LEU  18           H        LEU  18  -1.850  -5.405   2.313
  111    HA   LEU  18           HA       LEU  18  -3.465  -3.151   2.874
  112   1HB   LEU  18          1HB       LEU  18  -0.677  -3.358   1.757
  113   2HB   LEU  18          2HB       LEU  18  -1.438  -1.848   2.223
  114    HG   LEU  18           HG       LEU  18  -1.152  -4.107   4.174
  115   1HD1  LEU  18          1HD1      LEU  18   1.067  -3.887   3.775
  116   2HD1  LEU  18          2HD1      LEU  18   0.914  -2.233   3.181
  117   3HD1  LEU  18          3HD1      LEU  18   0.859  -2.555   4.913
  118   1HD2  LEU  18          1HD2      LEU  18  -2.655  -2.048   4.521
  119   2HD2  LEU  18          2HD2      LEU  18  -1.544  -2.500   5.814
  120   3HD2  LEU  18          3HD2      LEU  18  -1.145  -1.163   4.735
  121    H    ALA  19           H        ALA  19  -2.422  -4.643  -0.140
  122    HA   ALA  19           HA       ALA  19  -3.114  -2.598  -1.913
  123   1HB   ALA  19          1HB       ALA  19  -3.882  -4.860  -3.258
  124   2HB   ALA  19          2HB       ALA  19  -2.238  -4.224  -3.189
  125   3HB   ALA  19          3HB       ALA  19  -2.741  -5.494  -2.073
  126    H    ALA  20           H        ALA  20  -5.100  -5.164  -0.500
  127    HA   ALA  20           HA       ALA  20  -7.523  -4.279  -1.701
  128   1HB   ALA  20          1HB       ALA  20  -8.333  -5.716   0.468
  129   2HB   ALA  20          2HB       ALA  20  -7.905  -6.406  -1.098
  130   3HB   ALA  20          3HB       ALA  20  -6.710  -6.353   0.199
  131    H    ALA  21           H        ALA  21  -5.974  -3.762   1.427
  132    HA   ALA  21           HA       ALA  21  -8.093  -2.468   2.721
  133   1HB   ALA  21          1HB       ALA  21  -5.127  -2.431   3.118
  134   2HB   ALA  21          2HB       ALA  21  -6.197  -1.441   4.111
  135   3HB   ALA  21          3HB       ALA  21  -6.373  -3.196   4.106
  136    H    LYS  22           H        LYS  22  -5.372  -1.083   0.863
  137    HA   LYS  22           HA       LYS  22  -6.199   1.599   1.301
  138   1HB   LYS  22          1HB       LYS  22  -4.093   0.201  -0.176
  139   2HB   LYS  22          2HB       LYS  22  -4.648   1.673  -0.966
  140   1HG   LYS  22          1HG       LYS  22  -2.932   2.446   0.361
  141   2HG   LYS  22          2HG       LYS  22  -4.353   2.737   1.368
  142   1HD   LYS  22          1HD       LYS  22  -3.919   0.596   2.531
  143   2HD   LYS  22          2HD       LYS  22  -2.440   0.420   1.586
  144   1HE   LYS  22          2HE       LYS  22  -2.032   1.340   3.845
  145   2HE   LYS  22          1HE       LYS  22  -1.526   2.428   2.555
  146   1HZ   LYS  22          1HZ       LYS  22  -2.963   3.235   4.609
  147   2HZ   LYS  22          2HZ       LYS  22  -4.235   2.777   3.583
  148   3HZ   LYS  22          3HZ       LYS  22  -3.106   3.937   3.071
  149    H    LYS  23           H        LYS  23  -6.704  -0.766  -1.252
  150    HA   LYS  23           HA       LYS  23  -7.953   0.923  -3.121
  151   1HB   LYS  23          1HB       LYS  23  -7.126  -1.425  -3.532
  152   2HB   LYS  23          2HB       LYS  23  -8.552  -2.007  -2.689
  153   1HG   LYS  23          1HG       LYS  23  -9.517  -0.221  -4.598
  154   2HG   LYS  23          2HG       LYS  23  -8.262  -1.153  -5.417
  155   1HD   LYS  23          1HD       LYS  23  -9.922  -2.645  -5.736
  156   2HD   LYS  23          2HD       LYS  23  -9.549  -3.121  -4.078
  157   1HE   LYS  23          2HE       LYS  23 -11.710  -2.735  -3.666
  158   2HE   LYS  23          1HE       LYS  23 -11.272  -1.027  -3.714
  159   1HZ   LYS  23          1HZ       LYS  23 -11.682  -1.333  -6.253
  160   2HZ   LYS  23          2HZ       LYS  23 -13.000  -1.110  -5.203
  161   3HZ   LYS  23          3HZ       LYS  23 -12.611  -2.664  -5.758
  162    H    THR  24           H        THR  24  -9.298  -1.164  -0.596
  163    HA   THR  24           HA       THR  24 -11.989  -0.647  -1.122
  164    HB   THR  24           HB       THR  24 -10.412  -1.823   1.086
  165    HG1  THR  24           1HG      THR  24 -12.791  -2.783  -0.132
  166   1HG2  THR  24          1HG2      THR  24 -12.666  -2.217   2.276
  167   2HG2  THR  24          2HG2      THR  24 -13.187  -0.773   1.406
  168   3HG2  THR  24          3HG2      THR  24 -11.823  -0.688   2.519
  169    H    ALA  25           H        ALA  25  -9.727   0.883   1.164
  170    HA   ALA  25           HA       ALA  25 -11.511   2.617   2.423
  171   1HB   ALA  25          1HB       ALA  25  -8.805   3.666   1.869
  172   2HB   ALA  25          2HB       ALA  25  -9.686   3.536   3.392
  173   3HB   ALA  25          3HB       ALA  25  -8.894   2.116   2.708
  174    H    ALA  26           H        ALA  26  -9.503   3.173  -0.449
  175    HA   ALA  26           HA       ALA  26 -10.516   5.744  -1.034
  176   1HB   ALA  26          1HB       ALA  26  -9.709   4.339  -3.412
  177   2HB   ALA  26          2HB       ALA  26  -8.941   5.704  -2.600
  178   3HB   ALA  26          3HB       ALA  26  -8.566   4.054  -2.099
  179    H    ASP  27           H        ASP  27 -11.441   2.522  -2.091
  180    HA   ASP  27           HA       ASP  27 -13.307   3.256  -4.062
  181   1HB   ASP  27          1HB       ASP  27 -12.199   0.951  -3.403
  182   2HB   ASP  27          2HB       ASP  27 -13.677   0.757  -2.466
  183    H    ALA  28           H        ALA  28 -13.706   2.510  -0.629
  184    HA   ALA  28           HA       ALA  28 -16.501   2.653  -0.516
  185   1HB   ALA  28          1HB       ALA  28 -14.905   1.805   1.263
  186   2HB   ALA  28          2HB       ALA  28 -14.676   3.491   1.727
  187   3HB   ALA  28          3HB       ALA  28 -16.277   2.756   1.831
  188    H    ALA  29           H        ALA  29 -14.050   5.164  -0.324
  189    HA   ALA  29           HA       ALA  29 -15.947   7.248   0.276
  190   1HB   ALA  29          1HB       ALA  29 -14.126   8.376   0.869
  191   2HB   ALA  29          2HB       ALA  29 -13.166   6.967   0.420
  192   3HB   ALA  29          3HB       ALA  29 -13.460   8.242  -0.759
  193    H    ALA  30           H        ALA  30 -14.640   5.762  -2.547
  194    HA   ALA  30           HA       ALA  30 -15.229   7.929  -4.347
  195   1HB   ALA  30          1HB       ALA  30 -14.735   5.064  -5.119
  196   2HB   ALA  30          2HB       ALA  30 -14.470   6.517  -6.083
  197   3HB   ALA  30          3HB       ALA  30 -13.432   6.176  -4.697
  198    H    ALA  31           H        ALA  31 -16.826   5.021  -3.221
  199    HA   ALA  31           HA       ALA  31 -18.979   5.238  -5.121
  200   1HB   ALA  31          1HB       ALA  31 -19.013   3.062  -4.594
  201   2HB   ALA  31          2HB       ALA  31 -18.135   3.329  -3.088
  202   3HB   ALA  31          3HB       ALA  31 -19.882   3.555  -3.141
  203    H    ALA  32           H        ALA  32 -18.152   6.930  -2.473
  204    HA   ALA  32           HA       ALA  32 -20.901   7.472  -1.630
  205   1HB   ALA  32          1HB       ALA  32 -18.875   7.001  -0.027
  206   2HB   ALA  32          2HB       ALA  32 -18.544   8.712  -0.293
  207   3HB   ALA  32          3HB       ALA  32 -20.091   8.210   0.390
  208    H    ALA  33           H        ALA  33 -21.800   8.896  -2.965
  209    HA   ALA  33           HA       ALA  33 -20.217  11.182  -3.902
  210   1HB   ALA  33          1HB       ALA  33 -21.345   9.893  -5.630
  211   2HB   ALA  33          2HB       ALA  33 -22.897  10.164  -4.836
  212   3HB   ALA  33          3HB       ALA  33 -22.013  11.522  -5.534
  213    H    ALA  34           H        ALA  34 -22.906  10.294  -1.906
  214    HA   ALA  34           HA       ALA  34 -23.177  13.103  -1.084
  215   1HB   ALA  34          1HB       ALA  34 -25.056  12.820  -2.480
  216   2HB   ALA  34          2HB       ALA  34 -25.405  11.221  -1.822
  217   3HB   ALA  34          3HB       ALA  34 -25.659  12.658  -0.831
  218    H    ALA  35           H        ALA  35 -21.846  10.652  -0.019
  219    HA   ALA  35           HA       ALA  35 -23.194  10.591   2.594
  220   1HB   ALA  35          1HB       ALA  35 -21.466   8.320   1.762
  221   2HB   ALA  35          2HB       ALA  35 -22.875   8.341   2.824
  222   3HB   ALA  35          3HB       ALA  35 -23.088   8.435   1.076
  Start of MODEL    8
    1   1H    GLY   1          1H        GLY   1  17.184 -21.129   4.185
    2   2H    GLY   1          2H        GLY   1  17.434 -22.136   2.843
    3   3H    GLY   1          3H        GLY   1  15.874 -21.581   3.209
    4   1HA   GLY   1          2HA       GLY   1  18.108 -19.764   2.528
    5   2HA   GLY   1          1HA       GLY   1  17.012 -20.420   1.320
    6    H    SER   2           H        SER   2  17.574 -17.876   3.377
    7    HA   SER   2           HA       SER   2  14.873 -17.193   4.038
    8   1HB   SER   2          1HB       SER   2  16.878 -15.032   4.024
    9   2HB   SER   2          2HB       SER   2  15.831 -15.594   5.330
   10    HG   SER   2           HG       SER   2  18.285 -15.967   5.378
   11    H    MET   3           H        MET   3  16.672 -17.016   1.206
   12    HA   MET   3           HA       MET   3  15.171 -14.757   0.118
   13   1HB   MET   3          1HB       MET   3  17.730 -15.571  -0.297
   14   2HB   MET   3          2HB       MET   3  16.922 -16.351  -1.651
   15   1HG   MET   3          1HG       MET   3  15.898 -14.003  -2.054
   16   2HG   MET   3          2HG       MET   3  17.239 -13.447  -1.053
   17   1HE   MET   3          1HE       MET   3  20.367 -14.322  -2.925
   18   2HE   MET   3          2HE       MET   3  19.567 -14.349  -1.355
   19   3HE   MET   3          3HE       MET   3  19.641 -15.816  -2.333
   20    H    ASN   4           H        ASN   4  14.225 -17.622   0.821
   21    HA   ASN   4           HA       ASN   4  13.505 -18.846  -1.658
   22   1HB   ASN   4          1HB       ASN   4  13.646 -19.681   0.954
   23   2HB   ASN   4          2HB       ASN   4  11.912 -19.582   0.692
   24   1HD2  ASN   4          1HD2      ASN   4  13.650 -21.901   1.109
   25   2HD2  ASN   4          2HD2      ASN   4  13.377 -22.934  -0.254
   26    H    ALA   5           H        ALA   5  11.480 -19.057  -2.570
   27    HA   ALA   5           HA       ALA   5   9.822 -16.799  -2.597
   28   1HB   ALA   5          1HB       ALA   5   9.628 -19.538  -3.739
   29   2HB   ALA   5          2HB       ALA   5   8.179 -18.532  -3.719
   30   3HB   ALA   5          3HB       ALA   5   9.632 -17.969  -4.545
   31    HA   PRO   6           HA       PRO   6   6.714 -19.500   0.182
   32   1HB   PRO   6          1HB       PRO   6   8.869 -20.843   1.741
   33   2HB   PRO   6          2HB       PRO   6   7.259 -21.425   1.317
   34   1HG   PRO   6          1HG       PRO   6   9.392 -22.341   0.040
   35   2HG   PRO   6          2HG       PRO   6   7.891 -22.000  -0.842
   36   1HD   PRO   6          1HD       PRO   6  10.422 -20.427  -0.726
   37   2HD   PRO   6          2HD       PRO   6   9.306 -20.684  -2.080
   38    H    ALA   7           H        ALA   7   9.916 -18.517   1.315
   39    HA   ALA   7           HA       ALA   7   9.108 -17.490   3.813
   40   1HB   ALA   7          1HB       ALA   7  11.464 -16.560   2.188
   41   2HB   ALA   7          2HB       ALA   7  11.270 -16.472   3.938
   42   3HB   ALA   7          3HB       ALA   7  11.463 -18.038   3.149
   43    H    ARG   8           H        ARG   8   9.274 -16.172   0.623
   44    HA   ARG   8           HA       ARG   8   8.846 -13.444   1.304
   45   1HB   ARG   8          1HB       ARG   8   8.533 -14.998  -1.256
   46   2HB   ARG   8          2HB       ARG   8   8.177 -13.281  -1.157
   47   1HG   ARG   8          1HG       ARG   8  10.589 -13.109  -0.194
   48   2HG   ARG   8          2HG       ARG   8  10.803 -14.684  -0.966
   49   1HD   ARG   8          1HD       ARG   8   9.600 -13.342  -2.963
   50   2HD   ARG   8          2HD       ARG   8  10.435 -12.012  -2.164
   51    HE   ARG   8           HE       ARG   8  11.757 -14.405  -3.269
   52   1HH1  ARG   8          2HH1      ARG   8  11.799 -11.051  -2.285
   53   2HH1  ARG   8          1HH1      ARG   8  13.362 -10.726  -2.982
   54   1HH2  ARG   8          2HH2      ARG   8  13.826 -14.003  -4.178
   55   2HH2  ARG   8          1HH2      ARG   8  14.510 -12.405  -4.072
   56    H    ALA   9           H        ALA   9   6.789 -16.150   1.177
   57    HA   ALA   9           HA       ALA   9   4.368 -14.827   0.441
   58   1HB   ALA   9          1HB       ALA   9   4.128 -17.047   0.060
   59   2HB   ALA   9          2HB       ALA   9   5.112 -17.509   1.449
   60   3HB   ALA   9          3HB       ALA   9   3.442 -16.989   1.683
   61    H    ALA  10           H        ALA  10   6.195 -15.009   3.324
   62    HA   ALA  10           HA       ALA  10   3.945 -14.307   5.036
   63   1HB   ALA  10          1HB       ALA  10   6.775 -15.080   5.469
   64   2HB   ALA  10          2HB       ALA  10   6.028 -14.039   6.679
   65   3HB   ALA  10          3HB       ALA  10   5.314 -15.607   6.303
   66    H    ALA  11           H        ALA  11   5.941 -12.719   2.931
   67    HA   ALA  11           HA       ALA  11   5.814 -10.206   4.459
   68   1HB   ALA  11          1HB       ALA  11   7.937  -9.906   3.906
   69   2HB   ALA  11          2HB       ALA  11   7.930 -11.414   2.990
   70   3HB   ALA  11          3HB       ALA  11   7.486  -9.901   2.201
   71    H    LYS  12           H        LYS  12   5.332 -11.642   1.264
   72    HA   LYS  12           HA       LYS  12   4.418  -9.349  -0.064
   73   1HB   LYS  12          1HB       LYS  12   5.095 -11.656  -0.995
   74   2HB   LYS  12          2HB       LYS  12   3.414 -12.097  -0.707
   75   1HG   LYS  12          1HG       LYS  12   3.000  -9.837  -2.025
   76   2HG   LYS  12          2HG       LYS  12   4.582 -10.244  -2.694
   77   1HD   LYS  12          1HD       LYS  12   3.804 -12.071  -3.772
   78   2HD   LYS  12          2HD       LYS  12   2.581 -12.415  -2.555
   79   1HE   LYS  12          2HE       LYS  12   1.888  -9.954  -3.732
   80   2HE   LYS  12          1HE       LYS  12   2.310 -11.041  -5.055
   81   1HZ   LYS  12          1HZ       LYS  12   0.290 -11.898  -4.837
   82   2HZ   LYS  12          2HZ       LYS  12  -0.019 -11.024  -3.415
   83   3HZ   LYS  12          3HZ       LYS  12   0.752 -12.536  -3.337
   84    H    THR  13           H        THR  13   2.809 -11.523   2.102
   85    HA   THR  13           HA       THR  13   0.138 -11.060   1.378
   86    HB   THR  13           HB       THR  13  -0.005 -11.670   4.019
   87    HG1  THR  13           1HG      THR  13   2.100 -13.303   3.574
   88   1HG2  THR  13          1HG2      THR  13   0.363 -14.128   3.059
   89   2HG2  THR  13          2HG2      THR  13   0.271 -13.262   1.525
   90   3HG2  THR  13          3HG2      THR  13  -1.070 -13.178   2.670
   91    H    ALA  14           H        ALA  14   2.412  -9.326   3.348
   92    HA   ALA  14           HA       ALA  14   0.573  -7.722   4.794
   93   1HB   ALA  14          1HB       ALA  14   2.500  -6.276   5.256
   94   2HB   ALA  14          2HB       ALA  14   2.892  -7.979   5.503
   95   3HB   ALA  14          3HB       ALA  14   3.442  -7.153   4.047
   96    H    ALA  15           H        ALA  15   2.557  -7.023   1.922
   97    HA   ALA  15           HA       ALA  15   1.275  -4.565   1.322
   98   1HB   ALA  15          1HB       ALA  15   2.318  -5.059  -1.007
   99   2HB   ALA  15          2HB       ALA  15   3.378  -4.758   0.370
  100   3HB   ALA  15          3HB       ALA  15   3.093  -6.409  -0.179
  101    H    ASP  16           H        ASP  16   0.625  -7.889   0.575
  102    HA   ASP  16           HA       ASP  16  -1.178  -7.558  -1.567
  103   1HB   ASP  16          1HB       ASP  16  -0.067  -9.725  -0.491
  104   2HB   ASP  16          2HB       ASP  16  -1.565  -9.738   0.439
  105    H    ALA  17           H        ALA  17  -1.674  -7.902   1.917
  106    HA   ALA  17           HA       ALA  17  -4.482  -7.542   1.850
  107   1HB   ALA  17          1HB       ALA  17  -3.993  -6.892   4.356
  108   2HB   ALA  17          2HB       ALA  17  -3.834  -8.555   3.791
  109   3HB   ALA  17          3HB       ALA  17  -2.399  -7.545   3.973
  110    H    LEU  18           H        LEU  18  -1.778  -5.330   2.181
  111    HA   LEU  18           HA       LEU  18  -3.276  -3.046   2.897
  112   1HB   LEU  18          1HB       LEU  18  -0.587  -3.390   1.595
  113   2HB   LEU  18          2HB       LEU  18  -1.252  -1.812   1.973
  114    HG   LEU  18           HG       LEU  18  -0.523  -3.995   3.924
  115   1HD1  LEU  18          1HD1      LEU  18   0.612  -1.314   3.215
  116   2HD1  LEU  18          2HD1      LEU  18   0.911  -2.051   4.789
  117   3HD1  LEU  18          3HD1      LEU  18   1.428  -2.873   3.315
  118   1HD2  LEU  18          1HD2      LEU  18  -2.624  -2.261   4.229
  119   2HD2  LEU  18          2HD2      LEU  18  -1.723  -3.013   5.544
  120   3HD2  LEU  18          3HD2      LEU  18  -1.300  -1.388   5.000
  121    H    ALA  19           H        ALA  19  -2.195  -4.322  -0.226
  122    HA   ALA  19           HA       ALA  19  -3.141  -2.283  -1.870
  123   1HB   ALA  19          1HB       ALA  19  -2.315  -5.044  -2.192
  124   2HB   ALA  19          2HB       ALA  19  -3.598  -4.596  -3.314
  125   3HB   ALA  19          3HB       ALA  19  -2.102  -3.667  -3.273
  126    H    ALA  20           H        ALA  20  -4.822  -5.074  -0.528
  127    HA   ALA  20           HA       ALA  20  -7.318  -4.520  -1.778
  128   1HB   ALA  20          1HB       ALA  20  -7.784  -6.544  -0.999
  129   2HB   ALA  20          2HB       ALA  20  -6.244  -6.557  -0.141
  130   3HB   ALA  20          3HB       ALA  20  -7.694  -5.950   0.660
  131    H    ALA  21           H        ALA  21  -6.015  -3.882   1.464
  132    HA   ALA  21           HA       ALA  21  -8.322  -2.741   2.572
  133   1HB   ALA  21          1HB       ALA  21  -7.011  -2.896   4.358
  134   2HB   ALA  21          2HB       ALA  21  -5.587  -3.112   3.338
  135   3HB   ALA  21          3HB       ALA  21  -6.116  -1.489   3.779
  136    H    LYS  22           H        LYS  22  -5.656  -1.267   0.756
  137    HA   LYS  22           HA       LYS  22  -6.508   1.406   1.198
  138   1HB   LYS  22          1HB       LYS  22  -4.405   0.047  -0.284
  139   2HB   LYS  22          2HB       LYS  22  -5.047   1.433  -1.157
  140   1HG   LYS  22          1HG       LYS  22  -3.550   2.592   0.029
  141   2HG   LYS  22          2HG       LYS  22  -4.733   2.466   1.337
  142   1HD   LYS  22          1HD       LYS  22  -2.949   1.620   2.450
  143   2HD   LYS  22          2HD       LYS  22  -3.477   0.129   1.665
  144   1HE   LYS  22          2HE       LYS  22  -1.352   0.023   0.944
  145   2HE   LYS  22          1HE       LYS  22  -1.891   1.197  -0.258
  146   1HZ   LYS  22          1HZ       LYS  22  -0.224   1.586   2.111
  147   2HZ   LYS  22          2HZ       LYS  22  -1.272   2.845   1.688
  148   3HZ   LYS  22          3HZ       LYS  22  -0.113   2.302   0.573
  149    H    LYS  23           H        LYS  23  -7.105  -0.995  -1.296
  150    HA   LYS  23           HA       LYS  23  -8.323   0.790  -3.141
  151   1HB   LYS  23          1HB       LYS  23  -7.333  -1.614  -3.487
  152   2HB   LYS  23          2HB       LYS  23  -8.965  -2.132  -3.083
  153   1HG   LYS  23          1HG       LYS  23  -9.832  -0.716  -4.889
  154   2HG   LYS  23          2HG       LYS  23  -8.178  -0.286  -5.323
  155   1HD   LYS  23          1HD       LYS  23  -7.782  -2.279  -6.307
  156   2HD   LYS  23          2HD       LYS  23  -8.734  -3.169  -5.117
  157   1HE   LYS  23          2HE       LYS  23 -10.295  -1.395  -6.845
  158   2HE   LYS  23          1HE       LYS  23  -9.483  -2.713  -7.693
  159   1HZ   LYS  23          1HZ       LYS  23 -10.499  -4.072  -5.686
  160   2HZ   LYS  23          2HZ       LYS  23 -11.384  -3.766  -7.101
  161   3HZ   LYS  23          3HZ       LYS  23 -11.637  -2.817  -5.718
  162    H    THR  24           H        THR  24  -9.540  -1.386  -0.655
  163    HA   THR  24           HA       THR  24 -12.256  -0.924  -1.046
  164    HB   THR  24           HB       THR  24 -10.947  -1.497   1.585
  165    HG1  THR  24           1HG      THR  24 -10.089  -3.067   0.311
  166   1HG2  THR  24          1HG2      THR  24 -13.471  -1.038   1.136
  167   2HG2  THR  24          2HG2      THR  24 -12.965  -2.323   2.234
  168   3HG2  THR  24          3HG2      THR  24 -13.447  -2.709   0.582
  169    H    ALA  25           H        ALA  25  -9.911   0.660   1.129
  170    HA   ALA  25           HA       ALA  25 -11.677   2.532   2.243
  171   1HB   ALA  25          1HB       ALA  25  -9.806   3.629   3.078
  172   2HB   ALA  25          2HB       ALA  25  -9.233   1.972   2.876
  173   3HB   ALA  25          3HB       ALA  25  -8.811   3.202   1.684
  174    H    ALA  26           H        ALA  26  -9.786   2.570  -0.708
  175    HA   ALA  26           HA       ALA  26 -10.398   5.218  -1.508
  176   1HB   ALA  26          1HB       ALA  26  -9.878   3.040  -3.489
  177   2HB   ALA  26          2HB       ALA  26  -9.346   4.722  -3.506
  178   3HB   ALA  26          3HB       ALA  26  -8.597   3.572  -2.397
  179    H    ASP  27           H        ASP  27 -11.878   2.099  -2.203
  180    HA   ASP  27           HA       ASP  27 -13.887   2.927  -3.950
  181   1HB   ASP  27          1HB       ASP  27 -13.152   0.546  -3.115
  182   2HB   ASP  27          2HB       ASP  27 -14.412   0.794  -1.912
  183    H    ALA  28           H        ALA  28 -13.970   2.586  -0.406
  184    HA   ALA  28           HA       ALA  28 -16.585   3.569  -0.072
  185   1HB   ALA  28          1HB       ALA  28 -14.926   4.177   2.192
  186   2HB   ALA  28          2HB       ALA  28 -16.211   2.981   2.036
  187   3HB   ALA  28          3HB       ALA  28 -14.558   2.565   1.578
  188    H    ALA  29           H        ALA  29 -13.474   5.166  -0.317
  189    HA   ALA  29           HA       ALA  29 -14.296   7.739   0.508
  190   1HB   ALA  29          1HB       ALA  29 -11.979   6.648  -1.014
  191   2HB   ALA  29          2HB       ALA  29 -12.272   8.388  -1.045
  192   3HB   ALA  29          3HB       ALA  29 -12.012   7.565   0.494
  193    H    ALA  30           H        ALA  30 -14.304   6.112  -2.622
  194    HA   ALA  30           HA       ALA  30 -15.107   8.364  -4.151
  195   1HB   ALA  30          1HB       ALA  30 -15.073   6.950  -5.914
  196   2HB   ALA  30          2HB       ALA  30 -14.249   5.880  -4.777
  197   3HB   ALA  30          3HB       ALA  30 -15.980   5.699  -5.061
  198    H    ALA  31           H        ALA  31 -16.805   5.838  -2.407
  199    HA   ALA  31           HA       ALA  31 -19.407   6.844  -3.212
  200   1HB   ALA  31          1HB       ALA  31 -18.879   4.396  -2.965
  201   2HB   ALA  31          2HB       ALA  31 -18.831   4.660  -1.223
  202   3HB   ALA  31          3HB       ALA  31 -20.322   4.948  -2.119
  203    H    ALA  32           H        ALA  32 -17.409   8.319  -1.408
  204    HA   ALA  32           HA       ALA  32 -19.023   8.546   1.019
  205   1HB   ALA  32          1HB       ALA  32 -16.346   8.374   0.786
  206   2HB   ALA  32          2HB       ALA  32 -16.548  10.125   0.823
  207   3HB   ALA  32          3HB       ALA  32 -17.168   9.137   2.147
  208    H    ALA  33           H        ALA  33 -19.846   9.643  -1.554
  209    HA   ALA  33           HA       ALA  33 -19.884  12.515  -0.944
  210   1HB   ALA  33          1HB       ALA  33 -19.580  11.364  -3.333
  211   2HB   ALA  33          2HB       ALA  33 -21.342  11.433  -3.293
  212   3HB   ALA  33          3HB       ALA  33 -20.399  12.915  -3.129
  213    H    ALA  34           H        ALA  34 -21.955   9.708  -1.367
  214    HA   ALA  34           HA       ALA  34 -24.041  11.093   0.181
  215   1HB   ALA  34          1HB       ALA  34 -25.283   8.997  -1.183
  216   2HB   ALA  34          2HB       ALA  34 -25.436  10.722  -1.512
  217   3HB   ALA  34          3HB       ALA  34 -24.229   9.765  -2.371
  218    H    ALA  35           H        ALA  35 -22.805  10.233   2.016
  219    HA   ALA  35           HA       ALA  35 -23.458   7.407   2.527
  220   1HB   ALA  35          1HB       ALA  35 -21.282   7.369   3.875
  221   2HB   ALA  35          2HB       ALA  35 -21.149   7.309   2.117
  222   3HB   ALA  35          3HB       ALA  35 -20.847   8.822   2.973
  Start of MODEL    9
    1   1H    GLY   1          1H        GLY   1  19.815  -4.042   1.309
    2   2H    GLY   1          2H        GLY   1  19.938  -5.673   1.754
    3   3H    GLY   1          3H        GLY   1  20.416  -4.466   2.839
    4   1HA   GLY   1          2HA       GLY   1  18.370  -4.982   3.685
    5   2HA   GLY   1          1HA       GLY   1  17.977  -3.656   2.596
    6    H    SER   2           H        SER   2  15.817  -4.561   2.552
    7    HA   SER   2           HA       SER   2  15.409  -7.176   1.446
    8   1HB   SER   2          1HB       SER   2  13.118  -5.324   1.478
    9   2HB   SER   2          2HB       SER   2  13.272  -6.947   2.152
   10    HG   SER   2           HG       SER   2  13.033  -5.238   3.733
   11    H    MET   3           H        MET   3  16.919  -6.101  -0.386
   12    HA   MET   3           HA       MET   3  15.244  -5.029  -2.530
   13   1HB   MET   3          1HB       MET   3  17.560  -4.119  -2.028
   14   2HB   MET   3          2HB       MET   3  18.205  -5.644  -2.618
   15   1HG   MET   3          1HG       MET   3  16.399  -4.630  -4.563
   16   2HG   MET   3          2HG       MET   3  17.504  -3.338  -4.091
   17   1HE   MET   3          1HE       MET   3  17.629  -6.497  -6.822
   18   2HE   MET   3          2HE       MET   3  16.757  -4.978  -6.599
   19   3HE   MET   3          3HE       MET   3  18.271  -5.003  -7.506
   20    H    ASN   4           H        ASN   4  16.341  -7.940  -1.314
   21    HA   ASN   4           HA       ASN   4  16.429  -9.366  -3.823
   22   1HB   ASN   4          1HB       ASN   4  16.721 -11.361  -2.235
   23   2HB   ASN   4          2HB       ASN   4  18.017 -10.179  -2.303
   24   1HD2  ASN   4          1HD2      ASN   4  17.904 -11.882  -0.222
   25   2HD2  ASN   4          2HD2      ASN   4  17.420 -11.052   1.221
   26    H    ALA   5           H        ALA   5  15.072 -11.103  -4.340
   27    HA   ALA   5           HA       ALA   5  12.360 -10.540  -4.106
   28   1HB   ALA   5          1HB       ALA   5  13.936 -12.324  -5.574
   29   2HB   ALA   5          2HB       ALA   5  12.733 -13.310  -4.742
   30   3HB   ALA   5          3HB       ALA   5  12.217 -11.977  -5.776
   31    HA   PRO   6           HA       PRO   6  12.049 -14.423  -1.027
   32   1HB   PRO   6          1HB       PRO   6  14.667 -13.915   0.309
   33   2HB   PRO   6          2HB       PRO   6  13.806 -15.437   0.065
   34   1HG   PRO   6          1HG       PRO   6  15.885 -14.841  -1.448
   35   2HG   PRO   6          2HG       PRO   6  14.443 -15.587  -2.167
   36   1HD   PRO   6          1HD       PRO   6  15.360 -12.750  -2.272
   37   2HD   PRO   6          2HD       PRO   6  14.573 -13.729  -3.521
   38    H    ALA   7           H        ALA   7  13.882 -11.532  -0.076
   39    HA   ALA   7           HA       ALA   7  12.615 -11.317   2.464
   40   1HB   ALA   7          1HB       ALA   7  14.657  -9.886   1.013
   41   2HB   ALA   7          2HB       ALA   7  13.554  -8.784   1.838
   42   3HB   ALA   7          3HB       ALA   7  14.403 -10.028   2.754
   43    H    ARG   8           H        ARG   8  11.981 -10.046  -0.696
   44    HA   ARG   8           HA       ARG   8   9.911  -8.248   0.105
   45   1HB   ARG   8          1HB       ARG   8  11.134  -9.135  -2.393
   46   2HB   ARG   8          2HB       ARG   8   9.399  -8.886  -2.540
   47   1HG   ARG   8          1HG       ARG   8   9.590  -6.671  -2.419
   48   2HG   ARG   8          2HG       ARG   8  10.768  -6.751  -1.107
   49   1HD   ARG   8          1HD       ARG   8  12.370  -7.579  -3.007
   50   2HD   ARG   8          2HD       ARG   8  11.201  -6.779  -4.058
   51    HE   ARG   8           HE       ARG   8  12.914  -5.491  -2.049
   52   1HH1  ARG   8          2HH1      ARG   8  10.601  -5.251  -4.667
   53   2HH1  ARG   8          1HH1      ARG   8  10.770  -3.526  -4.835
   54   1HH2  ARG   8          2HH2      ARG   8  13.166  -3.224  -2.272
   55   2HH2  ARG   8          1HH2      ARG   8  12.213  -2.367  -3.455
   56    H    ALA   9           H        ALA   9  10.046 -11.567  -1.036
   57    HA   ALA   9           HA       ALA   9   7.275 -12.030  -1.259
   58   1HB   ALA   9          1HB       ALA   9   8.041 -14.472  -0.864
   59   2HB   ALA   9          2HB       ALA   9   8.589 -13.623  -2.310
   60   3HB   ALA   9          3HB       ALA   9   9.669 -13.795  -0.925
   61    H    ALA  10           H        ALA  10   9.413 -11.894   1.452
   62    HA   ALA  10           HA       ALA  10   7.836 -13.294   3.334
   63   1HB   ALA  10          1HB       ALA  10  10.280 -11.838   3.330
   64   2HB   ALA  10          2HB       ALA  10   9.281 -11.259   4.665
   65   3HB   ALA  10          3HB       ALA  10   9.672 -12.974   4.534
   66    H    ALA  11           H        ALA  11   7.577 -10.161   1.944
   67    HA   ALA  11           HA       ALA  11   5.634  -9.330   3.992
   68   1HB   ALA  11          1HB       ALA  11   6.271  -7.254   2.111
   69   2HB   ALA  11          2HB       ALA  11   6.517  -7.297   3.857
   70   3HB   ALA  11          3HB       ALA  11   7.747  -7.951   2.777
   71    H    LYS  12           H        LYS  12   5.479 -11.064   1.399
   72    HA   LYS  12           HA       LYS  12   3.955  -9.806  -0.542
   73   1HB   LYS  12          1HB       LYS  12   4.726 -11.894  -1.167
   74   2HB   LYS  12          2HB       LYS  12   4.229 -12.650   0.339
   75   1HG   LYS  12          1HG       LYS  12   2.479 -13.454  -0.756
   76   2HG   LYS  12          2HG       LYS  12   1.857 -11.805  -0.830
   77   1HD   LYS  12          1HD       LYS  12   3.700 -11.913  -2.890
   78   2HD   LYS  12          2HD       LYS  12   2.912 -13.491  -2.941
   79   1HE   LYS  12          2HE       LYS  12   1.404 -10.889  -2.814
   80   2HE   LYS  12          1HE       LYS  12   1.835 -11.681  -4.328
   81   1HZ   LYS  12          1HZ       LYS  12  -0.320 -12.231  -2.574
   82   2HZ   LYS  12          2HZ       LYS  12   0.639 -13.618  -2.753
   83   3HZ   LYS  12          3HZ       LYS  12  -0.014 -12.858  -4.122
   84    H    THR  13           H        THR  13   2.766 -11.635   2.280
   85    HA   THR  13           HA       THR  13   0.029 -11.300   1.699
   86    HB   THR  13           HB       THR  13   0.540 -11.641   4.513
   87    HG1  THR  13           1HG      THR  13   1.872 -13.518   4.321
   88   1HG2  THR  13          1HG2      THR  13  -1.136 -13.069   4.189
   89   2HG2  THR  13          2HG2      THR  13  -0.135 -14.056   3.121
   90   3HG2  THR  13          3HG2      THR  13  -1.061 -12.706   2.463
   91    H    ALA  14           H        ALA  14   2.366  -9.394   3.409
   92    HA   ALA  14           HA       ALA  14   0.537  -7.729   4.827
   93   1HB   ALA  14          1HB       ALA  14   2.377  -6.783   5.715
   94   2HB   ALA  14          2HB       ALA  14   3.223  -8.136   4.965
   95   3HB   ALA  14          3HB       ALA  14   3.150  -6.579   4.144
   96    H    ALA  15           H        ALA  15   2.446  -7.316   1.856
   97    HA   ALA  15           HA       ALA  15   1.250  -4.841   1.135
   98   1HB   ALA  15          1HB       ALA  15   3.456  -5.881   0.297
   99   2HB   ALA  15          2HB       ALA  15   2.436  -6.749  -0.851
  100   3HB   ALA  15          3HB       ALA  15   2.459  -4.986  -0.851
  101    H    ASP  16           H        ASP  16   0.424  -8.189   0.658
  102    HA   ASP  16           HA       ASP  16  -1.502  -7.911  -1.378
  103   1HB   ASP  16          1HB       ASP  16  -0.468 -10.011   0.099
  104   2HB   ASP  16          2HB       ASP  16  -2.138  -9.925   0.660
  105    H    ALA  17           H        ALA  17  -1.716  -7.776   2.130
  106    HA   ALA  17           HA       ALA  17  -4.508  -7.291   2.269
  107   1HB   ALA  17          1HB       ALA  17  -3.209  -6.112   4.501
  108   2HB   ALA  17          2HB       ALA  17  -4.094  -7.637   4.423
  109   3HB   ALA  17          3HB       ALA  17  -2.360  -7.606   4.103
  110    H    LEU  18           H        LEU  18  -1.658  -5.179   2.271
  111    HA   LEU  18           HA       LEU  18  -2.985  -2.754   2.699
  112   1HB   LEU  18          1HB       LEU  18  -0.410  -3.377   1.270
  113   2HB   LEU  18          2HB       LEU  18  -0.960  -1.741   1.576
  114    HG   LEU  18           HG       LEU  18  -0.094  -3.813   3.570
  115   1HD1  LEU  18          1HD1      LEU  18   0.794  -1.024   2.885
  116   2HD1  LEU  18          2HD1      LEU  18   1.351  -1.911   4.305
  117   3HD1  LEU  18          3HD1      LEU  18   1.698  -2.526   2.690
  118   1HD2  LEU  18          1HD2      LEU  18  -1.949  -1.538   3.935
  119   2HD2  LEU  18          2HD2      LEU  18  -1.827  -3.059   4.819
  120   3HD2  LEU  18          3HD2      LEU  18  -0.692  -1.750   5.152
  121    H    ALA  19           H        ALA  19  -2.060  -4.325  -0.362
  122    HA   ALA  19           HA       ALA  19  -2.941  -2.389  -2.139
  123   1HB   ALA  19          1HB       ALA  19  -3.312  -4.342  -3.720
  124   2HB   ALA  19          2HB       ALA  19  -1.706  -4.202  -3.007
  125   3HB   ALA  19          3HB       ALA  19  -2.849  -5.389  -2.377
  126    H    ALA  20           H        ALA  20  -4.765  -5.040  -0.683
  127    HA   ALA  20           HA       ALA  20  -7.231  -4.391  -1.943
  128   1HB   ALA  20          1HB       ALA  20  -7.166  -6.586  -1.273
  129   2HB   ALA  20          2HB       ALA  20  -6.399  -6.210   0.270
  130   3HB   ALA  20          3HB       ALA  20  -8.113  -5.868   0.030
  131    H    ALA  21           H        ALA  21  -5.931  -3.784   1.305
  132    HA   ALA  21           HA       ALA  21  -8.222  -2.608   2.403
  133   1HB   ALA  21          1HB       ALA  21  -6.784  -1.775   4.151
  134   2HB   ALA  21          2HB       ALA  21  -6.295  -3.414   3.717
  135   3HB   ALA  21          3HB       ALA  21  -5.356  -2.031   3.148
  136    H    LYS  22           H        LYS  22  -5.509  -1.142   0.641
  137    HA   LYS  22           HA       LYS  22  -6.350   1.536   1.093
  138   1HB   LYS  22          1HB       LYS  22  -4.280   0.166  -0.487
  139   2HB   LYS  22          2HB       LYS  22  -4.872   1.656  -1.214
  140   1HG   LYS  22          1HG       LYS  22  -3.161   2.473   0.044
  141   2HG   LYS  22          2HG       LYS  22  -4.482   2.598   1.214
  142   1HD   LYS  22          1HD       LYS  22  -3.261   1.358   2.608
  143   2HD   LYS  22          2HD       LYS  22  -3.472   0.002   1.498
  144   1HE   LYS  22          2HE       LYS  22  -1.262   0.010   1.241
  145   2HE   LYS  22          1HE       LYS  22  -1.454   1.523   0.358
  146   1HZ   LYS  22          1HZ       LYS  22  -1.168   2.737   2.414
  147   2HZ   LYS  22          2HZ       LYS  22   0.167   1.727   2.143
  148   3HZ   LYS  22          3HZ       LYS  22  -1.011   1.293   3.285
  149    H    LYS  23           H        LYS  23  -6.834  -0.801  -1.494
  150    HA   LYS  23           HA       LYS  23  -8.229   0.870  -3.281
  151   1HB   LYS  23          1HB       LYS  23  -7.248  -1.477  -3.659
  152   2HB   LYS  23          2HB       LYS  23  -8.743  -2.077  -2.957
  153   1HG   LYS  23          1HG       LYS  23  -9.834  -0.508  -4.757
  154   2HG   LYS  23          2HG       LYS  23  -8.275  -0.725  -5.556
  155   1HD   LYS  23          1HD       LYS  23  -9.040  -3.270  -4.679
  156   2HD   LYS  23          2HD       LYS  23 -10.496  -2.545  -5.366
  157   1HE   LYS  23          2HE       LYS  23  -9.728  -3.002  -7.395
  158   2HE   LYS  23          1HE       LYS  23  -8.390  -1.892  -7.105
  159   1HZ   LYS  23          1HZ       LYS  23  -7.683  -4.145  -7.768
  160   2HZ   LYS  23          2HZ       LYS  23  -8.375  -4.767  -6.352
  161   3HZ   LYS  23          3HZ       LYS  23  -7.073  -3.685  -6.253
  162    H    THR  24           H        THR  24  -9.317  -1.265  -0.682
  163    HA   THR  24           HA       THR  24 -12.076  -0.874  -1.100
  164    HB   THR  24           HB       THR  24 -10.373  -2.280   0.750
  165    HG1  THR  24           1HG      THR  24 -13.019  -2.991   0.675
  166   1HG2  THR  24          1HG2      THR  24 -11.736  -2.293   2.724
  167   2HG2  THR  24          2HG2      THR  24 -12.909  -1.206   1.979
  168   3HG2  THR  24          3HG2      THR  24 -11.291  -0.624   2.371
  169    H    ALA  25           H        ALA  25  -9.734   0.766   1.015
  170    HA   ALA  25           HA       ALA  25 -11.541   2.496   2.284
  171   1HB   ALA  25          1HB       ALA  25  -9.718   3.429   3.216
  172   2HB   ALA  25          2HB       ALA  25  -8.880   2.056   2.488
  173   3HB   ALA  25          3HB       ALA  25  -8.894   3.617   1.667
  174    H    ALA  26           H        ALA  26  -9.582   2.967  -0.644
  175    HA   ALA  26           HA       ALA  26 -10.546   5.519  -1.300
  176   1HB   ALA  26          1HB       ALA  26  -9.699   5.056  -3.562
  177   2HB   ALA  26          2HB       ALA  26  -8.541   4.608  -2.309
  178   3HB   ALA  26          3HB       ALA  26  -9.489   3.362  -3.120
  179    H    ASP  27           H        ASP  27 -11.734   2.306  -2.117
  180    HA   ASP  27           HA       ASP  27 -13.705   3.001  -3.972
  181   1HB   ASP  27          1HB       ASP  27 -12.825   0.666  -3.095
  182   2HB   ASP  27          2HB       ASP  27 -14.213   0.789  -2.024
  183    H    ALA  28           H        ALA  28 -14.049   2.411  -0.490
  184    HA   ALA  28           HA       ALA  28 -16.753   3.098  -0.282
  185   1HB   ALA  28          1HB       ALA  28 -14.595   2.469   1.509
  186   2HB   ALA  28          2HB       ALA  28 -15.575   3.783   2.160
  187   3HB   ALA  28          3HB       ALA  28 -16.332   2.251   1.724
  188    H    ALA  29           H        ALA  29 -13.854   5.089  -0.088
  189    HA   ALA  29           HA       ALA  29 -15.162   7.439   0.848
  190   1HB   ALA  29          1HB       ALA  29 -12.500   6.625   0.313
  191   2HB   ALA  29          2HB       ALA  29 -12.796   8.125  -0.568
  192   3HB   ALA  29          3HB       ALA  29 -13.059   8.058   1.175
  193    H    ALA  30           H        ALA  30 -14.383   6.167  -2.340
  194    HA   ALA  30           HA       ALA  30 -14.912   8.524  -3.805
  195   1HB   ALA  30          1HB       ALA  30 -14.104   5.888  -4.382
  196   2HB   ALA  30          2HB       ALA  30 -15.533   6.210  -5.365
  197   3HB   ALA  30          3HB       ALA  30 -14.131   7.279  -5.466
  198    H    ALA  31           H        ALA  31 -16.958   5.867  -2.728
  199    HA   ALA  31           HA       ALA  31 -19.246   6.904  -4.170
  200   1HB   ALA  31          1HB       ALA  31 -18.535   4.388  -3.436
  201   2HB   ALA  31          2HB       ALA  31 -19.720   4.791  -2.194
  202   3HB   ALA  31          3HB       ALA  31 -20.167   4.871  -3.899
  203    H    ALA  32           H        ALA  32 -17.765   7.870  -1.482
  204    HA   ALA  32           HA       ALA  32 -20.204   8.345   0.078
  205   1HB   ALA  32          1HB       ALA  32 -18.956   8.325   1.954
  206   2HB   ALA  32          2HB       ALA  32 -17.797   7.468   0.938
  207   3HB   ALA  32          3HB       ALA  32 -17.623   9.203   1.204
  208    H    ALA  33           H        ALA  33 -20.077   9.802  -2.228
  209    HA   ALA  33           HA       ALA  33 -18.792  12.289  -2.068
  210   1HB   ALA  33          1HB       ALA  33 -20.951  12.852  -3.595
  211   2HB   ALA  33          2HB       ALA  33 -19.505  12.033  -4.186
  212   3HB   ALA  33          3HB       ALA  33 -20.918  11.092  -3.708
  213    H    ALA  34           H        ALA  34 -22.232  11.549  -1.481
  214    HA   ALA  34           HA       ALA  34 -22.368  13.962   0.198
  215   1HB   ALA  34          1HB       ALA  34 -24.265  14.526  -0.821
  216   2HB   ALA  34          2HB       ALA  34 -23.910  13.264  -2.000
  217   3HB   ALA  34          3HB       ALA  34 -24.939  12.910  -0.614
  218    H    ALA  35           H        ALA  35 -21.336  11.791   1.403
  219    HA   ALA  35           HA       ALA  35 -23.469  10.945   3.215
  220   1HB   ALA  35          1HB       ALA  35 -21.741   8.729   2.941
  221   2HB   ALA  35          2HB       ALA  35 -23.445   8.842   2.501
  222   3HB   ALA  35          3HB       ALA  35 -22.201   9.231   1.314
  Start of MODEL   10
    1   1H    GLY   1          1H        GLY   1  11.580  -0.933   6.935
    2   2H    GLY   1          2H        GLY   1  11.854  -0.752   5.271
    3   3H    GLY   1          3H        GLY   1  12.954  -1.622   6.220
    4   1HA   GLY   1          2HA       GLY   1  10.994  -3.150   6.751
    5   2HA   GLY   1          1HA       GLY   1  10.239  -2.390   5.358
    6    H    SER   2           H        SER   2  12.240  -2.120   3.571
    7    HA   SER   2           HA       SER   2  12.623  -4.847   2.745
    8   1HB   SER   2          1HB       SER   2  13.979  -3.174   0.963
    9   2HB   SER   2          2HB       SER   2  12.339  -3.801   0.787
   10    HG   SER   2           HG       SER   2  12.724  -1.397   0.731
   11    H    MET   3           H        MET   3  14.035  -4.826   4.939
   12    HA   MET   3           HA       MET   3  16.695  -3.885   4.806
   13   1HB   MET   3          1HB       MET   3  15.298  -4.784   6.831
   14   2HB   MET   3          2HB       MET   3  15.954  -6.345   6.357
   15   1HG   MET   3          1HG       MET   3  17.783  -4.024   6.776
   16   2HG   MET   3          2HG       MET   3  17.159  -4.924   8.156
   17   1HE   MET   3          1HE       MET   3  17.453  -7.159   8.687
   18   2HE   MET   3          2HE       MET   3  18.749  -8.229   8.155
   19   3HE   MET   3          3HE       MET   3  19.126  -6.804   9.124
   20    H    ASN   4           H        ASN   4  15.457  -7.198   4.415
   21    HA   ASN   4           HA       ASN   4  17.947  -7.905   3.027
   22   1HB   ASN   4          1HB       ASN   4  16.028  -9.389   4.739
   23   2HB   ASN   4          2HB       ASN   4  16.729 -10.287   3.400
   24   1HD2  ASN   4          1HD2      ASN   4  19.273  -9.425   3.274
   25   2HD2  ASN   4          2HD2      ASN   4  20.103  -9.745   4.762
   26    H    ALA   5           H        ALA   5  17.821  -9.271   1.147
   27    HA   ALA   5           HA       ALA   5  16.029  -8.329  -0.787
   28   1HB   ALA   5          1HB       ALA   5  18.286 -10.082  -0.728
   29   2HB   ALA   5          2HB       ALA   5  17.010 -10.793  -1.717
   30   3HB   ALA   5          3HB       ALA   5  17.610  -9.178  -2.081
   31    HA   PRO   6           HA       PRO   6  13.590 -12.477  -0.500
   32   1HB   PRO   6          1HB       PRO   6  13.924 -14.026   1.710
   33   2HB   PRO   6          2HB       PRO   6  14.874 -14.234   0.234
   34   1HG   PRO   6          1HG       PRO   6  15.595 -12.823   2.768
   35   2HG   PRO   6          2HG       PRO   6  16.578 -13.916   1.775
   36   1HD   PRO   6          1HD       PRO   6  16.828 -11.235   1.661
   37   2HD   PRO   6          2HD       PRO   6  17.092 -12.269   0.251
   38    H    ALA   7           H        ALA   7  14.270 -10.416   2.145
   39    HA   ALA   7           HA       ALA   7  11.885 -10.848   3.644
   40   1HB   ALA   7          1HB       ALA   7  14.164  -9.648   4.265
   41   2HB   ALA   7          2HB       ALA   7  13.257  -8.220   3.765
   42   3HB   ALA   7          3HB       ALA   7  12.646  -9.240   5.066
   43    H    ARG   8           H        ARG   8  12.540  -9.289   0.724
   44    HA   ARG   8           HA       ARG   8  10.294  -7.467   0.834
   45   1HB   ARG   8          1HB       ARG   8  12.137  -8.308  -1.407
   46   2HB   ARG   8          2HB       ARG   8  10.804  -7.181  -1.625
   47   1HG   ARG   8          1HG       ARG   8  12.019  -5.499  -0.873
   48   2HG   ARG   8          2HG       ARG   8  12.407  -6.377   0.606
   49   1HD   ARG   8          1HD       ARG   8  14.123  -7.639  -0.806
   50   2HD   ARG   8          2HD       ARG   8  13.878  -6.373  -2.008
   51    HE   ARG   8           HE       ARG   8  14.614  -5.595   0.714
   52   1HH1  ARG   8          2HH1      ARG   8  15.534  -6.043  -2.615
   53   2HH1  ARG   8          1HH1      ARG   8  16.891  -4.955  -2.535
   54   1HH2  ARG   8          2HH2      ARG   8  16.402  -4.183   0.871
   55   2HH2  ARG   8          1HH2      ARG   8  17.394  -3.894  -0.533
   56    H    ALA   9           H        ALA   9  10.986 -10.684  -0.266
   57    HA   ALA   9           HA       ALA   9   8.496 -10.985  -1.701
   58   1HB   ALA   9          1HB       ALA   9  10.920 -12.241  -1.854
   59   2HB   ALA   9          2HB       ALA   9   9.943 -13.427  -0.987
   60   3HB   ALA   9          3HB       ALA   9   9.422 -12.838  -2.565
   61    H    ALA  10           H        ALA  10   9.830 -11.687   1.434
   62    HA   ALA  10           HA       ALA  10   7.780 -13.417   2.362
   63   1HB   ALA  10          1HB       ALA  10  10.092 -12.015   3.512
   64   2HB   ALA  10          2HB       ALA  10   8.772 -12.331   4.638
   65   3HB   ALA  10          3HB       ALA  10   9.523 -13.665   3.763
   66    H    ALA  11           H        ALA  11   7.721 -10.168   1.634
   67    HA   ALA  11           HA       ALA  11   5.756  -9.450   3.672
   68   1HB   ALA  11          1HB       ALA  11   7.804  -8.032   2.570
   69   2HB   ALA  11          2HB       ALA  11   6.427  -7.462   1.629
   70   3HB   ALA  11          3HB       ALA  11   6.411  -7.323   3.387
   71    H    LYS  12           H        LYS  12   5.494 -11.193   1.077
   72    HA   LYS  12           HA       LYS  12   3.958 -10.023  -0.857
   73   1HB   LYS  12          1HB       LYS  12   4.756 -12.578  -0.304
   74   2HB   LYS  12          2HB       LYS  12   3.008 -12.700  -0.138
   75   1HG   LYS  12          1HG       LYS  12   2.960 -11.451  -2.409
   76   2HG   LYS  12          2HG       LYS  12   4.632 -12.000  -2.542
   77   1HD   LYS  12          1HD       LYS  12   4.009 -14.258  -2.506
   78   2HD   LYS  12          2HD       LYS  12   2.402 -13.893  -1.879
   79   1HE   LYS  12          2HE       LYS  12   3.236 -12.829  -4.545
   80   2HE   LYS  12          1HE       LYS  12   2.710 -14.504  -4.394
   81   1HZ   LYS  12          1HZ       LYS  12   0.892 -12.980  -4.987
   82   2HZ   LYS  12          2HZ       LYS  12   1.116 -12.151  -3.525
   83   3HZ   LYS  12          3HZ       LYS  12   0.614 -13.772  -3.510
   84    H    THR  13           H        THR  13   2.370 -12.094   1.581
   85    HA   THR  13           HA       THR  13  -0.193 -11.170   1.137
   86    HB   THR  13           HB       THR  13   0.304 -11.974   3.902
   87    HG1  THR  13           1HG      THR  13   1.084 -14.057   3.344
   88   1HG2  THR  13          1HG2      THR  13  -1.693 -12.210   1.975
   89   2HG2  THR  13          2HG2      THR  13  -1.687 -12.932   3.583
   90   3HG2  THR  13          3HG2      THR  13  -1.095 -13.852   2.200
   91    H    ALA  14           H        ALA  14   2.313  -9.874   3.205
   92    HA   ALA  14           HA       ALA  14   0.719  -8.228   4.845
   93   1HB   ALA  14          1HB       ALA  14   3.494  -7.449   4.037
   94   2HB   ALA  14          2HB       ALA  14   2.695  -7.288   5.601
   95   3HB   ALA  14          3HB       ALA  14   3.225  -8.874   5.043
   96    H    ALA  15           H        ALA  15   2.498  -7.523   1.848
   97    HA   ALA  15           HA       ALA  15   1.396  -4.873   1.641
   98   1HB   ALA  15          1HB       ALA  15   3.607  -5.319   0.755
   99   2HB   ALA  15          2HB       ALA  15   2.945  -6.517  -0.357
  100   3HB   ALA  15          3HB       ALA  15   2.528  -4.814  -0.545
  101    H    ASP  16           H        ASP  16   0.534  -8.045   0.556
  102    HA   ASP  16           HA       ASP  16  -1.169  -7.351  -1.593
  103   1HB   ASP  16          1HB       ASP  16  -0.258  -9.705  -0.698
  104   2HB   ASP  16          2HB       ASP  16  -1.826  -9.709   0.105
  105    H    ALA  17           H        ALA  17  -1.755  -7.917   1.844
  106    HA   ALA  17           HA       ALA  17  -4.542  -7.430   1.781
  107   1HB   ALA  17          1HB       ALA  17  -4.269  -7.108   4.251
  108   2HB   ALA  17          2HB       ALA  17  -3.621  -8.626   3.627
  109   3HB   ALA  17          3HB       ALA  17  -2.531  -7.295   4.017
  110    H    LEU  18           H        LEU  18  -1.735  -5.366   2.149
  111    HA   LEU  18           HA       LEU  18  -3.108  -3.034   2.973
  112   1HB   LEU  18          1HB       LEU  18  -0.462  -3.455   1.607
  113   2HB   LEU  18          2HB       LEU  18  -1.046  -1.865   2.052
  114    HG   LEU  18           HG       LEU  18  -0.336  -4.135   3.903
  115   1HD1  LEU  18          1HD1      LEU  18   1.090  -2.143   4.803
  116   2HD1  LEU  18          2HD1      LEU  18   1.630  -3.055   3.393
  117   3HD1  LEU  18          3HD1      LEU  18   0.843  -1.491   3.181
  118   1HD2  LEU  18          1HD2      LEU  18  -2.259  -3.191   4.891
  119   2HD2  LEU  18          2HD2      LEU  18  -0.889  -2.430   5.701
  120   3HD2  LEU  18          3HD2      LEU  18  -1.776  -1.552   4.454
  121    H    ALA  19           H        ALA  19  -2.075  -4.211  -0.210
  122    HA   ALA  19           HA       ALA  19  -2.997  -2.088  -1.762
  123   1HB   ALA  19          1HB       ALA  19  -3.373  -4.781  -2.901
  124   2HB   ALA  19          2HB       ALA  19  -2.497  -3.389  -3.539
  125   3HB   ALA  19          3HB       ALA  19  -1.752  -4.413  -2.310
  126    H    ALA  20           H        ALA  20  -4.693  -4.923  -0.531
  127    HA   ALA  20           HA       ALA  20  -7.181  -4.357  -1.779
  128   1HB   ALA  20          1HB       ALA  20  -6.116  -6.424  -0.216
  129   2HB   ALA  20          2HB       ALA  20  -7.494  -5.797   0.689
  130   3HB   ALA  20          3HB       ALA  20  -7.710  -6.360  -0.968
  131    H    ALA  21           H        ALA  21  -5.902  -3.767   1.480
  132    HA   ALA  21           HA       ALA  21  -8.164  -2.579   2.596
  133   1HB   ALA  21          1HB       ALA  21  -6.725  -1.741   4.308
  134   2HB   ALA  21          2HB       ALA  21  -6.127  -3.331   3.831
  135   3HB   ALA  21          3HB       ALA  21  -5.312  -1.874   3.260
  136    H    LYS  22           H        LYS  22  -5.444  -1.081   0.833
  137    HA   LYS  22           HA       LYS  22  -6.358   1.579   1.178
  138   1HB   LYS  22          1HB       LYS  22  -4.211   0.207  -0.219
  139   2HB   LYS  22          2HB       LYS  22  -4.868   1.525  -1.178
  140   1HG   LYS  22          1HG       LYS  22  -3.415   2.784  -0.040
  141   2HG   LYS  22          2HG       LYS  22  -4.627   2.715   1.247
  142   1HD   LYS  22          1HD       LYS  22  -3.442   0.625   2.056
  143   2HD   LYS  22          2HD       LYS  22  -2.142   1.041   0.938
  144   1HE   LYS  22          2HE       LYS  22  -3.067   3.187   2.742
  145   2HE   LYS  22          1HE       LYS  22  -2.216   1.841   3.500
  146   1HZ   LYS  22          1HZ       LYS  22  -0.292   2.597   2.741
  147   2HZ   LYS  22          2HZ       LYS  22  -1.088   3.999   2.215
  148   3HZ   LYS  22          3HZ       LYS  22  -0.869   2.698   1.149
  149    H    LYS  23           H        LYS  23  -6.931  -0.918  -1.213
  150    HA   LYS  23           HA       LYS  23  -8.268   0.665  -3.129
  151   1HB   LYS  23          1HB       LYS  23  -7.395  -1.748  -3.367
  152   2HB   LYS  23          2HB       LYS  23  -8.901  -2.232  -2.599
  153   1HG   LYS  23          1HG       LYS  23  -9.782  -0.560  -4.562
  154   2HG   LYS  23          2HG       LYS  23  -8.390  -1.329  -5.327
  155   1HD   LYS  23          1HD       LYS  23  -9.801  -3.001  -5.805
  156   2HD   LYS  23          2HD       LYS  23  -9.646  -3.439  -4.102
  157   1HE   LYS  23          2HE       LYS  23 -11.977  -3.334  -4.659
  158   2HE   LYS  23          1HE       LYS  23 -11.590  -1.973  -3.606
  159   1HZ   LYS  23          1HZ       LYS  23 -12.884  -1.039  -5.275
  160   2HZ   LYS  23          2HZ       LYS  23 -12.168  -1.959  -6.508
  161   3HZ   LYS  23          3HZ       LYS  23 -11.307  -0.686  -5.791
  162    H    THR  24           H        THR  24  -9.375  -1.226  -0.376
  163    HA   THR  24           HA       THR  24 -12.102  -0.766  -0.602
  164    HB   THR  24           HB       THR  24 -10.632  -1.019   1.994
  165    HG1  THR  24           1HG      THR  24  -9.882  -2.620   0.436
  166   1HG2  THR  24          1HG2      THR  24 -13.130  -0.626   1.781
  167   2HG2  THR  24          2HG2      THR  24 -12.589  -1.967   2.795
  168   3HG2  THR  24          3HG2      THR  24 -13.196  -2.273   1.168
  169    H    ALA  25           H        ALA  25  -9.636   0.976   1.281
  170    HA   ALA  25           HA       ALA  25 -11.208   2.948   2.419
  171   1HB   ALA  25          1HB       ALA  25  -8.361   2.665   1.738
  172   2HB   ALA  25          2HB       ALA  25  -8.927   4.325   1.931
  173   3HB   ALA  25          3HB       ALA  25  -9.125   3.166   3.247
  174    H    ALA  26           H        ALA  26  -9.787   2.834  -0.800
  175    HA   ALA  26           HA       ALA  26 -10.684   5.461  -1.539
  176   1HB   ALA  26          1HB       ALA  26 -10.119   4.466  -3.903
  177   2HB   ALA  26          2HB       ALA  26  -8.838   4.870  -2.760
  178   3HB   ALA  26          3HB       ALA  26  -9.357   3.194  -2.944
  179    H    ASP  27           H        ASP  27 -11.808   2.174  -2.033
  180    HA   ASP  27           HA       ASP  27 -13.871   2.663  -3.855
  181   1HB   ASP  27          1HB       ASP  27 -12.831   0.439  -2.846
  182   2HB   ASP  27          2HB       ASP  27 -14.229   0.554  -1.782
  183    H    ALA  28           H        ALA  28 -13.857   2.696  -0.319
  184    HA   ALA  28           HA       ALA  28 -16.614   3.107   0.057
  185   1HB   ALA  28          1HB       ALA  28 -14.204   3.243   1.682
  186   2HB   ALA  28          2HB       ALA  28 -15.432   4.409   2.170
  187   3HB   ALA  28          3HB       ALA  28 -15.825   2.691   2.105
  188    H    ALA  29           H        ALA  29 -13.947   5.342  -0.486
  189    HA   ALA  29           HA       ALA  29 -15.470   7.716  -0.116
  190   1HB   ALA  29          1HB       ALA  29 -13.559   8.852  -1.164
  191   2HB   ALA  29          2HB       ALA  29 -13.052   7.738   0.105
  192   3HB   ALA  29          3HB       ALA  29 -12.874   7.285  -1.592
  193    H    ALA  30           H        ALA  30 -14.884   5.570  -2.796
  194    HA   ALA  30           HA       ALA  30 -15.802   7.290  -4.860
  195   1HB   ALA  30          1HB       ALA  30 -15.644   5.460  -6.284
  196   2HB   ALA  30          2HB       ALA  30 -14.443   5.107  -5.042
  197   3HB   ALA  30          3HB       ALA  30 -16.012   4.303  -5.003
  198    H    ALA  31           H        ALA  31 -17.394   5.433  -2.447
  199    HA   ALA  31           HA       ALA  31 -19.935   5.344  -3.796
  200   1HB   ALA  31          1HB       ALA  31 -20.211   4.963  -0.983
  201   2HB   ALA  31          2HB       ALA  31 -20.372   3.777  -2.277
  202   3HB   ALA  31          3HB       ALA  31 -18.795   4.077  -1.546
  203    H    ALA  32           H        ALA  32 -18.193   7.678  -2.288
  204    HA   ALA  32           HA       ALA  32 -20.543   9.214  -1.437
  205   1HB   ALA  32          1HB       ALA  32 -19.021  10.669  -0.271
  206   2HB   ALA  32          2HB       ALA  32 -18.631   8.998   0.144
  207   3HB   ALA  32          3HB       ALA  32 -17.629   9.876  -1.012
  208    H    ALA  33           H        ALA  33 -21.128   9.420  -3.712
  209    HA   ALA  33           HA       ALA  33 -19.427  11.122  -5.350
  210   1HB   ALA  33          1HB       ALA  33 -21.877   9.494  -5.831
  211   2HB   ALA  33          2HB       ALA  33 -21.511  10.830  -6.924
  212   3HB   ALA  33          3HB       ALA  33 -20.348   9.521  -6.710
  213    H    ALA  34           H        ALA  34 -22.509  11.219  -3.661
  214    HA   ALA  34           HA       ALA  34 -22.680  14.110  -4.243
  215   1HB   ALA  34          1HB       ALA  34 -25.074  13.955  -3.985
  216   2HB   ALA  34          2HB       ALA  34 -24.543  12.750  -5.160
  217   3HB   ALA  34          3HB       ALA  34 -24.950  12.261  -3.515
  218    H    ALA  35           H        ALA  35 -21.144  12.785  -2.144
  219    HA   ALA  35           HA       ALA  35 -22.303  14.167   0.154
  220   1HB   ALA  35          1HB       ALA  35 -21.827  12.289   1.641
  221   2HB   ALA  35          2HB       ALA  35 -22.993  11.837   0.397
  222   3HB   ALA  35          3HB       ALA  35 -21.314  11.317   0.260
  Start of MODEL   11
    1   1H    GLY   1          1H        GLY   1  12.115 -24.239 -13.175
    2   2H    GLY   1          2H        GLY   1  12.190 -22.702 -13.882
    3   3H    GLY   1          3H        GLY   1  11.244 -22.956 -12.492
    4   1HA   GLY   1          2HA       GLY   1  13.796 -23.792 -11.835
    5   2HA   GLY   1          1HA       GLY   1  13.980 -22.266 -12.693
    6    H    SER   2           H        SER   2  14.491 -20.963 -11.003
    7    HA   SER   2           HA       SER   2  13.015 -21.045  -8.530
    8   1HB   SER   2          1HB       SER   2  14.765 -18.725  -9.069
    9   2HB   SER   2          2HB       SER   2  14.739 -19.821  -7.686
   10    HG   SER   2           HG       SER   2  15.946 -21.296  -8.819
   11    H    MET   3           H        MET   3  10.933 -20.674  -9.636
   12    HA   MET   3           HA       MET   3  10.242 -17.855  -9.531
   13   1HB   MET   3          1HB       MET   3   8.965 -18.041 -11.692
   14   2HB   MET   3          2HB       MET   3  10.714 -17.983 -11.862
   15   1HG   MET   3          1HG       MET   3   9.777 -20.700 -11.645
   16   2HG   MET   3          2HG       MET   3   8.964 -19.847 -12.955
   17   1HE   MET   3          1HE       MET   3  10.174 -20.335 -15.449
   18   2HE   MET   3          2HE       MET   3   9.962 -18.714 -14.788
   19   3HE   MET   3          3HE       MET   3  11.485 -19.161 -15.555
   20    H    ASN   4           H        ASN   4   9.690 -19.926  -7.809
   21    HA   ASN   4           HA       ASN   4   7.256 -21.263  -8.310
   22   1HB   ASN   4          1HB       ASN   4   8.427 -20.642  -5.598
   23   2HB   ASN   4          2HB       ASN   4   7.368 -21.975  -6.029
   24   1HD2  ASN   4          1HD2      ASN   4   8.295 -23.858  -6.365
   25   2HD2  ASN   4          2HD2      ASN   4   9.962 -24.118  -6.763
   26    H    ALA   5           H        ALA   5   5.251 -20.579  -8.177
   27    HA   ALA   5           HA       ALA   5   4.608 -17.885  -7.664
   28   1HB   ALA   5          1HB       ALA   5   2.589 -20.105  -7.658
   29   2HB   ALA   5          2HB       ALA   5   2.389 -18.430  -8.174
   30   3HB   ALA   5          3HB       ALA   5   3.362 -19.541  -9.141
   31    HA   PRO   6           HA       PRO   6   2.608 -19.364  -3.508
   32   1HB   PRO   6          1HB       PRO   6   3.574 -21.670  -2.417
   33   2HB   PRO   6          2HB       PRO   6   2.138 -21.602  -3.441
   34   1HG   PRO   6          1HG       PRO   6   4.930 -22.384  -4.150
   35   2HG   PRO   6          2HG       PRO   6   3.393 -23.122  -4.642
   36   1HD   PRO   6          1HD       PRO   6   4.785 -21.468  -6.250
   37   2HD   PRO   6          2HD       PRO   6   3.022 -21.553  -6.280
   38    H    ALA   7           H        ALA   7   5.935 -19.893  -4.320
   39    HA   ALA   7           HA       ALA   7   6.946 -19.218  -1.716
   40   1HB   ALA   7          1HB       ALA   7   8.183 -19.767  -4.367
   41   2HB   ALA   7          2HB       ALA   7   9.135 -18.956  -3.122
   42   3HB   ALA   7          3HB       ALA   7   8.459 -20.556  -2.813
   43    H    ARG   8           H        ARG   8   6.377 -17.601  -4.733
   44    HA   ARG   8           HA       ARG   8   7.530 -15.110  -3.960
   45   1HB   ARG   8          1HB       ARG   8   6.123 -16.198  -6.284
   46   2HB   ARG   8          2HB       ARG   8   5.711 -14.520  -5.956
   47   1HG   ARG   8          1HG       ARG   8   7.653 -13.803  -6.746
   48   2HG   ARG   8          2HG       ARG   8   8.545 -14.939  -5.732
   49   1HD   ARG   8          1HD       ARG   8   7.774 -16.691  -7.507
   50   2HD   ARG   8          2HD       ARG   8   7.552 -15.271  -8.529
   51    HE   ARG   8           HE       ARG   8  10.129 -15.790  -7.193
   52   1HH1  ARG   8          2HH1      ARG   8   8.266 -15.376 -10.144
   53   2HH1  ARG   8          1HH1      ARG   8   9.671 -15.134 -11.139
   54   1HH2  ARG   8          2HH2      ARG   8  11.957 -15.430  -8.481
   55   2HH2  ARG   8          1HH2      ARG   8  11.776 -15.153 -10.185
   56    H    ALA   9           H        ALA   9   4.395 -16.603  -3.671
   57    HA   ALA   9           HA       ALA   9   2.856 -14.336  -3.043
   58   1HB   ALA   9          1HB       ALA   9   1.762 -16.386  -3.594
   59   2HB   ALA   9          2HB       ALA   9   2.533 -17.224  -2.249
   60   3HB   ALA   9          3HB       ALA   9   1.324 -15.978  -1.936
   61    H    ALA  10           H        ALA  10   5.225 -16.048  -1.240
   62    HA   ALA  10           HA       ALA  10   4.381 -15.426   1.383
   63   1HB   ALA  10          1HB       ALA  10   6.197 -17.089   0.539
   64   2HB   ALA  10          2HB       ALA  10   7.269 -15.699   0.687
   65   3HB   ALA  10          3HB       ALA  10   6.395 -16.292   2.100
   66    H    ALA  11           H        ALA  11   5.903 -13.548  -1.082
   67    HA   ALA  11           HA       ALA  11   6.587 -11.443   0.852
   68   1HB   ALA  11          1HB       ALA  11   8.450 -11.392  -0.376
   69   2HB   ALA  11          2HB       ALA  11   7.712 -12.311  -1.689
   70   3HB   ALA  11          3HB       ALA  11   7.478 -10.565  -1.593
   71    H    LYS  12           H        LYS  12   3.978 -12.341  -0.705
   72    HA   LYS  12           HA       LYS  12   3.215  -9.716  -1.762
   73   1HB   LYS  12          1HB       LYS  12   2.868 -11.794  -3.135
   74   2HB   LYS  12          2HB       LYS  12   1.701 -12.327  -1.932
   75   1HG   LYS  12          1HG       LYS  12   0.710  -9.893  -2.466
   76   2HG   LYS  12          2HG       LYS  12   1.465 -10.264  -4.019
   77   1HD   LYS  12          1HD       LYS  12   0.230 -12.607  -3.505
   78   2HD   LYS  12          2HD       LYS  12  -0.866 -11.487  -2.696
   79   1HE   LYS  12          2HE       LYS  12  -0.085 -10.503  -5.300
   80   2HE   LYS  12          1HE       LYS  12  -0.789 -12.114  -5.413
   81   1HZ   LYS  12          1HZ       LYS  12  -2.807 -11.280  -5.063
   82   2HZ   LYS  12          2HZ       LYS  12  -2.145  -9.727  -5.192
   83   3HZ   LYS  12          3HZ       LYS  12  -2.311 -10.453  -3.669
   84    H    THR  13           H        THR  13   2.206 -12.181   0.531
   85    HA   THR  13           HA       THR  13  -0.215 -11.560   1.384
   86    HB   THR  13           HB       THR  13   1.225 -11.885   3.792
   87    HG1  THR  13           1HG      THR  13   3.075 -12.321   2.524
   88   1HG2  THR  13          1HG2      THR  13  -0.007 -13.977   1.996
   89   2HG2  THR  13          2HG2      THR  13  -0.921 -12.940   3.090
   90   3HG2  THR  13          3HG2      THR  13   0.248 -14.093   3.737
   91    H    ALA  14           H        ALA  14   2.608  -9.875   2.858
   92    HA   ALA  14           HA       ALA  14   0.966  -8.344   4.593
   93   1HB   ALA  14          1HB       ALA  14   3.005  -8.327   5.516
   94   2HB   ALA  14          2HB       ALA  14   3.821  -8.520   3.964
   95   3HB   ALA  14          3HB       ALA  14   3.286  -6.923   4.488
   96    H    ALA  15           H        ALA  15   2.586  -7.558   1.542
   97    HA   ALA  15           HA       ALA  15   1.678  -4.862   1.475
   98   1HB   ALA  15          1HB       ALA  15   2.443  -6.374  -0.991
   99   2HB   ALA  15          2HB       ALA  15   2.748  -4.690  -0.568
  100   3HB   ALA  15          3HB       ALA  15   3.661  -5.975   0.221
  101    H    ASP  16           H        ASP  16   0.282  -7.888   0.658
  102    HA   ASP  16           HA       ASP  16  -1.588  -6.935  -1.291
  103   1HB   ASP  16          1HB       ASP  16  -0.670  -9.420  -0.582
  104   2HB   ASP  16          2HB       ASP  16  -2.270  -9.402   0.154
  105    H    ALA  17           H        ALA  17  -1.645  -7.673   2.159
  106    HA   ALA  17           HA       ALA  17  -4.352  -7.240   2.672
  107   1HB   ALA  17          1HB       ALA  17  -2.235  -7.897   4.199
  108   2HB   ALA  17          2HB       ALA  17  -2.448  -6.214   4.681
  109   3HB   ALA  17          3HB       ALA  17  -3.780  -7.357   4.861
  110    H    LEU  18           H        LEU  18  -1.647  -4.973   2.545
  111    HA   LEU  18           HA       LEU  18  -3.160  -2.660   3.160
  112   1HB   LEU  18          1HB       LEU  18  -0.559  -2.899   1.647
  113   2HB   LEU  18          2HB       LEU  18  -1.226  -1.412   2.294
  114    HG   LEU  18           HG       LEU  18  -0.292  -3.782   3.914
  115   1HD1  LEU  18          1HD1      LEU  18   0.901  -1.137   3.204
  116   2HD1  LEU  18          2HD1      LEU  18   1.318  -1.922   4.730
  117   3HD1  LEU  18          3HD1      LEU  18   1.641  -2.740   3.195
  118   1HD2  LEU  18          1HD2      LEU  18  -2.071  -1.618   4.563
  119   2HD2  LEU  18          2HD2      LEU  18  -1.562  -2.984   5.557
  120   3HD2  LEU  18          3HD2      LEU  18  -0.596  -1.509   5.524
  121    H    ALA  19           H        ALA  19  -2.216  -4.205   0.130
  122    HA   ALA  19           HA       ALA  19  -3.112  -2.244  -1.646
  123   1HB   ALA  19          1HB       ALA  19  -2.364  -3.681  -3.170
  124   2HB   ALA  19          2HB       ALA  19  -1.997  -4.787  -1.844
  125   3HB   ALA  19          3HB       ALA  19  -3.546  -4.900  -2.685
  126    H    ALA  20           H        ALA  20  -4.825  -5.063  -0.319
  127    HA   ALA  20           HA       ALA  20  -7.259  -4.548  -1.690
  128   1HB   ALA  20          1HB       ALA  20  -6.878  -6.117   0.856
  129   2HB   ALA  20          2HB       ALA  20  -8.224  -6.239  -0.277
  130   3HB   ALA  20          3HB       ALA  20  -6.609  -6.759  -0.766
  131    H    ALA  21           H        ALA  21  -6.115  -3.829   1.578
  132    HA   ALA  21           HA       ALA  21  -8.402  -2.588   2.573
  133   1HB   ALA  21          1HB       ALA  21  -6.809  -1.360   4.084
  134   2HB   ALA  21          2HB       ALA  21  -6.642  -3.116   4.074
  135   3HB   ALA  21          3HB       ALA  21  -5.492  -2.117   3.185
  136    H    LYS  22           H        LYS  22  -5.522  -0.937   1.206
  137    HA   LYS  22           HA       LYS  22  -6.546   1.595   1.012
  138   1HB   LYS  22          1HB       LYS  22  -4.429   0.082  -0.352
  139   2HB   LYS  22          2HB       LYS  22  -5.031   1.465  -1.253
  140   1HG   LYS  22          1HG       LYS  22  -3.212   2.268  -0.016
  141   2HG   LYS  22          2HG       LYS  22  -4.643   2.828   0.854
  142   1HD   LYS  22          1HD       LYS  22  -4.342   1.301   2.579
  143   2HD   LYS  22          2HD       LYS  22  -3.332   0.240   1.595
  144   1HE   LYS  22          2HE       LYS  22  -1.649   1.183   2.750
  145   2HE   LYS  22          1HE       LYS  22  -1.841   2.488   1.578
  146   1HZ   LYS  22          1HZ       LYS  22  -2.382   2.460   4.403
  147   2HZ   LYS  22          2HZ       LYS  22  -3.654   3.111   3.486
  148   3HZ   LYS  22          3HZ       LYS  22  -2.094   3.770   3.365
  149    H    LYS  23           H        LYS  23  -7.009  -1.057  -1.277
  150    HA   LYS  23           HA       LYS  23  -8.284   0.427  -3.305
  151   1HB   LYS  23          1HB       LYS  23  -7.401  -1.973  -3.427
  152   2HB   LYS  23          2HB       LYS  23  -8.897  -2.450  -2.638
  153   1HG   LYS  23          1HG       LYS  23  -9.898  -2.517  -4.608
  154   2HG   LYS  23          2HG       LYS  23  -9.597  -0.790  -4.809
  155   1HD   LYS  23          1HD       LYS  23  -8.590  -1.704  -6.684
  156   2HD   LYS  23          2HD       LYS  23  -7.236  -1.532  -5.566
  157   1HE   LYS  23          2HE       LYS  23  -7.080  -3.797  -5.196
  158   2HE   LYS  23          1HE       LYS  23  -8.773  -4.089  -5.593
  159   1HZ   LYS  23          1HZ       LYS  23  -8.153  -3.516  -7.948
  160   2HZ   LYS  23          2HZ       LYS  23  -7.514  -4.967  -7.355
  161   3HZ   LYS  23          3HZ       LYS  23  -6.528  -3.589  -7.462
  162    H    THR  24           H        THR  24  -9.551  -1.412  -0.573
  163    HA   THR  24           HA       THR  24 -12.269  -0.906  -0.980
  164    HB   THR  24           HB       THR  24 -10.611  -1.645   1.404
  165    HG1  THR  24           1HG      THR  24 -10.857  -3.248  -0.172
  166   1HG2  THR  24          1HG2      THR  24 -12.393  -1.737   2.794
  167   2HG2  THR  24          2HG2      THR  24 -13.547  -1.959   1.480
  168   3HG2  THR  24          3HG2      THR  24 -12.868  -0.363   1.799
  169    H    ALA  25           H        ALA  25  -9.812   0.725   0.967
  170    HA   ALA  25           HA       ALA  25 -11.416   2.669   2.178
  171   1HB   ALA  25          1HB       ALA  25  -9.432   2.956   3.146
  172   2HB   ALA  25          2HB       ALA  25  -8.585   2.215   1.788
  173   3HB   ALA  25          3HB       ALA  25  -8.986   3.932   1.746
  174    H    ALA  26           H        ALA  26  -9.592   2.845  -0.870
  175    HA   ALA  26           HA       ALA  26 -10.444   5.463  -1.555
  176   1HB   ALA  26          1HB       ALA  26  -9.192   5.203  -3.428
  177   2HB   ALA  26          2HB       ALA  26  -8.553   3.830  -2.527
  178   3HB   ALA  26          3HB       ALA  26  -9.806   3.581  -3.745
  179    H    ASP  27           H        ASP  27 -11.702   2.258  -2.203
  180    HA   ASP  27           HA       ASP  27 -13.704   2.912  -4.054
  181   1HB   ASP  27          1HB       ASP  27 -12.839   0.595  -3.258
  182   2HB   ASP  27          2HB       ASP  27 -14.056   0.751  -1.995
  183    H    ALA  28           H        ALA  28 -13.892   2.544  -0.520
  184    HA   ALA  28           HA       ALA  28 -16.615   3.173  -0.253
  185   1HB   ALA  28          1HB       ALA  28 -15.690   2.163   1.616
  186   2HB   ALA  28          2HB       ALA  28 -14.278   3.217   1.615
  187   3HB   ALA  28          3HB       ALA  28 -15.842   3.842   2.138
  188    H    ALA  29           H        ALA  29 -13.726   5.218  -0.175
  189    HA   ALA  29           HA       ALA  29 -15.006   7.627   0.497
  190   1HB   ALA  29          1HB       ALA  29 -12.804   8.204  -1.182
  191   2HB   ALA  29          2HB       ALA  29 -12.881   8.260   0.580
  192   3HB   ALA  29          3HB       ALA  29 -12.388   6.774  -0.234
  193    H    ALA  30           H        ALA  30 -14.491   6.003  -2.576
  194    HA   ALA  30           HA       ALA  30 -15.353   8.229  -4.173
  195   1HB   ALA  30          1HB       ALA  30 -14.983   6.866  -6.044
  196   2HB   ALA  30          2HB       ALA  30 -13.752   6.372  -4.882
  197   3HB   ALA  30          3HB       ALA  30 -15.193   5.382  -5.118
  198    H    ALA  31           H        ALA  31 -16.838   5.326  -2.862
  199    HA   ALA  31           HA       ALA  31 -19.217   5.537  -4.428
  200   1HB   ALA  31          1HB       ALA  31 -18.657   3.364  -3.690
  201   2HB   ALA  31          2HB       ALA  31 -18.510   3.897  -2.015
  202   3HB   ALA  31          3HB       ALA  31 -20.096   3.831  -2.782
  203    H    ALA  32           H        ALA  32 -18.104   7.345  -1.945
  204    HA   ALA  32           HA       ALA  32 -20.633   7.803  -0.600
  205   1HB   ALA  32          1HB       ALA  32 -17.917   9.075  -0.270
  206   2HB   ALA  32          2HB       ALA  32 -19.334   9.507   0.684
  207   3HB   ALA  32          3HB       ALA  32 -18.672   7.876   0.778
  208    H    ALA  33           H        ALA  33 -21.434   8.325  -2.898
  209    HA   ALA  33           HA       ALA  33 -20.867  11.075  -3.713
  210   1HB   ALA  33          1HB       ALA  33 -22.172  10.535  -5.714
  211   2HB   ALA  33          2HB       ALA  33 -20.883   9.361  -5.450
  212   3HB   ALA  33          3HB       ALA  33 -22.549   8.949  -5.043
  213    H    ALA  34           H        ALA  34 -22.258  12.715  -3.495
  214    HA   ALA  34           HA       ALA  34 -23.923  13.964  -2.594
  215   1HB   ALA  34          1HB       ALA  34 -25.415  13.311  -4.221
  216   2HB   ALA  34          2HB       ALA  34 -25.403  11.622  -3.711
  217   3HB   ALA  34          3HB       ALA  34 -26.274  12.826  -2.760
  218    H    ALA  35           H        ALA  35 -22.383  12.440  -0.807
  219    HA   ALA  35           HA       ALA  35 -24.304  12.106   1.384
  220   1HB   ALA  35          1HB       ALA  35 -21.984  10.356   1.615
  221   2HB   ALA  35          2HB       ALA  35 -23.697   9.998   1.831
  222   3HB   ALA  35          3HB       ALA  35 -22.991   9.981   0.218
  Start of MODEL   12
    1   1H    GLY   1          1H        GLY   1   9.631 -24.798   3.945
    2   2H    GLY   1          2H        GLY   1  11.064 -25.679   4.163
    3   3H    GLY   1          3H        GLY   1   9.610 -26.486   3.827
    4   1HA   GLY   1          2HA       GLY   1  11.004 -26.399   1.865
    5   2HA   GLY   1          1HA       GLY   1   9.511 -25.498   1.642
    6    H    SER   2           H        SER   2  12.902 -25.120   2.600
    7    HA   SER   2           HA       SER   2  12.947 -22.298   2.368
    8   1HB   SER   2          1HB       SER   2  15.551 -23.316   1.945
    9   2HB   SER   2          2HB       SER   2  14.868 -22.698   3.450
   10    HG   SER   2           HG       SER   2  15.310 -25.308   2.631
   11    H    MET   3           H        MET   3  13.175 -24.859   0.089
   12    HA   MET   3           HA       MET   3  14.336 -23.153  -1.980
   13   1HB   MET   3          1HB       MET   3  14.798 -25.716  -1.482
   14   2HB   MET   3          2HB       MET   3  13.391 -25.935  -2.513
   15   1HG   MET   3          1HG       MET   3  15.401 -24.101  -3.587
   16   2HG   MET   3          2HG       MET   3  15.961 -25.757  -3.376
   17   1HE   MET   3          1HE       MET   3  14.630 -27.912  -5.473
   18   2HE   MET   3          2HE       MET   3  14.337 -27.613  -3.759
   19   3HE   MET   3          3HE       MET   3  12.989 -27.614  -4.895
   20    H    ASN   4           H        ASN   4  11.331 -23.654  -0.736
   21    HA   ASN   4           HA       ASN   4   9.866 -24.084  -3.172
   22   1HB   ASN   4          1HB       ASN   4   9.143 -23.706  -0.299
   23   2HB   ASN   4          2HB       ASN   4   7.902 -23.473  -1.524
   24   1HD2  ASN   4          1HD2      ASN   4   6.996 -25.214  -2.476
   25   2HD2  ASN   4          2HD2      ASN   4   7.422 -26.852  -2.112
   26    H    ALA   5           H        ALA   5   8.568 -22.685  -4.249
   27    HA   ALA   5           HA       ALA   5   9.306 -19.926  -4.199
   28   1HB   ALA   5          1HB       ALA   5   7.740 -19.671  -6.056
   29   2HB   ALA   5          2HB       ALA   5   8.825 -21.041  -6.301
   30   3HB   ALA   5          3HB       ALA   5   7.161 -21.316  -5.786
   31    HA   PRO   6           HA       PRO   6   4.718 -19.235  -2.863
   32   1HB   PRO   6          1HB       PRO   6   3.414 -21.314  -1.672
   33   2HB   PRO   6          2HB       PRO   6   3.338 -20.972  -3.403
   34   1HG   PRO   6          1HG       PRO   6   4.986 -22.979  -1.935
   35   2HG   PRO   6          2HG       PRO   6   4.136 -23.140  -3.483
   36   1HD   PRO   6          1HD       PRO   6   6.806 -22.718  -3.303
   37   2HD   PRO   6          2HD       PRO   6   5.836 -22.123  -4.659
   38    H    ALA   7           H        ALA   7   7.061 -20.954  -1.055
   39    HA   ALA   7           HA       ALA   7   6.060 -20.511   1.554
   40   1HB   ALA   7          1HB       ALA   7   8.504 -21.509   0.363
   41   2HB   ALA   7          2HB       ALA   7   8.821 -20.525   1.792
   42   3HB   ALA   7          3HB       ALA   7   7.752 -21.924   1.904
   43    H    ARG   8           H        ARG   8   7.754 -18.572  -0.721
   44    HA   ARG   8           HA       ARG   8   8.299 -16.467   1.224
   45   1HB   ARG   8          1HB       ARG   8   8.983 -16.780  -1.697
   46   2HB   ARG   8          2HB       ARG   8   9.338 -15.325  -0.777
   47   1HG   ARG   8          1HG       ARG   8  11.196 -16.227   0.005
   48   2HG   ARG   8          2HG       ARG   8  10.304 -17.604   0.649
   49   1HD   ARG   8          1HD       ARG   8  10.704 -18.905  -1.196
   50   2HD   ARG   8          2HD       ARG   8  10.864 -17.517  -2.274
   51    HE   ARG   8           HE       ARG   8  13.017 -17.212  -0.751
   52   1HH1  ARG   8          2HH1      ARG   8  11.751 -20.106  -2.279
   53   2HH1  ARG   8          1HH1      ARG   8  13.324 -20.819  -2.479
   54   1HH2  ARG   8          2HH2      ARG   8  15.047 -18.157  -0.993
   55   2HH2  ARG   8          1HH2      ARG   8  15.194 -19.728  -1.727
   56    H    ALA   9           H        ALA   9   5.842 -17.438  -0.811
   57    HA   ALA   9           HA       ALA   9   4.922 -14.892  -1.736
   58   1HB   ALA   9          1HB       ALA   9   3.256 -17.383  -1.525
   59   2HB   ALA   9          2HB       ALA   9   3.093 -16.046  -2.667
   60   3HB   ALA   9          3HB       ALA   9   4.460 -17.157  -2.797
   61    H    ALA  10           H        ALA  10   4.754 -16.538   1.225
   62    HA   ALA  10           HA       ALA  10   2.275 -15.569   2.196
   63   1HB   ALA  10          1HB       ALA  10   3.796 -17.441   3.124
   64   2HB   ALA  10          2HB       ALA  10   4.603 -16.132   3.989
   65   3HB   ALA  10          3HB       ALA  10   2.887 -16.438   4.256
   66    H    ALA  11           H        ALA  11   5.407 -14.152   1.840
   67    HA   ALA  11           HA       ALA  11   4.960 -11.980   3.670
   68   1HB   ALA  11          1HB       ALA  11   7.151 -13.010   2.169
   69   2HB   ALA  11          2HB       ALA  11   6.964 -11.297   1.785
   70   3HB   ALA  11          3HB       ALA  11   7.163 -11.810   3.462
   71    H    LYS  12           H        LYS  12   4.180 -12.698   0.407
   72    HA   LYS  12           HA       LYS  12   3.920 -10.044  -0.582
   73   1HB   LYS  12          1HB       LYS  12   3.933 -12.458  -1.767
   74   2HB   LYS  12          2HB       LYS  12   2.196 -12.198  -1.689
   75   1HG   LYS  12          1HG       LYS  12   3.450  -9.822  -2.646
   76   2HG   LYS  12          2HG       LYS  12   4.020 -11.205  -3.580
   77   1HD   LYS  12          1HD       LYS  12   1.665 -11.876  -3.941
   78   2HD   LYS  12          2HD       LYS  12   1.149 -10.411  -3.102
   79   1HE   LYS  12          2HE       LYS  12   2.884  -9.411  -4.949
   80   2HE   LYS  12          1HE       LYS  12   2.190 -10.774  -5.823
   81   1HZ   LYS  12          1HZ       LYS  12   0.350  -9.613  -6.164
   82   2HZ   LYS  12          2HZ       LYS  12   1.065  -8.271  -5.421
   83   3HZ   LYS  12          3HZ       LYS  12   0.139  -9.350  -4.499
   84    H    THR  13           H        THR  13   1.719 -12.343   0.917
   85    HA   THR  13           HA       THR  13  -0.694 -11.036   0.566
   86    HB   THR  13           HB       THR  13  -0.416 -12.343   3.165
   87    HG1  THR  13           1HG      THR  13  -0.114 -14.441   1.922
   88   1HG2  THR  13          1HG2      THR  13  -2.042 -12.889   0.679
   89   2HG2  THR  13          2HG2      THR  13  -2.571 -12.009   2.111
   90   3HG2  THR  13          3HG2      THR  13  -2.235 -13.737   2.215
   91    H    ALA  14           H        ALA  14   1.854 -10.403   2.872
   92    HA   ALA  14           HA       ALA  14   0.406  -8.815   4.693
   93   1HB   ALA  14          1HB       ALA  14   2.418  -8.320   5.656
   94   2HB   ALA  14          2HB       ALA  14   2.885  -9.748   4.730
   95   3HB   ALA  14          3HB       ALA  14   3.242  -8.136   4.108
   96    H    ALA  15           H        ALA  15   2.582  -7.759   2.078
   97    HA   ALA  15           HA       ALA  15   1.704  -5.083   2.051
   98   1HB   ALA  15          1HB       ALA  15   3.368  -4.827   0.604
   99   2HB   ALA  15          2HB       ALA  15   3.669  -6.557   0.755
  100   3HB   ALA  15          3HB       ALA  15   2.636  -5.953  -0.539
  101    H    ASP  16           H        ASP  16   0.494  -7.960   0.496
  102    HA   ASP  16           HA       ASP  16  -1.149  -6.709  -1.450
  103   1HB   ASP  16          1HB       ASP  16  -0.440  -9.310  -0.882
  104   2HB   ASP  16          2HB       ASP  16  -2.135  -9.268  -0.405
  105    H    ALA  17           H        ALA  17  -1.622  -7.651   1.903
  106    HA   ALA  17           HA       ALA  17  -4.393  -7.158   2.059
  107   1HB   ALA  17          1HB       ALA  17  -2.228  -7.682   3.912
  108   2HB   ALA  17          2HB       ALA  17  -3.371  -6.505   4.558
  109   3HB   ALA  17          3HB       ALA  17  -3.939  -8.089   4.035
  110    H    LEU  18           H        LEU  18  -1.581  -5.074   2.288
  111    HA   LEU  18           HA       LEU  18  -2.975  -2.745   3.137
  112   1HB   LEU  18          1HB       LEU  18  -0.347  -3.085   1.698
  113   2HB   LEU  18          2HB       LEU  18  -0.946  -1.548   2.290
  114    HG   LEU  18           HG       LEU  18   0.018  -3.914   3.863
  115   1HD1  LEU  18          1HD1      LEU  18   1.151  -1.894   5.036
  116   2HD1  LEU  18          2HD1      LEU  18   1.765  -2.451   3.478
  117   3HD1  LEU  18          3HD1      LEU  18   0.726  -1.029   3.558
  118   1HD2  LEU  18          1HD2      LEU  18  -2.097  -2.016   4.595
  119   2HD2  LEU  18          2HD2      LEU  18  -1.685  -3.583   5.291
  120   3HD2  LEU  18          3HD2      LEU  18  -0.785  -2.141   5.768
  121    H    ALA  19           H        ALA  19  -1.874  -3.921  -0.024
  122    HA   ALA  19           HA       ALA  19  -2.877  -1.897  -1.635
  123   1HB   ALA  19          1HB       ALA  19  -2.746  -3.412  -3.448
  124   2HB   ALA  19          2HB       ALA  19  -1.462  -3.880  -2.332
  125   3HB   ALA  19          3HB       ALA  19  -2.961  -4.809  -2.394
  126    H    ALA  20           H        ALA  20  -4.500  -4.790  -0.402
  127    HA   ALA  20           HA       ALA  20  -7.008  -4.327  -1.597
  128   1HB   ALA  20          1HB       ALA  20  -6.281  -6.481  -0.602
  129   2HB   ALA  20          2HB       ALA  20  -6.466  -5.764   0.999
  130   3HB   ALA  20          3HB       ALA  20  -7.872  -5.956  -0.048
  131    H    ALA  21           H        ALA  21  -5.724  -3.457   1.597
  132    HA   ALA  21           HA       ALA  21  -8.054  -2.286   2.632
  133   1HB   ALA  21          1HB       ALA  21  -5.152  -2.095   3.275
  134   2HB   ALA  21          2HB       ALA  21  -6.277  -0.969   4.036
  135   3HB   ALA  21          3HB       ALA  21  -6.485  -2.708   4.252
  136    H    LYS  22           H        LYS  22  -5.392  -0.887   0.746
  137    HA   LYS  22           HA       LYS  22  -6.289   1.800   0.971
  138   1HB   LYS  22          1HB       LYS  22  -4.225   0.332  -0.535
  139   2HB   LYS  22          2HB       LYS  22  -4.827   1.782  -1.328
  140   1HG   LYS  22          1HG       LYS  22  -3.026   2.574  -0.117
  141   2HG   LYS  22          2HG       LYS  22  -4.392   2.923   0.946
  142   1HD   LYS  22          1HD       LYS  22  -3.878   1.145   2.385
  143   2HD   LYS  22          2HD       LYS  22  -2.836   0.367   1.193
  144   1HE   LYS  22          2HE       LYS  22  -1.405   1.321   2.818
  145   2HE   LYS  22          1HE       LYS  22  -1.308   2.358   1.397
  146   1HZ   LYS  22          1HZ       LYS  22  -1.706   3.281   3.849
  147   2HZ   LYS  22          2HZ       LYS  22  -3.323   3.083   3.370
  148   3HZ   LYS  22          3HZ       LYS  22  -2.279   4.065   2.461
  149    H    LYS  23           H        LYS  23  -6.827  -0.804  -1.317
  150    HA   LYS  23           HA       LYS  23  -8.298   0.694  -3.215
  151   1HB   LYS  23          1HB       LYS  23  -7.275  -1.686  -3.400
  152   2HB   LYS  23          2HB       LYS  23  -8.786  -2.220  -2.678
  153   1HG   LYS  23          1HG       LYS  23  -9.942  -0.955  -4.553
  154   2HG   LYS  23          2HG       LYS  23  -8.355  -0.870  -5.318
  155   1HD   LYS  23          1HD       LYS  23  -9.248  -3.526  -4.353
  156   2HD   LYS  23          2HD       LYS  23 -10.074  -2.868  -5.767
  157   1HE   LYS  23          2HE       LYS  23  -8.260  -3.100  -7.091
  158   2HE   LYS  23          1HE       LYS  23  -7.143  -2.641  -5.807
  159   1HZ   LYS  23          1HZ       LYS  23  -7.743  -4.949  -4.850
  160   2HZ   LYS  23          2HZ       LYS  23  -6.640  -4.849  -6.137
  161   3HZ   LYS  23          3HZ       LYS  23  -8.252  -5.298  -6.430
  162    H    THR  24           H        THR  24  -9.225  -1.229  -0.407
  163    HA   THR  24           HA       THR  24 -11.984  -1.011  -0.620
  164    HB   THR  24           HB       THR  24 -10.095  -1.471   1.653
  165    HG1  THR  24           1HG      THR  24 -11.790  -3.013   0.000
  166   1HG2  THR  24          1HG2      THR  24 -11.650  -1.090   3.168
  167   2HG2  THR  24          2HG2      THR  24 -12.720  -2.247   2.374
  168   3HG2  THR  24          3HG2      THR  24 -12.747  -0.548   1.902
  169    H    ALA  25           H        ALA  25  -9.613   1.047   1.031
  170    HA   ALA  25           HA       ALA  25 -11.401   2.909   2.115
  171   1HB   ALA  25          1HB       ALA  25  -9.140   2.931   2.835
  172   2HB   ALA  25          2HB       ALA  25  -8.550   3.214   1.198
  173   3HB   ALA  25          3HB       ALA  25  -9.443   4.477   2.045
  174    H    ALA  26           H        ALA  26  -9.777   2.857  -1.033
  175    HA   ALA  26           HA       ALA  26 -10.874   5.255  -2.031
  176   1HB   ALA  26          1HB       ALA  26  -9.529   2.891  -3.191
  177   2HB   ALA  26          2HB       ALA  26 -10.479   3.887  -4.294
  178   3HB   ALA  26          3HB       ALA  26  -9.161   4.606  -3.368
  179    H    ASP  27           H        ASP  27 -11.974   1.911  -2.165
  180    HA   ASP  27           HA       ASP  27 -14.233   2.203  -3.764
  181   1HB   ASP  27          1HB       ASP  27 -13.148   0.081  -2.728
  182   2HB   ASP  27          2HB       ASP  27 -14.204   0.393  -1.357
  183    H    ALA  28           H        ALA  28 -13.944   2.443  -0.230
  184    HA   ALA  28           HA       ALA  28 -16.638   3.127   0.252
  185   1HB   ALA  28          1HB       ALA  28 -14.133   3.078   1.791
  186   2HB   ALA  28          2HB       ALA  28 -15.338   4.233   2.359
  187   3HB   ALA  28          3HB       ALA  28 -15.749   2.523   2.227
  188    H    ALA  29           H        ALA  29 -13.795   5.053  -0.491
  189    HA   ALA  29           HA       ALA  29 -14.916   7.590   0.090
  190   1HB   ALA  29          1HB       ALA  29 -12.501   6.572  -1.224
  191   2HB   ALA  29          2HB       ALA  29 -13.062   8.130  -1.830
  192   3HB   ALA  29          3HB       ALA  29 -12.706   7.927  -0.114
  193    H    ALA  30           H        ALA  30 -14.805   5.607  -2.836
  194    HA   ALA  30           HA       ALA  30 -16.064   7.589  -4.483
  195   1HB   ALA  30          1HB       ALA  30 -14.826   5.048  -4.851
  196   2HB   ALA  30          2HB       ALA  30 -16.408   5.036  -5.631
  197   3HB   ALA  30          3HB       ALA  30 -15.225   6.276  -6.053
  198    H    ALA  31           H        ALA  31 -17.159   5.209  -2.272
  199    HA   ALA  31           HA       ALA  31 -19.806   4.933  -3.286
  200   1HB   ALA  31          1HB       ALA  31 -18.501   4.242  -0.683
  201   2HB   ALA  31          2HB       ALA  31 -20.247   4.098  -0.887
  202   3HB   ALA  31          3HB       ALA  31 -19.158   3.165  -1.915
  203    H    ALA  32           H        ALA  32 -18.184   7.317  -1.625
  204    HA   ALA  32           HA       ALA  32 -20.638   8.556  -0.608
  205   1HB   ALA  32          1HB       ALA  32 -18.308   8.257   0.669
  206   2HB   ALA  32          2HB       ALA  32 -18.007   9.814  -0.101
  207   3HB   ALA  32          3HB       ALA  32 -19.396   9.612   0.969
  208    H    ALA  33           H        ALA  33 -20.358   8.479  -3.358
  209    HA   ALA  33           HA       ALA  33 -19.156  10.796  -4.462
  210   1HB   ALA  33          1HB       ALA  33 -21.468   9.785  -5.929
  211   2HB   ALA  33          2HB       ALA  33 -19.778   9.904  -6.420
  212   3HB   ALA  33          3HB       ALA  33 -20.325   8.518  -5.476
  213    H    ALA  34           H        ALA  34 -22.508  10.000  -3.607
  214    HA   ALA  34           HA       ALA  34 -23.110  12.885  -3.609
  215   1HB   ALA  34          1HB       ALA  34 -25.362  10.996  -3.484
  216   2HB   ALA  34          2HB       ALA  34 -25.156  12.456  -4.452
  217   3HB   ALA  34          3HB       ALA  34 -24.420  10.944  -4.973
  218    H    ALA  35           H        ALA  35 -21.852  12.565  -1.488
  219    HA   ALA  35           HA       ALA  35 -23.563  11.577   0.668
  220   1HB   ALA  35          1HB       ALA  35 -21.106  12.576   1.675
  221   2HB   ALA  35          2HB       ALA  35 -21.649  10.902   1.569
  222   3HB   ALA  35          3HB       ALA  35 -20.751  11.622   0.235
  Start of MODEL   13
    1   1H    GLY   1          1H        GLY   1   9.967 -26.271  -4.178
    2   2H    GLY   1          2H        GLY   1   9.344 -26.157  -2.602
    3   3H    GLY   1          3H        GLY   1  10.773 -27.023  -2.888
    4   1HA   GLY   1          2HA       GLY   1  11.362 -24.940  -1.930
    5   2HA   GLY   1          1HA       GLY   1  11.851 -24.947  -3.621
    6    H    SER   2           H        SER   2  11.824 -22.632  -3.521
    7    HA   SER   2           HA       SER   2   9.417 -21.218  -2.924
    8   1HB   SER   2          1HB       SER   2  11.501 -19.856  -4.515
    9   2HB   SER   2          2HB       SER   2  10.719 -19.356  -3.015
   10    HG   SER   2           HG       SER   2  12.251 -20.274  -1.888
   11    H    MET   3           H        MET   3   8.082 -22.521  -4.427
   12    HA   MET   3           HA       MET   3   8.074 -21.287  -7.101
   13   1HB   MET   3          1HB       MET   3   8.797 -23.611  -7.291
   14   2HB   MET   3          2HB       MET   3   7.379 -24.145  -6.398
   15   1HG   MET   3          1HG       MET   3   6.282 -22.712  -8.461
   16   2HG   MET   3          2HG       MET   3   7.678 -23.479  -9.215
   17   1HE   MET   3          1HE       MET   3   8.264 -25.988  -8.671
   18   2HE   MET   3          2HE       MET   3   7.028 -27.186  -9.064
   19   3HE   MET   3          3HE       MET   3   7.454 -25.942 -10.238
   20    H    ASN   4           H        ASN   4   6.100 -22.937  -4.646
   21    HA   ASN   4           HA       ASN   4   3.633 -22.057  -5.808
   22   1HB   ASN   4          1HB       ASN   4   2.780 -22.842  -3.452
   23   2HB   ASN   4          2HB       ASN   4   3.297 -24.024  -4.649
   24   1HD2  ASN   4          1HD2      ASN   4   5.098 -25.226  -4.282
   25   2HD2  ASN   4          2HD2      ASN   4   5.945 -25.224  -2.767
   26    H    ALA   5           H        ALA   5   1.993 -20.932  -4.292
   27    HA   ALA   5           HA       ALA   5   2.893 -18.292  -3.934
   28   1HB   ALA   5          1HB       ALA   5   0.370 -19.735  -3.572
   29   2HB   ALA   5          2HB       ALA   5   0.568 -18.330  -2.521
   30   3HB   ALA   5          3HB       ALA   5   0.688 -18.147  -4.272
   31    HA   PRO   6           HA       PRO   6   2.584 -19.225   0.951
   32   1HB   PRO   6          1HB       PRO   6   3.469 -22.064   0.650
   33   2HB   PRO   6          2HB       PRO   6   2.469 -21.327   1.902
   34   1HG   PRO   6          1HG       PRO   6   1.337 -22.770   0.005
   35   2HG   PRO   6          2HG       PRO   6   0.584 -21.252   0.532
   36   1HD   PRO   6          1HD       PRO   6   2.150 -21.832  -1.941
   37   2HD   PRO   6          2HD       PRO   6   0.742 -20.782  -1.715
   38    H    ALA   7           H        ALA   7   4.800 -20.819  -1.269
   39    HA   ALA   7           HA       ALA   7   7.119 -20.622   0.330
   40   1HB   ALA   7          1HB       ALA   7   7.682 -22.047  -1.286
   41   2HB   ALA   7          2HB       ALA   7   6.487 -21.387  -2.402
   42   3HB   ALA   7          3HB       ALA   7   8.065 -20.615  -2.242
   43    H    ARG   8           H        ARG   8   5.410 -18.249  -1.387
   44    HA   ARG   8           HA       ARG   8   7.626 -16.356  -0.982
   45   1HB   ARG   8          1HB       ARG   8   5.736 -15.440  -2.970
   46   2HB   ARG   8          2HB       ARG   8   7.487 -15.581  -3.076
   47   1HG   ARG   8          1HG       ARG   8   7.358 -17.444  -4.277
   48   2HG   ARG   8          2HG       ARG   8   6.135 -18.136  -3.215
   49   1HD   ARG   8          1HD       ARG   8   4.382 -17.039  -4.355
   50   2HD   ARG   8          2HD       ARG   8   5.504 -15.975  -5.200
   51    HE   ARG   8           HE       ARG   8   5.480 -18.872  -5.724
   52   1HH1  ARG   8          2HH1      ARG   8   5.247 -15.562  -6.837
   53   2HH1  ARG   8          1HH1      ARG   8   5.197 -15.994  -8.515
   54   1HH2  ARG   8          2HH2      ARG   8   5.440 -19.443  -7.943
   55   2HH2  ARG   8          1HH2      ARG   8   5.316 -18.188  -9.148
   56    H    ALA   9           H        ALA   9   5.208 -17.215   0.617
   57    HA   ALA   9           HA       ALA   9   3.467 -14.889   0.519
   58   1HB   ALA   9          1HB       ALA   9   3.301 -17.606   1.644
   59   2HB   ALA   9          2HB       ALA   9   2.475 -16.343   2.557
   60   3HB   ALA   9          3HB       ALA   9   2.065 -16.617   0.864
   61    H    ALA  10           H        ALA  10   6.328 -14.919   1.606
   62    HA   ALA  10           HA       ALA  10   6.217 -14.504   4.390
   63   1HB   ALA  10          1HB       ALA  10   8.257 -14.894   2.849
   64   2HB   ALA  10          2HB       ALA  10   8.233 -13.142   2.652
   65   3HB   ALA  10          3HB       ALA  10   8.436 -13.847   4.258
   66    H    ALA  11           H        ALA  11   6.759 -12.012   1.889
   67    HA   ALA  11           HA       ALA  11   5.470 -10.084   3.709
   68   1HB   ALA  11          1HB       ALA  11   7.179  -9.129   1.482
   69   2HB   ALA  11          2HB       ALA  11   6.982  -8.492   3.115
   70   3HB   ALA  11          3HB       ALA  11   7.977  -9.924   2.841
   71    H    LYS  12           H        LYS  12   5.214 -11.624   0.685
   72    HA   LYS  12           HA       LYS  12   3.983  -9.721  -0.922
   73   1HB   LYS  12          1HB       LYS  12   4.512 -12.471  -1.069
   74   2HB   LYS  12          2HB       LYS  12   2.776 -12.319  -1.304
   75   1HG   LYS  12          1HG       LYS  12   4.437 -10.425  -2.827
   76   2HG   LYS  12          2HG       LYS  12   4.582 -12.123  -3.285
   77   1HD   LYS  12          1HD       LYS  12   2.740 -11.821  -4.509
   78   2HD   LYS  12          2HD       LYS  12   1.855 -11.739  -2.985
   79   1HE   LYS  12          2HE       LYS  12   2.088  -9.337  -2.930
   80   2HE   LYS  12          1HE       LYS  12   3.096  -9.371  -4.376
   81   1HZ   LYS  12          1HZ       LYS  12   1.077 -10.458  -5.470
   82   2HZ   LYS  12          2HZ       LYS  12   1.001  -8.796  -5.151
   83   3HZ   LYS  12          3HZ       LYS  12   0.195  -9.890  -4.134
   84    H    THR  13           H        THR  13   2.321 -12.222   0.997
   85    HA   THR  13           HA       THR  13  -0.275 -11.340   0.651
   86    HB   THR  13           HB       THR  13   0.069 -12.399   3.298
   87    HG1  THR  13           1HG      THR  13   1.660 -13.759   3.008
   88   1HG2  THR  13          1HG2      THR  13  -0.926 -14.438   1.888
   89   2HG2  THR  13          2HG2      THR  13  -1.210 -13.140   0.729
   90   3HG2  THR  13          3HG2      THR  13  -1.898 -13.042   2.348
   91    H    ALA  14           H        ALA  14   2.166 -10.274   2.909
   92    HA   ALA  14           HA       ALA  14   0.468  -8.808   4.642
   93   1HB   ALA  14          1HB       ALA  14   2.513  -7.752   5.456
   94   2HB   ALA  14          2HB       ALA  14   2.716  -9.498   5.312
   95   3HB   ALA  14          3HB       ALA  14   3.412  -8.424   4.094
   96    H    ALA  15           H        ALA  15   2.594  -7.776   1.975
   97    HA   ALA  15           HA       ALA  15   1.678  -5.093   1.949
   98   1HB   ALA  15          1HB       ALA  15   3.676  -6.538   0.678
   99   2HB   ALA  15          2HB       ALA  15   2.612  -6.021  -0.630
  100   3HB   ALA  15          3HB       ALA  15   3.314  -4.826   0.460
  101    H    ASP  16           H        ASP  16   0.531  -8.038   0.468
  102    HA   ASP  16           HA       ASP  16  -1.169  -6.856  -1.463
  103   1HB   ASP  16          1HB       ASP  16  -0.426  -9.488  -0.580
  104   2HB   ASP  16          2HB       ASP  16  -2.179  -9.384  -0.676
  105    H    ALA  17           H        ALA  17  -1.405  -7.480   1.921
  106    HA   ALA  17           HA       ALA  17  -4.234  -7.342   2.163
  107   1HB   ALA  17          1HB       ALA  17  -2.224  -8.048   3.847
  108   2HB   ALA  17          2HB       ALA  17  -2.654  -6.457   4.473
  109   3HB   ALA  17          3HB       ALA  17  -3.882  -7.718   4.353
  110    H    LEU  18           H        LEU  18  -1.619  -4.970   2.434
  111    HA   LEU  18           HA       LEU  18  -3.322  -2.804   3.147
  112   1HB   LEU  18          1HB       LEU  18  -0.847  -2.162   1.675
  113   2HB   LEU  18          2HB       LEU  18  -1.474  -1.491   3.164
  114    HG   LEU  18           HG       LEU  18  -0.312  -4.246   3.157
  115   1HD1  LEU  18          1HD1      LEU  18   1.093  -1.664   2.818
  116   2HD1  LEU  18          2HD1      LEU  18   1.801  -2.854   3.915
  117   3HD1  LEU  18          3HD1      LEU  18   1.513  -3.269   2.226
  118   1HD2  LEU  18          1HD2      LEU  18  -1.179  -3.856   5.236
  119   2HD2  LEU  18          2HD2      LEU  18   0.432  -3.168   5.455
  120   3HD2  LEU  18          3HD2      LEU  18  -0.942  -2.110   5.127
  121    H    ALA  19           H        ALA  19  -2.078  -4.082   0.112
  122    HA   ALA  19           HA       ALA  19  -3.020  -2.195  -1.673
  123   1HB   ALA  19          1HB       ALA  19  -2.073  -4.852  -1.829
  124   2HB   ALA  19          2HB       ALA  19  -3.580  -4.784  -2.743
  125   3HB   ALA  19          3HB       ALA  19  -2.260  -3.682  -3.136
  126    H    ALA  20           H        ALA  20  -4.781  -4.949  -0.265
  127    HA   ALA  20           HA       ALA  20  -7.271  -4.353  -1.467
  128   1HB   ALA  20          1HB       ALA  20  -8.210  -5.928   0.095
  129   2HB   ALA  20          2HB       ALA  20  -6.671  -6.552  -0.499
  130   3HB   ALA  20          3HB       ALA  20  -6.770  -5.835   1.108
  131    H    ALA  21           H        ALA  21  -5.853  -3.515   1.675
  132    HA   ALA  21           HA       ALA  21  -8.078  -2.210   2.776
  133   1HB   ALA  21          1HB       ALA  21  -5.725  -0.907   3.675
  134   2HB   ALA  21          2HB       ALA  21  -6.697  -2.118   4.507
  135   3HB   ALA  21          3HB       ALA  21  -5.357  -2.621   3.476
  136    H    LYS  22           H        LYS  22  -5.473  -0.998   0.708
  137    HA   LYS  22           HA       LYS  22  -6.311   1.731   0.849
  138   1HB   LYS  22          1HB       LYS  22  -4.253   0.173  -0.539
  139   2HB   LYS  22          2HB       LYS  22  -4.879   1.504  -1.497
  140   1HG   LYS  22          1HG       LYS  22  -2.815   1.829   0.070
  141   2HG   LYS  22          2HG       LYS  22  -4.027   3.100  -0.101
  142   1HD   LYS  22          1HD       LYS  22  -4.039   3.070   2.150
  143   2HD   LYS  22          2HD       LYS  22  -5.061   1.648   1.952
  144   1HE   LYS  22          2HE       LYS  22  -3.179   1.339   3.550
  145   2HE   LYS  22          1HE       LYS  22  -3.201   0.180   2.222
  146   1HZ   LYS  22          1HZ       LYS  22  -1.019   1.436   2.936
  147   2HZ   LYS  22          2HZ       LYS  22  -1.619   2.616   1.874
  148   3HZ   LYS  22          3HZ       LYS  22  -1.326   1.041   1.315
  149    H    LYS  23           H        LYS  23  -6.828  -0.931  -1.368
  150    HA   LYS  23           HA       LYS  23  -8.253   0.400  -3.378
  151   1HB   LYS  23          1HB       LYS  23  -7.359  -2.018  -3.332
  152   2HB   LYS  23          2HB       LYS  23  -8.848  -2.418  -2.491
  153   1HG   LYS  23          1HG       LYS  23 -10.036  -1.322  -4.484
  154   2HG   LYS  23          2HG       LYS  23  -8.479  -1.465  -5.302
  155   1HD   LYS  23          1HD       LYS  23  -9.231  -3.502  -5.890
  156   2HD   LYS  23          2HD       LYS  23  -8.746  -3.956  -4.254
  157   1HE   LYS  23          2HE       LYS  23 -11.186  -3.058  -3.707
  158   2HE   LYS  23          1HE       LYS  23 -11.452  -3.507  -5.391
  159   1HZ   LYS  23          1HZ       LYS  23 -11.167  -5.709  -4.950
  160   2HZ   LYS  23          2HZ       LYS  23 -11.797  -5.218  -3.453
  161   3HZ   LYS  23          3HZ       LYS  23 -10.125  -5.450  -3.636
  162    H    THR  24           H        THR  24  -9.292  -1.147  -0.397
  163    HA   THR  24           HA       THR  24 -12.038  -0.764  -0.650
  164    HB   THR  24           HB       THR  24 -10.292  -0.991   1.773
  165    HG1  THR  24           1HG      THR  24 -10.059  -2.851   0.621
  166   1HG2  THR  24          1HG2      THR  24 -12.627  -0.071   2.059
  167   2HG2  THR  24          2HG2      THR  24 -12.176  -1.463   3.043
  168   3HG2  THR  24          3HG2      THR  24 -13.185  -1.680   1.614
  169    H    ALA  25           H        ALA  25  -9.529   1.154   0.992
  170    HA   ALA  25           HA       ALA  25 -11.114   3.117   2.135
  171   1HB   ALA  25          1HB       ALA  25  -9.172   4.131   2.657
  172   2HB   ALA  25          2HB       ALA  25  -8.445   2.658   2.014
  173   3HB   ALA  25          3HB       ALA  25  -8.585   4.091   0.995
  174    H    ALA  26           H        ALA  26  -9.620   3.089  -1.069
  175    HA   ALA  26           HA       ALA  26 -10.704   5.547  -1.945
  176   1HB   ALA  26          1HB       ALA  26 -10.220   4.545  -4.259
  177   2HB   ALA  26          2HB       ALA  26  -8.863   4.789  -3.160
  178   3HB   ALA  26          3HB       ALA  26  -9.548   3.178  -3.371
  179    H    ASP  27           H        ASP  27 -11.804   2.214  -2.227
  180    HA   ASP  27           HA       ASP  27 -13.979   2.630  -3.948
  181   1HB   ASP  27          1HB       ASP  27 -12.902   0.413  -3.087
  182   2HB   ASP  27          2HB       ASP  27 -14.064   0.566  -1.775
  183    H    ALA  28           H        ALA  28 -13.815   2.547  -0.415
  184    HA   ALA  28           HA       ALA  28 -16.575   2.793   0.053
  185   1HB   ALA  28          1HB       ALA  28 -14.697   3.939   2.036
  186   2HB   ALA  28          2HB       ALA  28 -16.047   2.828   2.261
  187   3HB   ALA  28          3HB       ALA  28 -14.512   2.233   1.631
  188    H    ALA  29           H        ALA  29 -14.056   5.195  -0.413
  189    HA   ALA  29           HA       ALA  29 -15.665   7.427   0.355
  190   1HB   ALA  29          1HB       ALA  29 -12.956   6.974  -0.571
  191   2HB   ALA  29          2HB       ALA  29 -13.673   8.411  -1.298
  192   3HB   ALA  29          3HB       ALA  29 -13.599   8.254   0.457
  193    H    ALA  30           H        ALA  30 -14.911   5.825  -2.692
  194    HA   ALA  30           HA       ALA  30 -16.141   7.856  -4.306
  195   1HB   ALA  30          1HB       ALA  30 -15.921   5.832  -6.019
  196   2HB   ALA  30          2HB       ALA  30 -14.547   6.832  -5.550
  197   3HB   ALA  30          3HB       ALA  30 -14.797   5.264  -4.786
  198    H    ALA  31           H        ALA  31 -17.077   4.723  -3.021
  199    HA   ALA  31           HA       ALA  31 -19.620   4.802  -4.436
  200   1HB   ALA  31          1HB       ALA  31 -17.952   2.756  -3.415
  201   2HB   ALA  31          2HB       ALA  31 -19.501   2.655  -2.575
  202   3HB   ALA  31          3HB       ALA  31 -19.447   2.593  -4.337
  203    H    ALA  32           H        ALA  32 -18.742   6.602  -2.079
  204    HA   ALA  32           HA       ALA  32 -20.915   6.005  -0.219
  205   1HB   ALA  32          1HB       ALA  32 -19.947   7.719   1.203
  206   2HB   ALA  32          2HB       ALA  32 -18.703   6.572   0.704
  207   3HB   ALA  32          3HB       ALA  32 -18.803   8.157  -0.065
  208    H    ALA  33           H        ALA  33 -22.193   6.527  -2.375
  209    HA   ALA  33           HA       ALA  33 -22.610   9.212  -3.102
  210   1HB   ALA  33          1HB       ALA  33 -24.774   7.140  -3.230
  211   2HB   ALA  33          2HB       ALA  33 -24.442   8.466  -4.342
  212   3HB   ALA  33          3HB       ALA  33 -23.372   7.063  -4.296
  213    H    ALA  34           H        ALA  34 -24.749   7.131  -1.179
  214    HA   ALA  34           HA       ALA  34 -25.293   9.414   0.587
  215   1HB   ALA  34          1HB       ALA  34 -27.166   9.066  -1.035
  216   2HB   ALA  34          2HB       ALA  34 -27.408   7.474  -0.322
  217   3HB   ALA  34          3HB       ALA  34 -27.629   8.920   0.660
  218    H    ALA  35           H        ALA  35 -23.438   7.949   1.464
  219    HA   ALA  35           HA       ALA  35 -24.534   5.692   2.985
  220   1HB   ALA  35          1HB       ALA  35 -21.647   6.117   3.132
  221   2HB   ALA  35          2HB       ALA  35 -22.564   4.656   2.767
  222   3HB   ALA  35          3HB       ALA  35 -22.243   5.836   1.497
  Start of MODEL   14
    1   1H    GLY   1          1H        GLY   1  24.050 -10.138  11.215
    2   2H    GLY   1          2H        GLY   1  24.069 -10.637   9.594
    3   3H    GLY   1          3H        GLY   1  22.620 -10.643  10.466
    4   1HA   GLY   1          2HA       GLY   1  23.568  -8.065  10.667
    5   2HA   GLY   1          1HA       GLY   1  23.801  -8.536   8.988
    6    H    SER   2           H        SER   2  22.116  -6.590   9.208
    7    HA   SER   2           HA       SER   2  19.413  -7.422   9.708
    8   1HB   SER   2          1HB       SER   2  19.686  -4.934   8.227
    9   2HB   SER   2          2HB       SER   2  19.074  -5.207   9.862
   10    HG   SER   2           HG       SER   2  21.241  -3.979   9.325
   11    H    MET   3           H        MET   3  20.161  -9.211   7.934
   12    HA   MET   3           HA       MET   3  18.667  -8.450   5.545
   13   1HB   MET   3          1HB       MET   3  21.486  -8.854   5.573
   14   2HB   MET   3          2HB       MET   3  20.758 -10.214   4.729
   15   1HG   MET   3          1HG       MET   3  19.447  -8.437   3.426
   16   2HG   MET   3          2HG       MET   3  20.647  -7.307   4.049
   17   1HE   MET   3          1HE       MET   3  20.994  -9.536   0.286
   18   2HE   MET   3          2HE       MET   3  19.830 -10.086   1.493
   19   3HE   MET   3          3HE       MET   3  19.813  -8.406   0.951
   20    H    ASN   4           H        ASN   4  17.220  -9.704   7.110
   21    HA   ASN   4           HA       ASN   4  17.635 -12.586   6.993
   22   1HB   ASN   4          1HB       ASN   4  15.165 -12.173   8.186
   23   2HB   ASN   4          2HB       ASN   4  16.686 -12.451   9.023
   24   1HD2  ASN   4          1HD2      ASN   4  16.670 -11.174  10.719
   25   2HD2  ASN   4          2HD2      ASN   4  16.317  -9.475  10.703
   26    H    ALA   5           H        ALA   5  17.059 -13.529   5.182
   27    HA   ALA   5           HA       ALA   5  15.340 -12.494   3.253
   28   1HB   ALA   5          1HB       ALA   5  17.113 -14.389   3.107
   29   2HB   ALA   5          2HB       ALA   5  15.746 -15.439   3.477
   30   3HB   ALA   5          3HB       ALA   5  15.706 -14.415   2.041
   31    HA   PRO   6           HA       PRO   6  11.927 -15.596   4.817
   32   1HB   PRO   6          1HB       PRO   6  11.988 -16.163   7.496
   33   2HB   PRO   6          2HB       PRO   6  12.687 -17.200   6.252
   34   1HG   PRO   6          1HG       PRO   6  14.026 -15.211   8.031
   35   2HG   PRO   6          2HG       PRO   6  14.561 -16.835   7.557
   36   1HD   PRO   6          1HD       PRO   6  15.560 -14.628   6.406
   37   2HD   PRO   6          2HD       PRO   6  15.310 -16.116   5.488
   38    H    ALA   7           H        ALA   7  13.237 -13.058   6.796
   39    HA   ALA   7           HA       ALA   7  10.764 -12.321   8.029
   40   1HB   ALA   7          1HB       ALA   7  11.970 -10.832   9.227
   41   2HB   ALA   7          2HB       ALA   7  13.327 -11.792   8.634
   42   3HB   ALA   7          3HB       ALA   7  12.889 -10.288   7.822
   43    H    ARG   8           H        ARG   8  12.240 -11.700   5.025
   44    HA   ARG   8           HA       ARG   8  10.539  -9.386   4.494
   45   1HB   ARG   8          1HB       ARG   8  13.031 -10.484   3.305
   46   2HB   ARG   8          2HB       ARG   8  11.943  -9.593   2.241
   47   1HG   ARG   8          1HG       ARG   8  12.726  -7.682   3.032
   48   2HG   ARG   8          2HG       ARG   8  12.203  -8.138   4.653
   49   1HD   ARG   8          1HD       ARG   8  14.508  -9.611   4.261
   50   2HD   ARG   8          2HD       ARG   8  14.873  -8.050   3.524
   51    HE   ARG   8           HE       ARG   8  13.808  -8.219   6.262
   52   1HH1  ARG   8          2HH1      ARG   8  16.354  -7.257   4.050
   53   2HH1  ARG   8          1HH1      ARG   8  17.140  -6.249   5.225
   54   1HH2  ARG   8          2HH2      ARG   8  14.825  -6.902   7.783
   55   2HH2  ARG   8          1HH2      ARG   8  16.265  -6.021   7.343
   56    H    ALA   9           H        ALA   9  10.155 -12.590   4.373
   57    HA   ALA   9           HA       ALA   9   9.036 -12.854   1.727
   58   1HB   ALA   9          1HB       ALA   9   9.784 -14.903   2.302
   59   2HB   ALA   9          2HB       ALA   9   9.522 -14.637   4.024
   60   3HB   ALA   9          3HB       ALA   9   8.163 -15.059   2.982
   61    H    ALA  10           H        ALA  10   7.912 -12.111   4.923
   62    HA   ALA  10           HA       ALA  10   5.151 -12.662   4.474
   63   1HB   ALA  10          1HB       ALA  10   4.773 -11.834   6.612
   64   2HB   ALA  10          2HB       ALA  10   6.426 -12.440   6.712
   65   3HB   ALA  10          3HB       ALA  10   6.131 -10.711   6.525
   66    H    ALA  11           H        ALA  11   7.211 -10.204   3.430
   67    HA   ALA  11           HA       ALA  11   5.567  -7.942   3.415
   68   1HB   ALA  11          1HB       ALA  11   8.066  -8.193   2.839
   69   2HB   ALA  11          2HB       ALA  11   7.497  -8.533   1.205
   70   3HB   ALA  11          3HB       ALA  11   7.115  -6.989   1.967
   71    H    LYS  12           H        LYS  12   5.580 -10.782   1.417
   72    HA   LYS  12           HA       LYS  12   4.121  -9.801  -0.782
   73   1HB   LYS  12          1HB       LYS  12   5.269 -12.207  -0.113
   74   2HB   LYS  12          2HB       LYS  12   3.554 -12.579  -0.027
   75   1HG   LYS  12          1HG       LYS  12   4.333 -11.074  -2.413
   76   2HG   LYS  12          2HG       LYS  12   5.063 -12.675  -2.284
   77   1HD   LYS  12          1HD       LYS  12   3.156 -13.618  -2.916
   78   2HD   LYS  12          2HD       LYS  12   2.310 -12.861  -1.566
   79   1HE   LYS  12          2HE       LYS  12   1.290 -11.428  -2.928
   80   2HE   LYS  12          1HE       LYS  12   2.827 -10.935  -3.637
   81   1HZ   LYS  12          1HZ       LYS  12   1.269 -13.333  -4.446
   82   2HZ   LYS  12          2HZ       LYS  12   2.712 -12.787  -5.155
   83   3HZ   LYS  12          3HZ       LYS  12   1.300 -11.857  -5.283
   84    H    THR  13           H        THR  13   3.058 -11.407   2.190
   85    HA   THR  13           HA       THR  13   0.285 -11.216   1.601
   86    HB   THR  13           HB       THR  13   1.146 -11.565   4.413
   87    HG1  THR  13           1HG      THR  13   1.768 -13.521   2.418
   88   1HG2  THR  13          1HG2      THR  13  -1.125 -12.077   2.996
   89   2HG2  THR  13          2HG2      THR  13  -0.704 -12.854   4.524
   90   3HG2  THR  13          3HG2      THR  13  -0.353 -13.662   2.996
   91    H    ALA  14           H        ALA  14   2.628  -9.286   3.360
   92    HA   ALA  14           HA       ALA  14   0.811  -7.561   4.665
   93   1HB   ALA  14          1HB       ALA  14   3.655  -7.730   4.291
   94   2HB   ALA  14          2HB       ALA  14   3.110  -6.066   4.077
   95   3HB   ALA  14          3HB       ALA  14   2.741  -6.929   5.571
   96    H    ALA  15           H        ALA  15   2.661  -7.121   1.638
   97    HA   ALA  15           HA       ALA  15   1.292  -4.764   0.852
   98   1HB   ALA  15          1HB       ALA  15   2.961  -4.749  -0.619
   99   2HB   ALA  15          2HB       ALA  15   3.384  -6.405  -0.187
  100   3HB   ALA  15          3HB       ALA  15   2.209  -6.100  -1.465
  101    H    ASP  16           H        ASP  16   0.584  -8.121   0.637
  102    HA   ASP  16           HA       ASP  16  -1.405  -8.136  -1.357
  103   1HB   ASP  16          1HB       ASP  16  -0.304 -10.142  -0.169
  104   2HB   ASP  16          2HB       ASP  16  -1.420  -9.818   1.149
  105    H    ALA  17           H        ALA  17  -1.678  -7.993   2.165
  106    HA   ALA  17           HA       ALA  17  -4.454  -7.521   2.235
  107   1HB   ALA  17          1HB       ALA  17  -3.134  -8.395   4.132
  108   2HB   ALA  17          2HB       ALA  17  -2.410  -6.800   4.328
  109   3HB   ALA  17          3HB       ALA  17  -4.142  -7.017   4.576
  110    H    LEU  18           H        LEU  18  -1.670  -5.365   2.193
  111    HA   LEU  18           HA       LEU  18  -3.036  -2.971   2.746
  112   1HB   LEU  18          1HB       LEU  18  -0.464  -3.515   1.275
  113   2HB   LEU  18          2HB       LEU  18  -1.051  -1.894   1.596
  114    HG   LEU  18           HG       LEU  18  -0.196  -3.962   3.613
  115   1HD1  LEU  18          1HD1      LEU  18   0.920  -1.436   2.525
  116   2HD1  LEU  18          2HD1      LEU  18   1.214  -1.821   4.221
  117   3HD1  LEU  18          3HD1      LEU  18   1.733  -2.940   2.959
  118   1HD2  LEU  18          1HD2      LEU  18  -1.739  -1.420   3.959
  119   2HD2  LEU  18          2HD2      LEU  18  -2.000  -2.996   4.706
  120   3HD2  LEU  18          3HD2      LEU  18  -0.646  -1.989   5.221
  121    H    ALA  19           H        ALA  19  -2.194  -4.518  -0.343
  122    HA   ALA  19           HA       ALA  19  -3.073  -2.527  -2.067
  123   1HB   ALA  19          1HB       ALA  19  -2.272  -4.016  -3.504
  124   2HB   ALA  19          2HB       ALA  19  -2.317  -5.279  -2.274
  125   3HB   ALA  19          3HB       ALA  19  -3.733  -4.979  -3.281
  126    H    ALA  20           H        ALA  20  -4.881  -5.219  -0.644
  127    HA   ALA  20           HA       ALA  20  -7.348  -4.556  -1.888
  128   1HB   ALA  20          1HB       ALA  20  -7.978  -6.526  -1.070
  129   2HB   ALA  20          2HB       ALA  20  -6.357  -6.683  -0.396
  130   3HB   ALA  20          3HB       ALA  20  -7.659  -6.013   0.586
  131    H    ALA  21           H        ALA  21  -6.073  -4.034   1.396
  132    HA   ALA  21           HA       ALA  21  -8.400  -2.907   2.477
  133   1HB   ALA  21          1HB       ALA  21  -5.878  -1.913   3.597
  134   2HB   ALA  21          2HB       ALA  21  -7.220  -2.750   4.378
  135   3HB   ALA  21          3HB       ALA  21  -6.007  -3.668   3.487
  136    H    LYS  22           H        LYS  22  -5.598  -1.345   0.934
  137    HA   LYS  22           HA       LYS  22  -6.466   1.298   1.529
  138   1HB   LYS  22          1HB       LYS  22  -4.299   0.042  -0.030
  139   2HB   LYS  22          2HB       LYS  22  -4.806   1.630  -0.591
  140   1HG   LYS  22          1HG       LYS  22  -3.222   2.277   0.887
  141   2HG   LYS  22          2HG       LYS  22  -4.595   2.190   1.996
  142   1HD   LYS  22          1HD       LYS  22  -3.799  -0.306   2.258
  143   2HD   LYS  22          2HD       LYS  22  -2.263   0.355   1.695
  144   1HE   LYS  22          2HE       LYS  22  -3.811   1.536   3.988
  145   2HE   LYS  22          1HE       LYS  22  -2.595   0.276   4.201
  146   1HZ   LYS  22          1HZ       LYS  22  -1.152   1.947   4.336
  147   2HZ   LYS  22          2HZ       LYS  22  -2.253   3.083   3.718
  148   3HZ   LYS  22          3HZ       LYS  22  -1.335   2.127   2.660
  149    H    LYS  23           H        LYS  23  -7.051  -0.968  -1.026
  150    HA   LYS  23           HA       LYS  23  -8.051   0.845  -2.962
  151   1HB   LYS  23          1HB       LYS  23  -7.302  -1.441  -3.515
  152   2HB   LYS  23          2HB       LYS  23  -8.636  -2.104  -2.588
  153   1HG   LYS  23          1HG       LYS  23  -8.971  -2.089  -5.059
  154   2HG   LYS  23          2HG       LYS  23 -10.236  -1.278  -4.135
  155   1HD   LYS  23          1HD       LYS  23  -9.180   0.890  -4.629
  156   2HD   LYS  23          2HD       LYS  23  -7.952   0.058  -5.587
  157   1HE   LYS  23          2HE       LYS  23  -9.353   0.508  -7.291
  158   2HE   LYS  23          1HE       LYS  23 -10.180  -0.937  -6.714
  159   1HZ   LYS  23          1HZ       LYS  23 -11.756   0.373  -5.552
  160   2HZ   LYS  23          2HZ       LYS  23 -11.636   1.033  -7.105
  161   3HZ   LYS  23          3HZ       LYS  23 -10.874   1.802  -5.800
  162    H    THR  24           H        THR  24  -9.640  -1.351  -0.678
  163    HA   THR  24           HA       THR  24 -12.251  -0.590  -1.138
  164    HB   THR  24           HB       THR  24 -11.244  -1.368   1.556
  165    HG1  THR  24           1HG      THR  24 -10.760  -3.345   0.837
  166   1HG2  THR  24          1HG2      THR  24 -13.398  -2.872   0.940
  167   2HG2  THR  24          2HG2      THR  24 -13.731  -1.382   0.059
  168   3HG2  THR  24          3HG2      THR  24 -13.454  -1.332   1.798
  169    H    ALA  25           H        ALA  25  -9.962   0.660   1.287
  170    HA   ALA  25           HA       ALA  25 -11.587   2.528   2.530
  171   1HB   ALA  25          1HB       ALA  25  -9.396   3.840   2.831
  172   2HB   ALA  25          2HB       ALA  25  -9.486   2.208   3.497
  173   3HB   ALA  25          3HB       ALA  25  -8.638   2.495   1.976
  174    H    ALA  26           H        ALA  26  -9.805   2.778  -0.474
  175    HA   ALA  26           HA       ALA  26 -10.517   5.525  -0.946
  176   1HB   ALA  26          1HB       ALA  26  -9.703   4.862  -3.336
  177   2HB   ALA  26          2HB       ALA  26  -8.544   4.983  -2.012
  178   3HB   ALA  26          3HB       ALA  26  -9.134   3.404  -2.527
  179    H    ASP  27           H        ASP  27 -11.670   2.384  -1.959
  180    HA   ASP  27           HA       ASP  27 -13.484   3.086  -3.941
  181   1HB   ASP  27          1HB       ASP  27 -12.701   0.776  -2.604
  182   2HB   ASP  27          2HB       ASP  27 -14.422   0.900  -2.268
  183    H    ALA  28           H        ALA  28 -13.918   2.855  -0.441
  184    HA   ALA  28           HA       ALA  28 -16.683   3.309  -0.356
  185   1HB   ALA  28          1HB       ALA  28 -14.607   4.026   1.715
  186   2HB   ALA  28          2HB       ALA  28 -16.344   3.906   1.989
  187   3HB   ALA  28          3HB       ALA  28 -15.421   2.468   1.553
  188    H    ALA  29           H        ALA  29 -13.988   5.551  -0.542
  189    HA   ALA  29           HA       ALA  29 -15.640   7.880  -0.155
  190   1HB   ALA  29          1HB       ALA  29 -13.236   8.690  -1.315
  191   2HB   ALA  29          2HB       ALA  29 -13.646   8.688   0.401
  192   3HB   ALA  29          3HB       ALA  29 -12.821   7.299  -0.309
  193    H    ALA  30           H        ALA  30 -14.355   6.051  -2.840
  194    HA   ALA  30           HA       ALA  30 -14.835   8.041  -4.830
  195   1HB   ALA  30          1HB       ALA  30 -13.907   5.235  -4.794
  196   2HB   ALA  30          2HB       ALA  30 -14.607   5.830  -6.301
  197   3HB   ALA  30          3HB       ALA  30 -13.218   6.651  -5.590
  198    H    ALA  31           H        ALA  31 -16.627   5.229  -3.660
  199    HA   ALA  31           HA       ALA  31 -18.605   5.431  -5.749
  200   1HB   ALA  31          1HB       ALA  31 -18.255   3.637  -3.377
  201   2HB   ALA  31          2HB       ALA  31 -19.744   3.628  -4.323
  202   3HB   ALA  31          3HB       ALA  31 -18.208   3.235  -5.095
  203    H    ALA  32           H        ALA  32 -18.083   7.259  -3.156
  204    HA   ALA  32           HA       ALA  32 -20.841   7.451  -2.238
  205   1HB   ALA  32          1HB       ALA  32 -18.278   7.976  -1.089
  206   2HB   ALA  32          2HB       ALA  32 -19.263   9.440  -1.017
  207   3HB   ALA  32          3HB       ALA  32 -19.861   7.937  -0.310
  208    H    ALA  33           H        ALA  33 -22.187   8.686  -3.336
  209    HA   ALA  33           HA       ALA  33 -21.196  10.865  -4.984
  210   1HB   ALA  33          1HB       ALA  33 -23.853   9.518  -4.672
  211   2HB   ALA  33          2HB       ALA  33 -23.722  11.072  -5.496
  212   3HB   ALA  33          3HB       ALA  33 -22.844   9.671  -6.110
  213    H    ALA  34           H        ALA  34 -21.135  12.906  -4.377
  214    HA   ALA  34           HA       ALA  34 -21.436  14.842  -3.250
  215   1HB   ALA  34          1HB       ALA  34 -24.076  13.611  -3.180
  216   2HB   ALA  34          2HB       ALA  34 -23.791  14.726  -1.844
  217   3HB   ALA  34          3HB       ALA  34 -23.611  15.279  -3.509
  218    H    ALA  35           H        ALA  35 -20.082  12.610  -2.023
  219    HA   ALA  35           HA       ALA  35 -20.303  13.449   0.778
  220   1HB   ALA  35          1HB       ALA  35 -20.214  10.618  -0.241
  221   2HB   ALA  35          2HB       ALA  35 -19.834  11.056   1.426
  222   3HB   ALA  35          3HB       ALA  35 -21.444  11.370   0.778
  Start of MODEL   15
    1   1H    GLY   1          1H        GLY   1  12.561 -18.182   5.071
    2   2H    GLY   1          2H        GLY   1  14.007 -18.408   4.214
    3   3H    GLY   1          3H        GLY   1  13.261 -19.725   4.971
    4   1HA   GLY   1          2HA       GLY   1  11.361 -18.618   3.288
    5   2HA   GLY   1          1HA       GLY   1  12.861 -18.709   2.374
    6    H    SER   2           H        SER   2  11.036 -20.231   1.364
    7    HA   SER   2           HA       SER   2  11.964 -22.906   1.871
    8   1HB   SER   2          1HB       SER   2   9.020 -22.285   2.241
    9   2HB   SER   2          2HB       SER   2   9.760 -23.884   2.291
   10    HG   SER   2           HG       SER   2  11.098 -22.423   4.002
   11    H    MET   3           H        MET   3  11.046 -24.438   0.250
   12    HA   MET   3           HA       MET   3  11.067 -23.250  -2.337
   13   1HB   MET   3          1HB       MET   3  10.808 -26.018  -1.260
   14   2HB   MET   3          2HB       MET   3  10.311 -25.730  -2.922
   15   1HG   MET   3          1HG       MET   3  12.409 -25.760  -3.610
   16   2HG   MET   3          2HG       MET   3  12.854 -24.508  -2.450
   17   1HE   MET   3          1HE       MET   3  11.614 -27.957  -2.685
   18   2HE   MET   3          2HE       MET   3  13.070 -28.915  -2.419
   19   3HE   MET   3          3HE       MET   3  11.979 -28.578  -1.074
   20    H    ASN   4           H        ASN   4   8.573 -24.082  -0.121
   21    HA   ASN   4           HA       ASN   4   6.475 -24.494  -1.991
   22   1HB   ASN   4          1HB       ASN   4   6.621 -25.184   0.505
   23   2HB   ASN   4          2HB       ASN   4   6.030 -23.557   0.826
   24   1HD2  ASN   4          1HD2      ASN   4   4.233 -24.711   1.784
   25   2HD2  ASN   4          2HD2      ASN   4   2.924 -25.224   0.765
   26    H    ALA   5           H        ALA   5   4.830 -23.142  -2.615
   27    HA   ALA   5           HA       ALA   5   5.598 -20.532  -3.259
   28   1HB   ALA   5          1HB       ALA   5   4.124 -21.177  -4.811
   29   2HB   ALA   5          2HB       ALA   5   3.221 -22.190  -3.686
   30   3HB   ALA   5          3HB       ALA   5   2.944 -20.449  -3.722
   31    HA   PRO   6           HA       PRO   6   2.326 -18.867  -0.134
   32   1HB   PRO   6          1HB       PRO   6   1.645 -20.511   1.951
   33   2HB   PRO   6          2HB       PRO   6   0.704 -20.345   0.466
   34   1HG   PRO   6          1HG       PRO   6   2.615 -22.478   1.278
   35   2HG   PRO   6          2HG       PRO   6   1.102 -22.610   0.365
   36   1HD   PRO   6          1HD       PRO   6   3.567 -22.698  -0.791
   37   2HD   PRO   6          2HD       PRO   6   2.128 -22.098  -1.632
   38    H    ALA   7           H        ALA   7   5.002 -20.851   0.774
   39    HA   ALA   7           HA       ALA   7   5.546 -19.596   3.278
   40   1HB   ALA   7          1HB       ALA   7   6.612 -21.616   3.173
   41   2HB   ALA   7          2HB       ALA   7   6.988 -21.442   1.458
   42   3HB   ALA   7          3HB       ALA   7   7.928 -20.559   2.660
   43    H    ARG   8           H        ARG   8   6.204 -18.927  -0.014
   44    HA   ARG   8           HA       ARG   8   8.045 -16.745   0.582
   45   1HB   ARG   8          1HB       ARG   8   6.951 -17.892  -1.980
   46   2HB   ARG   8          2HB       ARG   8   7.930 -16.432  -1.943
   47   1HG   ARG   8          1HG       ARG   8   9.811 -17.599  -1.813
   48   2HG   ARG   8          2HG       ARG   8   9.188 -18.590  -0.493
   49   1HD   ARG   8          1HD       ARG   8   9.826 -19.716  -2.740
   50   2HD   ARG   8          2HD       ARG   8   8.345 -20.199  -1.918
   51    HE   ARG   8           HE       ARG   8   7.623 -18.173  -3.650
   52   1HH1  ARG   8          2HH1      ARG   8   9.047 -21.350  -3.928
   53   2HH1  ARG   8          1HH1      ARG   8   8.404 -21.642  -5.513
   54   1HH2  ARG   8          2HH2      ARG   8   6.726 -18.557  -5.691
   55   2HH2  ARG   8          1HH2      ARG   8   7.077 -20.050  -6.520
   56    H    ALA   9           H        ALA   9   4.810 -17.343  -0.663
   57    HA   ALA   9           HA       ALA   9   4.103 -14.661  -1.186
   58   1HB   ALA   9          1HB       ALA   9   1.742 -15.584  -1.019
   59   2HB   ALA   9          2HB       ALA   9   2.801 -16.326  -2.217
   60   3HB   ALA   9          3HB       ALA   9   2.490 -17.146  -0.687
   61    H    ALA  10           H        ALA  10   4.556 -16.333   1.731
   62    HA   ALA  10           HA       ALA  10   2.793 -15.035   3.471
   63   1HB   ALA  10          1HB       ALA  10   4.773 -15.425   5.135
   64   2HB   ALA  10          2HB       ALA  10   3.906 -16.802   4.453
   65   3HB   ALA  10          3HB       ALA  10   5.467 -16.326   3.786
   66    H    ALA  11           H        ALA  11   5.710 -13.945   1.915
   67    HA   ALA  11           HA       ALA  11   5.954 -11.561   3.525
   68   1HB   ALA  11          1HB       ALA  11   7.323 -11.368   1.005
   69   2HB   ALA  11          2HB       ALA  11   7.991 -11.479   2.633
   70   3HB   ALA  11          3HB       ALA  11   7.614 -12.947   1.734
   71    H    LYS  12           H        LYS  12   4.434 -12.534   0.563
   72    HA   LYS  12           HA       LYS  12   3.988  -9.969  -0.543
   73   1HB   LYS  12          1HB       LYS  12   3.900 -11.821  -2.009
   74   2HB   LYS  12          2HB       LYS  12   2.773 -12.689  -0.978
   75   1HG   LYS  12          1HG       LYS  12   1.598 -10.215  -1.785
   76   2HG   LYS  12          2HG       LYS  12   2.214 -11.074  -3.196
   77   1HD   LYS  12          1HD       LYS  12   1.014 -13.073  -1.735
   78   2HD   LYS  12          2HD       LYS  12  -0.056 -11.695  -1.473
   79   1HE   LYS  12          2HE       LYS  12   0.595 -11.688  -4.206
   80   2HE   LYS  12          1HE       LYS  12   0.233 -13.362  -3.789
   81   1HZ   LYS  12          1HZ       LYS  12  -1.513 -11.018  -3.766
   82   2HZ   LYS  12          2HZ       LYS  12  -1.788 -12.211  -2.589
   83   3HZ   LYS  12          3HZ       LYS  12  -1.845 -12.616  -4.233
   84    H    THR  13           H        THR  13   2.053 -12.104   1.514
   85    HA   THR  13           HA       THR  13  -0.396 -10.987   1.555
   86    HB   THR  13           HB       THR  13   0.435 -11.493   4.286
   87    HG1  THR  13           1HG      THR  13   1.923 -12.923   3.786
   88   1HG2  THR  13          1HG2      THR  13  -1.628 -12.321   4.267
   89   2HG2  THR  13          2HG2      THR  13  -1.130 -13.582   3.140
   90   3HG2  THR  13          3HG2      THR  13  -1.720 -12.036   2.531
   91    H    ALA  14           H        ALA  14   2.438  -9.602   3.091
   92    HA   ALA  14           HA       ALA  14   1.176  -7.725   4.749
   93   1HB   ALA  14          1HB       ALA  14   3.420  -6.423   4.195
   94   2HB   ALA  14          2HB       ALA  14   3.400  -7.850   5.229
   95   3HB   ALA  14          3HB       ALA  14   3.872  -7.996   3.537
   96    H    ALA  15           H        ALA  15   2.724  -7.089   1.606
   97    HA   ALA  15           HA       ALA  15   1.447  -4.581   1.262
   98   1HB   ALA  15          1HB       ALA  15   2.661  -4.377  -0.656
   99   2HB   ALA  15          2HB       ALA  15   3.614  -5.610   0.170
  100   3HB   ALA  15          3HB       ALA  15   2.471  -6.075  -1.091
  101    H    ASP  16           H        ASP  16   0.539  -7.825   0.525
  102    HA   ASP  16           HA       ASP  16  -1.328  -7.293  -1.560
  103   1HB   ASP  16          1HB       ASP  16  -0.399  -9.518  -1.228
  104   2HB   ASP  16          2HB       ASP  16  -1.127  -9.622   0.365
  105    H    ALA  17           H        ALA  17  -1.663  -7.910   1.900
  106    HA   ALA  17           HA       ALA  17  -4.448  -7.547   2.065
  107   1HB   ALA  17          1HB       ALA  17  -2.573  -8.338   3.829
  108   2HB   ALA  17          2HB       ALA  17  -2.844  -6.689   4.392
  109   3HB   ALA  17          3HB       ALA  17  -4.194  -7.820   4.298
  110    H    LEU  18           H        LEU  18  -1.751  -5.293   2.350
  111    HA   LEU  18           HA       LEU  18  -3.265  -3.020   3.063
  112   1HB   LEU  18          1HB       LEU  18  -0.610  -3.285   1.665
  113   2HB   LEU  18          2HB       LEU  18  -1.287  -1.752   2.179
  114    HG   LEU  18           HG       LEU  18  -0.432  -4.040   3.943
  115   1HD1  LEU  18          1HD1      LEU  18   1.049  -2.195   4.852
  116   2HD1  LEU  18          2HD1      LEU  18   1.446  -2.810   3.247
  117   3HD1  LEU  18          3HD1      LEU  18   0.601  -1.273   3.417
  118   1HD2  LEU  18          1HD2      LEU  18  -0.961  -2.139   5.706
  119   2HD2  LEU  18          2HD2      LEU  18  -2.138  -1.664   4.482
  120   3HD2  LEU  18          3HD2      LEU  18  -2.196  -3.284   5.181
  121    H    ALA  19           H        ALA  19  -2.223  -4.296  -0.074
  122    HA   ALA  19           HA       ALA  19  -3.138  -2.258  -1.720
  123   1HB   ALA  19          1HB       ALA  19  -1.911  -4.568  -2.194
  124   2HB   ALA  19          2HB       ALA  19  -3.547  -5.042  -2.651
  125   3HB   ALA  19          3HB       ALA  19  -2.768  -3.678  -3.452
  126    H    ALA  20           H        ALA  20  -4.907  -5.044  -0.421
  127    HA   ALA  20           HA       ALA  20  -7.371  -4.406  -1.701
  128   1HB   ALA  20          1HB       ALA  20  -8.325  -6.145  -0.406
  129   2HB   ALA  20          2HB       ALA  20  -6.688  -6.662  -0.812
  130   3HB   ALA  20          3HB       ALA  20  -7.042  -6.045   0.801
  131    H    ALA  21           H        ALA  21  -6.107  -3.880   1.573
  132    HA   ALA  21           HA       ALA  21  -8.364  -2.649   2.678
  133   1HB   ALA  21          1HB       ALA  21  -6.172  -3.470   3.790
  134   2HB   ALA  21          2HB       ALA  21  -5.597  -1.833   3.470
  135   3HB   ALA  21          3HB       ALA  21  -7.021  -2.086   4.479
  136    H    LYS  22           H        LYS  22  -5.668  -1.294   0.829
  137    HA   LYS  22           HA       LYS  22  -6.524   1.417   1.158
  138   1HB   LYS  22          1HB       LYS  22  -4.356  -0.006  -0.202
  139   2HB   LYS  22          2HB       LYS  22  -4.925   1.405  -1.081
  140   1HG   LYS  22          1HG       LYS  22  -3.003   1.491   0.790
  141   2HG   LYS  22          2HG       LYS  22  -4.065   2.854   0.415
  142   1HD   LYS  22          1HD       LYS  22  -4.907   2.819   2.473
  143   2HD   LYS  22          2HD       LYS  22  -5.328   1.114   2.322
  144   1HE   LYS  22          2HE       LYS  22  -3.413   0.405   3.342
  145   2HE   LYS  22          1HE       LYS  22  -2.486   1.810   2.820
  146   1HZ   LYS  22          1HZ       LYS  22  -2.757   2.530   4.891
  147   2HZ   LYS  22          2HZ       LYS  22  -3.981   1.408   5.237
  148   3HZ   LYS  22          3HZ       LYS  22  -4.364   2.875   4.470
  149    H    LYS  23           H        LYS  23  -7.021  -1.108  -1.216
  150    HA   LYS  23           HA       LYS  23  -8.236   0.460  -3.221
  151   1HB   LYS  23          1HB       LYS  23  -7.389  -1.938  -3.408
  152   2HB   LYS  23          2HB       LYS  23  -8.883  -2.428  -2.625
  153   1HG   LYS  23          1HG       LYS  23  -9.434  -2.692  -4.829
  154   2HG   LYS  23          2HG       LYS  23  -9.997  -1.044  -4.541
  155   1HD   LYS  23          1HD       LYS  23  -8.828  -0.723  -6.472
  156   2HD   LYS  23          2HD       LYS  23  -7.538  -0.448  -5.297
  157   1HE   LYS  23          2HE       LYS  23  -7.349  -3.123  -5.616
  158   2HE   LYS  23          1HE       LYS  23  -7.931  -2.656  -7.214
  159   1HZ   LYS  23          1HZ       LYS  23  -5.501  -1.623  -5.849
  160   2HZ   LYS  23          2HZ       LYS  23  -6.090  -1.045  -7.332
  161   3HZ   LYS  23          3HZ       LYS  23  -5.548  -2.645  -7.204
  162    H    THR  24           H        THR  24  -9.592  -1.450  -0.565
  163    HA   THR  24           HA       THR  24 -12.279  -0.858  -1.050
  164    HB   THR  24           HB       THR  24 -10.696  -1.946   1.214
  165    HG1  THR  24           1HG      THR  24 -12.426  -2.825  -0.728
  166   1HG2  THR  24          1HG2      THR  24 -12.074  -1.082   2.735
  167   2HG2  THR  24          2HG2      THR  24 -13.267  -2.222   2.110
  168   3HG2  THR  24          3HG2      THR  24 -13.233  -0.560   1.518
  169    H    ALA  25           H        ALA  25  -9.861   0.702   1.048
  170    HA   ALA  25           HA       ALA  25 -11.560   2.616   2.197
  171   1HB   ALA  25          1HB       ALA  25  -9.518   2.504   3.250
  172   2HB   ALA  25          2HB       ALA  25  -8.616   2.464   1.735
  173   3HB   ALA  25          3HB       ALA  25  -9.330   3.976   2.297
  174    H    ALA  26           H        ALA  26  -9.564   2.759  -0.728
  175    HA   ALA  26           HA       ALA  26 -10.306   5.327  -1.572
  176   1HB   ALA  26          1HB       ALA  26  -9.893   3.889  -3.901
  177   2HB   ALA  26          2HB       ALA  26  -8.670   4.758  -2.976
  178   3HB   ALA  26          3HB       ALA  26  -8.930   3.037  -2.694
  179    H    ASP  27           H        ASP  27 -11.735   2.166  -2.214
  180    HA   ASP  27           HA       ASP  27 -13.677   2.906  -4.073
  181   1HB   ASP  27          1HB       ASP  27 -12.913   0.568  -3.051
  182   2HB   ASP  27          2HB       ASP  27 -14.327   0.825  -2.040
  183    H    ALA  28           H        ALA  28 -13.998   2.502  -0.563
  184    HA   ALA  28           HA       ALA  28 -16.671   3.322  -0.394
  185   1HB   ALA  28          1HB       ALA  28 -15.600   2.065   1.373
  186   2HB   ALA  28          2HB       ALA  28 -14.504   3.408   1.700
  187   3HB   ALA  28          3HB       ALA  28 -16.231   3.583   2.012
  188    H    ALA  29           H        ALA  29 -13.664   5.155  -0.245
  189    HA   ALA  29           HA       ALA  29 -14.885   7.580   0.635
  190   1HB   ALA  29          1HB       ALA  29 -12.181   6.809  -0.346
  191   2HB   ALA  29          2HB       ALA  29 -12.618   8.517  -0.303
  192   3HB   ALA  29          3HB       ALA  29 -12.660   7.559   1.177
  193    H    ALA  30           H        ALA  30 -14.002   6.260  -2.520
  194    HA   ALA  30           HA       ALA  30 -14.475   8.663  -3.971
  195   1HB   ALA  30          1HB       ALA  30 -13.191   7.314  -5.254
  196   2HB   ALA  30          2HB       ALA  30 -13.929   5.836  -4.636
  197   3HB   ALA  30          3HB       ALA  30 -14.759   6.787  -5.869
  198    H    ALA  31           H        ALA  31 -16.490   6.020  -2.915
  199    HA   ALA  31           HA       ALA  31 -18.762   7.074  -4.442
  200   1HB   ALA  31          1HB       ALA  31 -18.349   4.685  -4.672
  201   2HB   ALA  31          2HB       ALA  31 -18.474   4.486  -2.923
  202   3HB   ALA  31          3HB       ALA  31 -19.887   4.977  -3.857
  203    H    ALA  32           H        ALA  32 -17.500   8.158  -1.877
  204    HA   ALA  32           HA       ALA  32 -19.655   7.765   0.043
  205   1HB   ALA  32          1HB       ALA  32 -16.869   8.714   0.187
  206   2HB   ALA  32          2HB       ALA  32 -18.004   9.444   1.323
  207   3HB   ALA  32          3HB       ALA  32 -17.784   7.694   1.296
  208    H    ALA  33           H        ALA  33 -21.311   8.903  -1.060
  209    HA   ALA  33           HA       ALA  33 -21.025  11.793  -1.258
  210   1HB   ALA  33          1HB       ALA  33 -22.496  10.123  -2.729
  211   2HB   ALA  33          2HB       ALA  33 -23.687  10.497  -1.482
  212   3HB   ALA  33          3HB       ALA  33 -22.975  11.795  -2.439
  213    H    ALA  34           H        ALA  34 -22.511   9.342   0.742
  214    HA   ALA  34           HA       ALA  34 -22.477  11.102   3.015
  215   1HB   ALA  34          1HB       ALA  34 -24.871  10.824   3.561
  216   2HB   ALA  34          2HB       ALA  34 -24.617  11.749   2.079
  217   3HB   ALA  34          3HB       ALA  34 -25.118  10.061   1.989
  218    H    ALA  35           H        ALA  35 -20.905   9.298   3.289
  219    HA   ALA  35           HA       ALA  35 -22.205   6.815   4.180
  220   1HB   ALA  35          1HB       ALA  35 -19.787   7.332   2.626
  221   2HB   ALA  35          2HB       ALA  35 -19.546   6.203   3.959
  222   3HB   ALA  35          3HB       ALA  35 -20.775   5.876   2.737
  Start of MODEL   16
    1   1H    GLY   1          1H        GLY   1  19.541 -13.426  12.606
    2   2H    GLY   1          2H        GLY   1  19.262 -12.578  14.047
    3   3H    GLY   1          3H        GLY   1  20.308 -11.939  12.880
    4   1HA   GLY   1          2HA       GLY   1  17.629 -11.400  13.161
    5   2HA   GLY   1          1HA       GLY   1  18.667 -10.934  11.816
    6    H    SER   2           H        SER   2  16.567 -11.122  10.649
    7    HA   SER   2           HA       SER   2  15.677 -13.852  10.178
    8   1HB   SER   2          1HB       SER   2  14.559 -11.433   8.791
    9   2HB   SER   2          2HB       SER   2  13.749 -12.939   9.226
   10    HG   SER   2           HG       SER   2  13.461 -12.253  11.228
   11    H    MET   3           H        MET   3  17.466 -14.685   9.064
   12    HA   MET   3           HA       MET   3  17.860 -13.633   6.347
   13   1HB   MET   3          1HB       MET   3  19.851 -14.192   7.786
   14   2HB   MET   3          2HB       MET   3  19.344 -15.875   7.737
   15   1HG   MET   3          1HG       MET   3  19.797 -16.060   5.443
   16   2HG   MET   3          2HG       MET   3  19.890 -14.311   5.234
   17   1HE   MET   3          1HE       MET   3  21.775 -16.214   8.309
   18   2HE   MET   3          2HE       MET   3  21.338 -17.345   7.028
   19   3HE   MET   3          3HE       MET   3  23.031 -16.945   7.310
   20    H    ASN   4           H        ASN   4  16.030 -15.791   8.066
   21    HA   ASN   4           HA       ASN   4  15.887 -18.006   6.306
   22   1HB   ASN   4          1HB       ASN   4  13.445 -17.444   7.836
   23   2HB   ASN   4          2HB       ASN   4  14.459 -18.880   7.827
   24   1HD2  ASN   4          1HD2      ASN   4  15.893 -19.194   9.432
   25   2HD2  ASN   4          2HD2      ASN   4  16.131 -18.103  10.757
   26    H    ALA   5           H        ALA   5  14.855 -18.268   4.477
   27    HA   ALA   5           HA       ALA   5  13.718 -16.118   3.091
   28   1HB   ALA   5          1HB       ALA   5  14.768 -18.039   1.999
   29   2HB   ALA   5          2HB       ALA   5  13.408 -19.050   2.490
   30   3HB   ALA   5          3HB       ALA   5  13.153 -17.715   1.368
   31    HA   PRO   6           HA       PRO   6   9.367 -18.108   3.837
   32   1HB   PRO   6          1HB       PRO   6   9.536 -19.567   6.331
   33   2HB   PRO   6          2HB       PRO   6   8.932 -20.097   4.769
   34   1HG   PRO   6          1HG       PRO   6  11.249 -21.002   5.895
   35   2HG   PRO   6          2HG       PRO   6  10.908 -21.008   4.157
   36   1HD   PRO   6          1HD       PRO   6  12.647 -19.207   5.740
   37   2HD   PRO   6          2HD       PRO   6  12.773 -19.727   4.052
   38    H    ALA   7           H        ALA   7  11.470 -16.872   6.262
   39    HA   ALA   7           HA       ALA   7   9.391 -15.863   7.979
   40   1HB   ALA   7          1HB       ALA   7  11.465 -16.328   9.022
   41   2HB   ALA   7          2HB       ALA   7  12.356 -15.360   7.844
   42   3HB   ALA   7          3HB       ALA   7  11.296 -14.573   9.012
   43    H    ARG   8           H        ARG   8  10.627 -14.968   5.014
   44    HA   ARG   8           HA       ARG   8   9.941 -12.137   5.369
   45   1HB   ARG   8          1HB       ARG   8  11.353 -13.517   3.081
   46   2HB   ARG   8          2HB       ARG   8  11.082 -11.786   3.223
   47   1HG   ARG   8          1HG       ARG   8  12.387 -12.028   5.453
   48   2HG   ARG   8          2HG       ARG   8  12.961 -13.537   4.734
   49   1HD   ARG   8          1HD       ARG   8  13.136 -11.520   2.754
   50   2HD   ARG   8          2HD       ARG   8  13.840 -10.874   4.237
   51    HE   ARG   8           HE       ARG   8  14.725 -13.337   2.882
   52   1HH1  ARG   8          2HH1      ARG   8  15.309 -10.632   5.015
   53   2HH1  ARG   8          1HH1      ARG   8  17.011 -10.953   5.161
   54   1HH2  ARG   8          2HH2      ARG   8  16.981 -13.758   3.064
   55   2HH2  ARG   8          1HH2      ARG   8  17.965 -12.704   4.043
   56    H    ALA   9           H        ALA   9   8.405 -14.872   4.613
   57    HA   ALA   9           HA       ALA   9   7.154 -14.254   2.133
   58   1HB   ALA   9          1HB       ALA   9   5.515 -16.036   3.561
   59   2HB   ALA   9          2HB       ALA   9   6.680 -16.413   2.290
   60   3HB   ALA   9          3HB       ALA   9   7.181 -16.431   3.983
   61    H    ALA  10           H        ALA  10   6.368 -13.674   5.500
   62    HA   ALA  10           HA       ALA  10   3.682 -12.925   5.218
   63   1HB   ALA  10          1HB       ALA  10   5.806 -12.538   7.230
   64   2HB   ALA  10          2HB       ALA  10   4.464 -11.396   7.289
   65   3HB   ALA  10          3HB       ALA  10   4.154 -13.125   7.421
   66    H    ALA  11           H        ALA  11   6.619 -11.209   4.476
   67    HA   ALA  11           HA       ALA  11   5.666  -8.564   4.563
   68   1HB   ALA  11          1HB       ALA  11   7.735  -9.505   2.598
   69   2HB   ALA  11          2HB       ALA  11   7.618  -7.950   3.425
   70   3HB   ALA  11          3HB       ALA  11   8.079  -9.395   4.327
   71    H    LYS  12           H        LYS  12   5.514 -11.032   2.055
   72    HA   LYS  12           HA       LYS  12   4.594  -9.314  -0.009
   73   1HB   LYS  12          1HB       LYS  12   5.314 -12.030   0.241
   74   2HB   LYS  12          2HB       LYS  12   3.658 -12.013  -0.348
   75   1HG   LYS  12          1HG       LYS  12   6.050 -10.695  -1.614
   76   2HG   LYS  12          2HG       LYS  12   5.137 -12.076  -2.223
   77   1HD   LYS  12          1HD       LYS  12   3.778  -9.455  -1.731
   78   2HD   LYS  12          2HD       LYS  12   4.688  -9.725  -3.218
   79   1HE   LYS  12          2HE       LYS  12   2.477 -11.519  -2.227
   80   2HE   LYS  12          1HE       LYS  12   2.247 -10.220  -3.397
   81   1HZ   LYS  12          1HZ       LYS  12   2.568 -11.996  -4.775
   82   2HZ   LYS  12          2HZ       LYS  12   3.626 -12.792  -3.718
   83   3HZ   LYS  12          3HZ       LYS  12   4.169 -11.467  -4.627
   84    H    THR  13           H        THR  13   2.963 -11.450   2.273
   85    HA   THR  13           HA       THR  13   0.336 -10.983   1.333
   86    HB   THR  13           HB       THR  13   0.873 -11.794   4.158
   87    HG1  THR  13           1HG      THR  13   1.317 -13.460   1.876
   88   1HG2  THR  13          1HG2      THR  13  -1.131 -12.847   4.003
   89   2HG2  THR  13          2HG2      THR  13  -0.850 -13.363   2.342
   90   3HG2  THR  13          3HG2      THR  13  -1.386 -11.718   2.672
   91    H    ALA  14           H        ALA  14   2.449  -9.340   3.578
   92    HA   ALA  14           HA       ALA  14   0.526  -7.755   4.893
   93   1HB   ALA  14          1HB       ALA  14   3.441  -7.718   4.541
   94   2HB   ALA  14          2HB       ALA  14   2.708  -6.137   4.821
   95   3HB   ALA  14          3HB       ALA  14   2.467  -7.439   5.985
   96    H    ALA  15           H        ALA  15   2.680  -6.870   2.191
   97    HA   ALA  15           HA       ALA  15   1.323  -4.494   1.517
   98   1HB   ALA  15          1HB       ALA  15   3.670  -5.563   0.768
   99   2HB   ALA  15          2HB       ALA  15   2.701  -5.951  -0.653
  100   3HB   ALA  15          3HB       ALA  15   2.864  -4.275  -0.129
  101    H    ASP  16           H        ASP  16   0.799  -7.819   0.715
  102    HA   ASP  16           HA       ASP  16  -0.930  -7.553  -1.483
  103   1HB   ASP  16          1HB       ASP  16   0.154  -9.688  -0.426
  104   2HB   ASP  16          2HB       ASP  16  -1.273  -9.680   0.610
  105    H    ALA  17           H        ALA  17  -1.750  -8.139   1.924
  106    HA   ALA  17           HA       ALA  17  -4.487  -7.639   1.716
  107   1HB   ALA  17          1HB       ALA  17  -4.462  -8.221   3.858
  108   2HB   ALA  17          2HB       ALA  17  -2.703  -8.300   3.759
  109   3HB   ALA  17          3HB       ALA  17  -3.491  -6.813   4.288
  110    H    LEU  18           H        LEU  18  -1.804  -5.427   2.167
  111    HA   LEU  18           HA       LEU  18  -3.305  -3.142   2.864
  112   1HB   LEU  18          1HB       LEU  18  -0.626  -3.457   1.524
  113   2HB   LEU  18          2HB       LEU  18  -1.293  -1.897   1.975
  114    HG   LEU  18           HG       LEU  18  -0.707  -4.144   3.908
  115   1HD1  LEU  18          1HD1      LEU  18   0.970  -2.140   4.587
  116   2HD1  LEU  18          2HD1      LEU  18   1.419  -3.487   3.541
  117   3HD1  LEU  18          3HD1      LEU  18   0.937  -1.943   2.835
  118   1HD2  LEU  18          1HD2      LEU  18  -1.821  -2.974   5.430
  119   2HD2  LEU  18          2HD2      LEU  18  -0.902  -1.519   5.049
  120   3HD2  LEU  18          3HD2      LEU  18  -2.369  -1.895   4.148
  121    H    ALA  19           H        ALA  19  -2.379  -4.536  -0.224
  122    HA   ALA  19           HA       ALA  19  -3.230  -2.464  -1.908
  123   1HB   ALA  19          1HB       ALA  19  -2.026  -4.041  -3.048
  124   2HB   ALA  19          2HB       ALA  19  -2.826  -5.396  -2.249
  125   3HB   ALA  19          3HB       ALA  19  -3.665  -4.495  -3.513
  126    H    ALA  20           H        ALA  20  -4.993  -5.219  -0.550
  127    HA   ALA  20           HA       ALA  20  -7.477  -4.606  -1.809
  128   1HB   ALA  20          1HB       ALA  20  -7.217  -6.136   0.761
  129   2HB   ALA  20          2HB       ALA  20  -8.384  -6.346  -0.545
  130   3HB   ALA  20          3HB       ALA  20  -6.705  -6.829  -0.778
  131    H    ALA  21           H        ALA  21  -6.029  -3.859   1.313
  132    HA   ALA  21           HA       ALA  21  -8.185  -2.564   2.521
  133   1HB   ALA  21          1HB       ALA  21  -6.675  -2.428   4.142
  134   2HB   ALA  21          2HB       ALA  21  -5.392  -2.858   3.011
  135   3HB   ALA  21          3HB       ALA  21  -5.832  -1.167   3.241
  136    H    LYS  22           H        LYS  22  -5.438  -0.970   0.888
  137    HA   LYS  22           HA       LYS  22  -6.436   1.549   0.627
  138   1HB   LYS  22          1HB       LYS  22  -4.429  -0.052  -0.728
  139   2HB   LYS  22          2HB       LYS  22  -5.149   1.142  -1.799
  140   1HG   LYS  22          1HG       LYS  22  -3.476   2.400  -0.950
  141   2HG   LYS  22          2HG       LYS  22  -4.698   2.722   0.282
  142   1HD   LYS  22          1HD       LYS  22  -3.528   1.658   1.871
  143   2HD   LYS  22          2HD       LYS  22  -3.132   0.313   0.800
  144   1HE   LYS  22          2HE       LYS  22  -1.048   1.184   1.143
  145   2HE   LYS  22          1HE       LYS  22  -1.533   2.087  -0.294
  146   1HZ   LYS  22          1HZ       LYS  22  -2.353   3.840   1.333
  147   2HZ   LYS  22          2HZ       LYS  22  -0.672   3.676   1.166
  148   3HZ   LYS  22          3HZ       LYS  22  -1.457   3.016   2.517
  149    H    LYS  23           H        LYS  23  -7.224  -1.216  -1.413
  150    HA   LYS  23           HA       LYS  23  -8.584   0.196  -3.436
  151   1HB   LYS  23          1HB       LYS  23  -7.872  -2.150  -3.667
  152   2HB   LYS  23          2HB       LYS  23  -9.048  -2.627  -2.456
  153   1HG   LYS  23          1HG       LYS  23  -9.920  -3.131  -4.629
  154   2HG   LYS  23          2HG       LYS  23 -10.852  -1.804  -3.936
  155   1HD   LYS  23          1HD       LYS  23  -8.621  -0.787  -5.440
  156   2HD   LYS  23          2HD       LYS  23  -9.585  -1.885  -6.431
  157   1HE   LYS  23          2HE       LYS  23 -10.844   0.295  -4.795
  158   2HE   LYS  23          1HE       LYS  23 -10.219   0.598  -6.414
  159   1HZ   LYS  23          1HZ       LYS  23 -11.872  -1.723  -6.373
  160   2HZ   LYS  23          2HZ       LYS  23 -12.018  -0.321  -7.315
  161   3HZ   LYS  23          3HZ       LYS  23 -12.715  -0.378  -5.768
  162    H    THR  24           H        THR  24  -9.826  -1.563  -0.617
  163    HA   THR  24           HA       THR  24 -12.503  -0.832  -0.904
  164    HB   THR  24           HB       THR  24 -10.800  -1.868   1.303
  165    HG1  THR  24           1HG      THR  24 -12.000  -3.053  -0.557
  166   1HG2  THR  24          1HG2      THR  24 -13.712  -1.516   1.767
  167   2HG2  THR  24          2HG2      THR  24 -12.595  -0.197   2.117
  168   3HG2  THR  24          3HG2      THR  24 -12.408  -1.750   2.930
  169    H    ALA  25           H        ALA  25  -9.844   0.640   0.913
  170    HA   ALA  25           HA       ALA  25 -11.305   2.591   2.301
  171   1HB   ALA  25          1HB       ALA  25  -8.856   3.777   1.829
  172   2HB   ALA  25          2HB       ALA  25  -9.253   2.711   3.175
  173   3HB   ALA  25          3HB       ALA  25  -8.505   2.054   1.721
  174    H    ALA  26           H        ALA  26  -9.522   2.889  -0.768
  175    HA   ALA  26           HA       ALA  26 -10.352   5.541  -1.305
  176   1HB   ALA  26          1HB       ALA  26  -8.428   4.184  -2.358
  177   2HB   ALA  26          2HB       ALA  26  -9.661   3.587  -3.472
  178   3HB   ALA  26          3HB       ALA  26  -9.319   5.316  -3.376
  179    H    ASP  27           H        ASP  27 -11.700   2.398  -2.087
  180    HA   ASP  27           HA       ASP  27 -13.637   3.209  -3.959
  181   1HB   ASP  27          1HB       ASP  27 -12.753   0.826  -3.020
  182   2HB   ASP  27          2HB       ASP  27 -14.289   0.938  -2.177
  183    H    ALA  28           H        ALA  28 -13.821   2.669  -0.461
  184    HA   ALA  28           HA       ALA  28 -16.538   3.330  -0.159
  185   1HB   ALA  28          1HB       ALA  28 -14.563   2.408   1.504
  186   2HB   ALA  28          2HB       ALA  28 -14.866   4.031   2.126
  187   3HB   ALA  28          3HB       ALA  28 -16.190   2.873   2.006
  188    H    ALA  29           H        ALA  29 -13.608   5.311   0.049
  189    HA   ALA  29           HA       ALA  29 -14.899   7.695   0.841
  190   1HB   ALA  29          1HB       ALA  29 -12.220   6.939  -0.144
  191   2HB   ALA  29          2HB       ALA  29 -12.688   8.624  -0.371
  192   3HB   ALA  29          3HB       ALA  29 -12.686   7.921   1.245
  193    H    ALA  30           H        ALA  30 -14.258   6.255  -2.291
  194    HA   ALA  30           HA       ALA  30 -14.966   8.597  -3.797
  195   1HB   ALA  30          1HB       ALA  30 -14.911   5.821  -4.922
  196   2HB   ALA  30          2HB       ALA  30 -14.519   7.351  -5.708
  197   3HB   ALA  30          3HB       ALA  30 -13.417   6.666  -4.512
  198    H    ALA  31           H        ALA  31 -16.727   6.187  -2.194
  199    HA   ALA  31           HA       ALA  31 -18.967   6.130  -3.984
  200   1HB   ALA  31          1HB       ALA  31 -20.081   4.897  -2.104
  201   2HB   ALA  31          2HB       ALA  31 -18.592   4.170  -2.703
  202   3HB   ALA  31          3HB       ALA  31 -18.582   5.083  -1.195
  203    H    ALA  32           H        ALA  32 -17.844   8.412  -1.957
  204    HA   ALA  32           HA       ALA  32 -20.444   9.347  -1.019
  205   1HB   ALA  32          1HB       ALA  32 -19.335  10.696   0.505
  206   2HB   ALA  32          2HB       ALA  32 -18.259   9.304   0.387
  207   3HB   ALA  32          3HB       ALA  32 -17.876  10.790  -0.484
  208    H    ALA  33           H        ALA  33 -19.763   9.344  -3.818
  209    HA   ALA  33           HA       ALA  33 -19.358  12.122  -4.545
  210   1HB   ALA  33          1HB       ALA  33 -20.142  10.026  -6.519
  211   2HB   ALA  33          2HB       ALA  33 -19.045  11.393  -6.707
  212   3HB   ALA  33          3HB       ALA  33 -18.535   9.971  -5.798
  213    H    ALA  34           H        ALA  34 -20.874  13.269  -5.892
  214    HA   ALA  34           HA       ALA  34 -22.888  14.232  -6.246
  215   1HB   ALA  34          1HB       ALA  34 -24.787  12.810  -6.785
  216   2HB   ALA  34          2HB       ALA  34 -23.320  12.213  -7.557
  217   3HB   ALA  34          3HB       ALA  34 -23.948  11.412  -6.118
  218    H    ALA  35           H        ALA  35 -21.898  13.879  -3.543
  219    HA   ALA  35           HA       ALA  35 -24.426  14.313  -2.118
  220   1HB   ALA  35          1HB       ALA  35 -23.187  13.224  -0.106
  221   2HB   ALA  35          2HB       ALA  35 -23.951  12.189  -1.316
  222   3HB   ALA  35          3HB       ALA  35 -22.208  12.452  -1.356
  Start of MODEL   17
    1   1H    GLY   1          1H        GLY   1  18.728 -12.698   1.980
    2   2H    GLY   1          2H        GLY   1  17.302 -11.949   1.447
    3   3H    GLY   1          3H        GLY   1  18.747 -11.721   0.594
    4   1HA   GLY   1          2HA       GLY   1  18.677 -13.732  -0.414
    5   2HA   GLY   1          1HA       GLY   1  17.800 -14.462   0.925
    6    H    SER   2           H        SER   2  17.498 -12.280  -1.835
    7    HA   SER   2           HA       SER   2  14.621 -12.177  -1.591
    8   1HB   SER   2          1HB       SER   2  15.456 -11.108  -4.081
    9   2HB   SER   2          2HB       SER   2  14.967 -10.227  -2.634
   10    HG   SER   2           HG       SER   2  17.593 -11.139  -3.269
   11    H    MET   3           H        MET   3  16.855 -14.255  -3.085
   12    HA   MET   3           HA       MET   3  15.028 -14.972  -5.253
   13   1HB   MET   3          1HB       MET   3  17.622 -14.594  -5.443
   14   2HB   MET   3          2HB       MET   3  17.704 -16.255  -4.873
   15   1HG   MET   3          1HG       MET   3  17.505 -15.482  -7.477
   16   2HG   MET   3          2HG       MET   3  17.109 -17.080  -6.849
   17   1HE   MET   3          1HE       MET   3  15.752 -18.018  -8.056
   18   2HE   MET   3          2HE       MET   3  14.028 -17.891  -7.709
   19   3HE   MET   3          3HE       MET   3  14.674 -17.243  -9.218
   20    H    ASN   4           H        ASN   4  14.155 -15.668  -2.680
   21    HA   ASN   4           HA       ASN   4  14.178 -18.582  -2.940
   22   1HB   ASN   4          1HB       ASN   4  15.410 -17.321  -0.879
   23   2HB   ASN   4          2HB       ASN   4  13.793 -17.527  -0.216
   24   1HD2  ASN   4          1HD2      ASN   4  14.066 -19.113   1.197
   25   2HD2  ASN   4          2HD2      ASN   4  14.642 -20.695   0.792
   26    H    ALA   5           H        ALA   5  12.261 -19.630  -2.302
   27    HA   ALA   5           HA       ALA   5   9.956 -18.335  -3.210
   28   1HB   ALA   5          1HB       ALA   5   8.915 -20.343  -3.055
   29   2HB   ALA   5          2HB       ALA   5  10.591 -20.887  -2.963
   30   3HB   ALA   5          3HB       ALA   5   9.633 -20.725  -1.490
   31    HA   PRO   6           HA       PRO   6   8.443 -18.291   1.504
   32   1HB   PRO   6          1HB       PRO   6  11.132 -17.771   2.679
   33   2HB   PRO   6          2HB       PRO   6   9.752 -18.638   3.358
   34   1HG   PRO   6          1HG       PRO   6  11.844 -19.968   2.422
   35   2HG   PRO   6          2HG       PRO   6  10.197 -20.562   2.136
   36   1HD   PRO   6          1HD       PRO   6  12.064 -19.171   0.271
   37   2HD   PRO   6          2HD       PRO   6  10.901 -20.470  -0.049
   38    H    ALA   7           H        ALA   7  11.260 -16.447   0.433
   39    HA   ALA   7           HA       ALA   7  10.624 -14.029   1.722
   40   1HB   ALA   7          1HB       ALA   7  12.370 -14.740  -0.594
   41   2HB   ALA   7          2HB       ALA   7  12.098 -13.050  -0.168
   42   3HB   ALA   7          3HB       ALA   7  12.827 -14.150   1.005
   43    H    ARG   8           H        ARG   8   9.768 -15.340  -1.380
   44    HA   ARG   8           HA       ARG   8   8.559 -12.983  -2.421
   45   1HB   ARG   8          1HB       ARG   8   7.931 -15.819  -3.250
   46   2HB   ARG   8          2HB       ARG   8   7.758 -14.357  -4.210
   47   1HG   ARG   8          1HG       ARG   8  10.452 -14.465  -3.435
   48   2HG   ARG   8          2HG       ARG   8  10.015 -16.097  -3.943
   49   1HD   ARG   8          1HD       ARG   8  10.004 -15.491  -6.081
   50   2HD   ARG   8          2HD       ARG   8   8.898 -14.160  -5.744
   51    HE   ARG   8           HE       ARG   8  10.830 -12.775  -5.265
   52   1HH1  ARG   8          2HH1      ARG   8  11.421 -15.775  -6.995
   53   2HH1  ARG   8          1HH1      ARG   8  12.974 -15.257  -7.588
   54   1HH2  ARG   8          2HH2      ARG   8  12.821 -12.101  -6.054
   55   2HH2  ARG   8          1HH2      ARG   8  13.765 -13.145  -7.074
   56    H    ALA   9           H        ALA   9   7.444 -15.707  -0.543
   57    HA   ALA   9           HA       ALA   9   4.656 -15.088  -0.773
   58   1HB   ALA   9          1HB       ALA   9   5.077 -17.348  -0.377
   59   2HB   ALA   9          2HB       ALA   9   6.250 -17.005   0.896
   60   3HB   ALA   9          3HB       ALA   9   4.528 -16.751   1.190
   61    H    ALA  10           H        ALA  10   7.125 -14.661   1.745
   62    HA   ALA  10           HA       ALA  10   5.390 -13.620   3.711
   63   1HB   ALA  10          1HB       ALA  10   7.652 -12.654   4.597
   64   2HB   ALA  10          2HB       ALA  10   7.364 -14.393   4.596
   65   3HB   ALA  10          3HB       ALA  10   8.347 -13.663   3.327
   66    H    ALA  11           H        ALA  11   7.245 -12.081   1.141
   67    HA   ALA  11           HA       ALA  11   6.637  -9.422   2.098
   68   1HB   ALA  11          1HB       ALA  11   8.737  -9.640   1.031
   69   2HB   ALA  11          2HB       ALA  11   8.026 -10.446  -0.367
   70   3HB   ALA  11          3HB       ALA  11   7.715  -8.732  -0.083
   71    H    LYS  12           H        LYS  12   4.905 -11.739   0.484
   72    HA   LYS  12           HA       LYS  12   3.533  -9.950  -1.336
   73   1HB   LYS  12          1HB       LYS  12   4.015 -12.670  -1.345
   74   2HB   LYS  12          2HB       LYS  12   2.312 -12.564  -0.918
   75   1HG   LYS  12          1HG       LYS  12   3.313 -10.960  -3.213
   76   2HG   LYS  12          2HG       LYS  12   3.076 -12.698  -3.418
   77   1HD   LYS  12          1HD       LYS  12   0.748 -12.320  -2.438
   78   2HD   LYS  12          2HD       LYS  12   1.043 -10.601  -2.708
   79   1HE   LYS  12          2HE       LYS  12   1.703 -11.484  -5.118
   80   2HE   LYS  12          1HE       LYS  12   0.614 -12.793  -4.666
   81   1HZ   LYS  12          1HZ       LYS  12  -0.645 -10.403  -3.986
   82   2HZ   LYS  12          2HZ       LYS  12  -1.074 -11.493  -5.213
   83   3HZ   LYS  12          3HZ       LYS  12  -0.031 -10.201  -5.556
   84    H    THR  13           H        THR  13   2.400 -12.185   1.209
   85    HA   THR  13           HA       THR  13  -0.178 -11.339   1.435
   86    HB   THR  13           HB       THR  13   0.893 -11.880   4.069
   87    HG1  THR  13           1HG      THR  13   2.260 -13.436   3.607
   88   1HG2  THR  13          1HG2      THR  13  -1.424 -12.337   2.951
   89   2HG2  THR  13          2HG2      THR  13  -0.771 -13.493   4.113
   90   3HG2  THR  13          3HG2      THR  13  -0.647 -13.814   2.382
   91    H    ALA  14           H        ALA  14   2.625  -9.881   3.011
   92    HA   ALA  14           HA       ALA  14   1.274  -8.152   4.754
   93   1HB   ALA  14          1HB       ALA  14   3.375  -6.835   4.745
   94   2HB   ALA  14          2HB       ALA  14   3.633  -8.563   4.995
   95   3HB   ALA  14          3HB       ALA  14   3.959  -7.842   3.419
   96    H    ALA  15           H        ALA  15   2.748  -7.358   1.617
   97    HA   ALA  15           HA       ALA  15   1.497  -4.830   1.399
   98   1HB   ALA  15          1HB       ALA  15   2.327  -6.113  -1.106
   99   2HB   ALA  15          2HB       ALA  15   2.789  -4.557  -0.415
  100   3HB   ALA  15          3HB       ALA  15   3.567  -6.038   0.146
  101    H    ASP  16           H        ASP  16   0.465  -8.030   0.593
  102    HA   ASP  16           HA       ASP  16  -1.406  -7.363  -1.449
  103   1HB   ASP  16          1HB       ASP  16  -0.375  -9.703  -0.557
  104   2HB   ASP  16          2HB       ASP  16  -1.949  -9.741   0.229
  105    H    ALA  17           H        ALA  17  -1.633  -7.853   2.027
  106    HA   ALA  17           HA       ALA  17  -4.417  -7.473   2.259
  107   1HB   ALA  17          1HB       ALA  17  -3.552  -8.386   4.167
  108   2HB   ALA  17          2HB       ALA  17  -2.108  -7.373   4.133
  109   3HB   ALA  17          3HB       ALA  17  -3.650  -6.696   4.660
  110    H    LEU  18           H        LEU  18  -1.698  -5.271   2.195
  111    HA   LEU  18           HA       LEU  18  -3.111  -2.949   3.026
  112   1HB   LEU  18          1HB       LEU  18  -0.517  -3.348   1.557
  113   2HB   LEU  18          2HB       LEU  18  -1.125  -1.761   1.984
  114    HG   LEU  18           HG       LEU  18  -0.218  -3.954   3.837
  115   1HD1  LEU  18          1HD1      LEU  18   1.143  -1.933   4.664
  116   2HD1  LEU  18          2HD1      LEU  18   1.613  -2.701   3.148
  117   3HD1  LEU  18          3HD1      LEU  18   0.696  -1.194   3.124
  118   1HD2  LEU  18          1HD2      LEU  18  -1.912  -3.258   5.171
  119   2HD2  LEU  18          2HD2      LEU  18  -0.809  -1.922   5.504
  120   3HD2  LEU  18          3HD2      LEU  18  -2.100  -1.726   4.318
  121    H    ALA  19           H        ALA  19  -2.040  -4.111  -0.157
  122    HA   ALA  19           HA       ALA  19  -3.019  -2.083  -1.753
  123   1HB   ALA  19          1HB       ALA  19  -2.251  -4.866  -2.126
  124   2HB   ALA  19          2HB       ALA  19  -3.477  -4.327  -3.273
  125   3HB   ALA  19          3HB       ALA  19  -1.947  -3.460  -3.148
  126    H    ALA  20           H        ALA  20  -4.739  -4.909  -0.514
  127    HA   ALA  20           HA       ALA  20  -7.195  -4.290  -1.818
  128   1HB   ALA  20          1HB       ALA  20  -7.142  -6.503  -1.289
  129   2HB   ALA  20          2HB       ALA  20  -6.304  -6.231   0.239
  130   3HB   ALA  20          3HB       ALA  20  -8.030  -5.898   0.108
  131    H    ALA  21           H        ALA  21  -5.992  -3.817   1.495
  132    HA   ALA  21           HA       ALA  21  -8.357  -2.743   2.562
  133   1HB   ALA  21          1HB       ALA  21  -7.117  -3.071   4.368
  134   2HB   ALA  21          2HB       ALA  21  -5.629  -3.105   3.424
  135   3HB   ALA  21          3HB       ALA  21  -6.281  -1.565   3.988
  136    H    LYS  22           H        LYS  22  -5.653  -1.203   0.899
  137    HA   LYS  22           HA       LYS  22  -6.546   1.457   1.394
  138   1HB   LYS  22          1HB       LYS  22  -4.412   0.157  -0.132
  139   2HB   LYS  22          2HB       LYS  22  -5.025   1.621  -0.885
  140   1HG   LYS  22          1HG       LYS  22  -3.035   1.719   0.794
  141   2HG   LYS  22          2HG       LYS  22  -4.278   2.973   0.801
  142   1HD   LYS  22          1HD       LYS  22  -4.782   2.507   2.918
  143   2HD   LYS  22          2HD       LYS  22  -5.080   0.817   2.508
  144   1HE   LYS  22          2HE       LYS  22  -3.218   0.205   3.546
  145   2HE   LYS  22          1HE       LYS  22  -2.266   1.283   2.525
  146   1HZ   LYS  22          1HZ       LYS  22  -2.612   3.068   4.049
  147   2HZ   LYS  22          2HZ       LYS  22  -2.059   1.731   4.940
  148   3HZ   LYS  22          3HZ       LYS  22  -3.701   2.154   4.976
  149    H    LYS  23           H        LYS  23  -6.944  -0.840  -1.247
  150    HA   LYS  23           HA       LYS  23  -8.303   0.885  -3.020
  151   1HB   LYS  23          1HB       LYS  23  -7.276  -1.484  -3.418
  152   2HB   LYS  23          2HB       LYS  23  -8.862  -2.060  -2.921
  153   1HG   LYS  23          1HG       LYS  23  -9.135  -1.957  -5.185
  154   2HG   LYS  23          2HG       LYS  23  -9.711  -0.357  -4.717
  155   1HD   LYS  23          1HD       LYS  23  -6.818  -0.563  -5.246
  156   2HD   LYS  23          2HD       LYS  23  -7.866  -0.799  -6.647
  157   1HE   LYS  23          2HE       LYS  23  -8.244   1.529  -4.793
  158   2HE   LYS  23          1HE       LYS  23  -7.059   1.589  -6.097
  159   1HZ   LYS  23          1HZ       LYS  23  -8.865   2.428  -7.166
  160   2HZ   LYS  23          2HZ       LYS  23  -9.986   1.561  -6.232
  161   3HZ   LYS  23          3HZ       LYS  23  -9.140   0.781  -7.478
  162    H    THR  24           H        THR  24  -9.407  -1.315  -0.506
  163    HA   THR  24           HA       THR  24 -12.142  -1.045  -0.814
  164    HB   THR  24           HB       THR  24 -10.365  -1.615   1.522
  165    HG1  THR  24           1HG      THR  24 -11.904  -3.109  -0.305
  166   1HG2  THR  24          1HG2      THR  24 -12.246  -2.190   2.859
  167   2HG2  THR  24          2HG2      THR  24 -13.355  -1.845   1.533
  168   3HG2  THR  24          3HG2      THR  24 -12.453  -0.535   2.295
  169    H    ALA  25           H        ALA  25  -9.827   0.899   1.041
  170    HA   ALA  25           HA       ALA  25 -11.711   2.654   2.218
  171   1HB   ALA  25          1HB       ALA  25  -8.978   2.261   2.398
  172   2HB   ALA  25          2HB       ALA  25  -9.127   3.879   1.710
  173   3HB   ALA  25          3HB       ALA  25  -9.914   3.494   3.242
  174    H    ALA  26           H        ALA  26  -9.705   2.922  -0.696
  175    HA   ALA  26           HA       ALA  26 -10.626   5.425  -1.568
  176   1HB   ALA  26          1HB       ALA  26  -9.857   4.693  -3.813
  177   2HB   ALA  26          2HB       ALA  26  -8.662   4.427  -2.544
  178   3HB   ALA  26          3HB       ALA  26  -9.610   3.074  -3.159
  179    H    ASP  27           H        ASP  27 -11.825   2.167  -2.157
  180    HA   ASP  27           HA       ASP  27 -13.886   2.662  -3.945
  181   1HB   ASP  27          1HB       ASP  27 -13.072   0.417  -3.006
  182   2HB   ASP  27          2HB       ASP  27 -14.120   0.732  -1.632
  183    H    ALA  28           H        ALA  28 -13.952   2.711  -0.415
  184    HA   ALA  28           HA       ALA  28 -16.656   3.405  -0.114
  185   1HB   ALA  28          1HB       ALA  28 -14.479   2.898   1.579
  186   2HB   ALA  28          2HB       ALA  28 -15.071   4.502   2.014
  187   3HB   ALA  28          3HB       ALA  28 -16.169   3.122   2.034
  188    H    ALA  29           H        ALA  29 -13.776   5.368  -0.544
  189    HA   ALA  29           HA       ALA  29 -15.052   7.862   0.028
  190   1HB   ALA  29          1HB       ALA  29 -12.544   7.278   0.125
  191   2HB   ALA  29          2HB       ALA  29 -12.559   7.589  -1.612
  192   3HB   ALA  29          3HB       ALA  29 -13.014   8.866  -0.483
  193    H    ALA  30           H        ALA  30 -14.315   6.046  -2.903
  194    HA   ALA  30           HA       ALA  30 -15.192   8.112  -4.684
  195   1HB   ALA  30          1HB       ALA  30 -14.208   6.847  -6.231
  196   2HB   ALA  30          2HB       ALA  30 -13.766   5.728  -4.940
  197   3HB   ALA  30          3HB       ALA  30 -15.252   5.477  -5.856
  198    H    ALA  31           H        ALA  31 -16.785   5.813  -2.767
  199    HA   ALA  31           HA       ALA  31 -19.158   5.720  -4.454
  200   1HB   ALA  31          1HB       ALA  31 -18.610   3.642  -3.426
  201   2HB   ALA  31          2HB       ALA  31 -18.478   4.394  -1.836
  202   3HB   ALA  31          3HB       ALA  31 -20.053   4.255  -2.619
  203    H    ALA  32           H        ALA  32 -17.916   7.952  -2.554
  204    HA   ALA  32           HA       ALA  32 -20.416   8.671  -1.206
  205   1HB   ALA  32          1HB       ALA  32 -19.145   9.453   0.438
  206   2HB   ALA  32          2HB       ALA  32 -17.733   8.835  -0.418
  207   3HB   ALA  32          3HB       ALA  32 -18.263  10.498  -0.677
  208    H    ALA  33           H        ALA  33 -20.436   8.879  -3.962
  209    HA   ALA  33           HA       ALA  33 -19.814  11.571  -4.766
  210   1HB   ALA  33          1HB       ALA  33 -19.915   9.379  -6.197
  211   2HB   ALA  33          2HB       ALA  33 -21.622   9.801  -6.345
  212   3HB   ALA  33          3HB       ALA  33 -20.383  10.928  -6.900
  213    H    ALA  34           H        ALA  34 -22.753   9.689  -4.156
  214    HA   ALA  34           HA       ALA  34 -24.121  12.191  -3.445
  215   1HB   ALA  34          1HB       ALA  34 -24.964  11.821  -5.606
  216   2HB   ALA  34          2HB       ALA  34 -25.097  10.082  -5.348
  217   3HB   ALA  34          3HB       ALA  34 -26.202  11.182  -4.522
  218    H    ALA  35           H        ALA  35 -22.861   9.871  -2.036
  219    HA   ALA  35           HA       ALA  35 -25.045   9.335  -0.209
  220   1HB   ALA  35          1HB       ALA  35 -25.399   7.225  -0.814
  221   2HB   ALA  35          2HB       ALA  35 -24.212   7.387  -2.109
  222   3HB   ALA  35          3HB       ALA  35 -23.703   6.853  -0.505
  Start of MODEL   18
    1   1H    GLY   1          1H        GLY   1  21.695 -16.954   3.098
    2   2H    GLY   1          2H        GLY   1  21.359 -18.147   4.257
    3   3H    GLY   1          3H        GLY   1  22.349 -16.829   4.655
    4   1HA   GLY   1          2HA       GLY   1  19.979 -16.764   5.495
    5   2HA   GLY   1          1HA       GLY   1  20.593 -15.329   4.686
    6    H    SER   2           H        SER   2  17.872 -15.840   4.915
    7    HA   SER   2           HA       SER   2  16.888 -17.006   2.476
    8   1HB   SER   2          1HB       SER   2  15.125 -15.263   4.103
    9   2HB   SER   2          2HB       SER   2  14.840 -16.889   3.481
   10    HG   SER   2           HG       SER   2  15.585 -17.718   5.275
   11    H    MET   3           H        MET   3  18.555 -15.313   1.484
   12    HA   MET   3           HA       MET   3  17.332 -12.691   1.082
   13   1HB   MET   3          1HB       MET   3  19.943 -13.503   1.406
   14   2HB   MET   3          2HB       MET   3  19.832 -13.273  -0.333
   15   1HG   MET   3          1HG       MET   3  18.608 -11.076   1.071
   16   2HG   MET   3          2HG       MET   3  20.265 -11.330   1.613
   17   1HE   MET   3          1HE       MET   3  21.590 -11.582  -2.347
   18   2HE   MET   3          2HE       MET   3  21.708 -12.468  -0.824
   19   3HE   MET   3          3HE       MET   3  20.311 -12.704  -1.877
   20    H    ASN   4           H        ASN   4  16.944 -15.595  -0.246
   21    HA   ASN   4           HA       ASN   4  17.304 -15.031  -3.030
   22   1HB   ASN   4          1HB       ASN   4  16.148 -17.317  -1.472
   23   2HB   ASN   4          2HB       ASN   4  15.895 -17.222  -3.212
   24   1HD2  ASN   4          1HD2      ASN   4  17.379 -18.124  -4.453
   25   2HD2  ASN   4          2HD2      ASN   4  18.997 -18.512  -3.970
   26    H    ALA   5           H        ALA   5  15.480 -15.309  -4.588
   27    HA   ALA   5           HA       ALA   5  13.657 -13.238  -4.254
   28   1HB   ALA   5          1HB       ALA   5  12.677 -13.933  -6.345
   29   2HB   ALA   5          2HB       ALA   5  14.437 -14.033  -6.425
   30   3HB   ALA   5          3HB       ALA   5  13.478 -15.499  -6.217
   31    HA   PRO   6           HA       PRO   6  10.125 -16.462  -3.634
   32   1HB   PRO   6          1HB       PRO   6  10.844 -18.923  -2.679
   33   2HB   PRO   6          2HB       PRO   6  10.609 -18.559  -4.390
   34   1HG   PRO   6          1HG       PRO   6  13.140 -18.766  -2.828
   35   2HG   PRO   6          2HG       PRO   6  12.793 -19.305  -4.481
   36   1HD   PRO   6          1HD       PRO   6  14.158 -17.027  -3.921
   37   2HD   PRO   6          2HD       PRO   6  13.152 -17.205  -5.366
   38    H    ALA   7           H        ALA   7  12.884 -16.158  -1.585
   39    HA   ALA   7           HA       ALA   7  11.496 -16.746   0.861
   40   1HB   ALA   7          1HB       ALA   7  13.502 -16.421   1.939
   41   2HB   ALA   7          2HB       ALA   7  14.049 -16.890   0.331
   42   3HB   ALA   7          3HB       ALA   7  14.035 -15.190   0.796
   43    H    ARG   8           H        ARG   8  11.872 -14.076  -1.196
   44    HA   ARG   8           HA       ARG   8  11.041 -12.135   0.810
   45   1HB   ARG   8          1HB       ARG   8  11.429 -11.739  -2.161
   46   2HB   ARG   8          2HB       ARG   8  11.280 -10.481  -0.943
   47   1HG   ARG   8          1HG       ARG   8  13.403 -10.976  -0.036
   48   2HG   ARG   8          2HG       ARG   8  13.515 -12.486  -0.945
   49   1HD   ARG   8          1HD       ARG   8  13.630 -11.250  -3.030
   50   2HD   ARG   8          2HD       ARG   8  13.440  -9.726  -2.160
   51    HE   ARG   8           HE       ARG   8  15.838 -11.288  -2.431
   52   1HH1  ARG   8          2HH1      ARG   8  14.171  -8.962  -0.410
   53   2HH1  ARG   8          1HH1      ARG   8  15.634  -8.311   0.267
   54   1HH2  ARG   8          2HH2      ARG   8  17.767 -10.417  -1.540
   55   2HH2  ARG   8          1HH2      ARG   8  17.670  -9.131  -0.376
   56    H    ALA   9           H        ALA   9   9.764 -14.101  -1.719
   57    HA   ALA   9           HA       ALA   9   7.316 -12.753  -2.154
   58   1HB   ALA   9          1HB       ALA   9   8.247 -15.562  -2.632
   59   2HB   ALA   9          2HB       ALA   9   6.583 -15.078  -2.955
   60   3HB   ALA   9          3HB       ALA   9   7.911 -14.291  -3.806
   61    H    ALA  10           H        ALA  10   8.487 -14.716   0.398
   62    HA   ALA  10           HA       ALA  10   6.017 -15.679   1.407
   63   1HB   ALA  10          1HB       ALA  10   7.316 -16.755   2.865
   64   2HB   ALA  10          2HB       ALA  10   8.693 -16.053   2.016
   65   3HB   ALA  10          3HB       ALA  10   8.037 -15.253   3.444
   66    H    ALA  11           H        ALA  11   7.442 -12.584   1.382
   67    HA   ALA  11           HA       ALA  11   5.863 -11.680   3.685
   68   1HB   ALA  11          1HB       ALA  11   8.271 -10.630   2.282
   69   2HB   ALA  11          2HB       ALA  11   7.201  -9.489   3.096
   70   3HB   ALA  11          3HB       ALA  11   7.951 -10.798   4.009
   71    H    LYS  12           H        LYS  12   5.505 -12.035   0.440
   72    HA   LYS  12           HA       LYS  12   4.617  -9.625  -0.582
   73   1HB   LYS  12          1HB       LYS  12   4.956 -11.444  -2.061
   74   2HB   LYS  12          2HB       LYS  12   3.850 -12.477  -1.170
   75   1HG   LYS  12          1HG       LYS  12   2.516 -10.111  -2.150
   76   2HG   LYS  12          2HG       LYS  12   3.304 -11.008  -3.448
   77   1HD   LYS  12          1HD       LYS  12   2.118 -12.970  -1.891
   78   2HD   LYS  12          2HD       LYS  12   0.932 -11.665  -1.917
   79   1HE   LYS  12          2HE       LYS  12   2.242 -12.523  -4.456
   80   2HE   LYS  12          1HE       LYS  12   0.937 -13.495  -3.782
   81   1HZ   LYS  12          1HZ       LYS  12  -0.370 -11.347  -3.706
   82   2HZ   LYS  12          2HZ       LYS  12  -0.081 -12.001  -5.244
   83   3HZ   LYS  12          3HZ       LYS  12   0.836 -10.684  -4.700
   84    H    THR  13           H        THR  13   2.851 -12.041   1.273
   85    HA   THR  13           HA       THR  13   0.255 -11.268   1.041
   86    HB   THR  13           HB       THR  13   0.799 -11.866   3.795
   87    HG1  THR  13           1HG      THR  13   2.144 -13.600   3.572
   88   1HG2  THR  13          1HG2      THR  13  -0.149 -13.769   1.674
   89   2HG2  THR  13          2HG2      THR  13  -1.170 -12.466   2.282
   90   3HG2  THR  13          3HG2      THR  13  -0.586 -13.717   3.380
   91    H    ALA  14           H        ALA  14   2.746  -9.654   2.901
   92    HA   ALA  14           HA       ALA  14   1.094  -8.181   4.640
   93   1HB   ALA  14          1HB       ALA  14   3.564  -8.497   4.882
   94   2HB   ALA  14          2HB       ALA  14   3.780  -7.301   3.603
   95   3HB   ALA  14          3HB       ALA  14   3.006  -6.842   5.121
   96    H    ALA  15           H        ALA  15   2.788  -7.016   1.718
   97    HA   ALA  15           HA       ALA  15   1.292  -4.607   1.577
   98   1HB   ALA  15          1HB       ALA  15   2.946  -4.077   0.197
   99   2HB   ALA  15          2HB       ALA  15   3.519  -5.744   0.230
  100   3HB   ALA  15          3HB       ALA  15   2.342  -5.240  -0.983
  101    H    ASP  16           H        ASP  16   0.641  -7.818   0.597
  102    HA   ASP  16           HA       ASP  16  -1.064  -7.254  -1.628
  103   1HB   ASP  16          1HB       ASP  16   0.051  -9.550  -0.435
  104   2HB   ASP  16          2HB       ASP  16  -1.693  -9.744  -0.308
  105    H    ALA  17           H        ALA  17  -1.578  -8.063   1.780
  106    HA   ALA  17           HA       ALA  17  -4.398  -7.808   1.735
  107   1HB   ALA  17          1HB       ALA  17  -4.289  -8.386   3.904
  108   2HB   ALA  17          2HB       ALA  17  -2.584  -8.689   3.568
  109   3HB   ALA  17          3HB       ALA  17  -3.085  -7.153   4.277
  110    H    LEU  18           H        LEU  18  -1.775  -5.537   2.362
  111    HA   LEU  18           HA       LEU  18  -3.351  -3.363   3.219
  112   1HB   LEU  18          1HB       LEU  18  -0.671  -3.400   1.826
  113   2HB   LEU  18          2HB       LEU  18  -1.392  -1.973   2.541
  114    HG   LEU  18           HG       LEU  18  -0.261  -4.389   3.911
  115   1HD1  LEU  18          1HD1      LEU  18   0.100  -1.485   4.570
  116   2HD1  LEU  18          2HD1      LEU  18   1.129  -2.852   4.998
  117   3HD1  LEU  18          3HD1      LEU  18   1.060  -2.285   3.328
  118   1HD2  LEU  18          1HD2      LEU  18  -1.169  -3.357   6.040
  119   2HD2  LEU  18          2HD2      LEU  18  -2.260  -2.427   5.015
  120   3HD2  LEU  18          3HD2      LEU  18  -2.341  -4.189   5.019
  121    H    ALA  19           H        ALA  19  -2.255  -4.389   0.024
  122    HA   ALA  19           HA       ALA  19  -3.134  -2.331  -1.565
  123   1HB   ALA  19          1HB       ALA  19  -2.296  -3.780  -3.030
  124   2HB   ALA  19          2HB       ALA  19  -2.544  -5.137  -1.929
  125   3HB   ALA  19          3HB       ALA  19  -3.851  -4.611  -2.991
  126    H    ALA  20           H        ALA  20  -5.065  -5.149  -0.539
  127    HA   ALA  20           HA       ALA  20  -7.484  -4.262  -1.693
  128   1HB   ALA  20          1HB       ALA  20  -7.006  -6.189   0.579
  129   2HB   ALA  20          2HB       ALA  20  -8.543  -5.970  -0.258
  130   3HB   ALA  20          3HB       ALA  20  -7.142  -6.591  -1.133
  131    H    ALA  21           H        ALA  21  -6.082  -3.860   1.528
  132    HA   ALA  21           HA       ALA  21  -8.342  -2.723   2.770
  133   1HB   ALA  21          1HB       ALA  21  -6.483  -1.687   4.287
  134   2HB   ALA  21          2HB       ALA  21  -6.763  -3.428   4.286
  135   3HB   ALA  21          3HB       ALA  21  -5.419  -2.751   3.367
  136    H    LYS  22           H        LYS  22  -5.667  -1.267   0.967
  137    HA   LYS  22           HA       LYS  22  -6.502   1.417   1.461
  138   1HB   LYS  22          1HB       LYS  22  -4.394   0.054  -0.070
  139   2HB   LYS  22          2HB       LYS  22  -4.948   1.567  -0.776
  140   1HG   LYS  22          1HG       LYS  22  -3.198   2.234   0.578
  141   2HG   LYS  22          2HG       LYS  22  -4.621   2.531   1.583
  142   1HD   LYS  22          1HD       LYS  22  -4.236   0.259   2.602
  143   2HD   LYS  22          2HD       LYS  22  -2.684   0.235   1.758
  144   1HE   LYS  22          2HE       LYS  22  -2.359   0.995   4.023
  145   2HE   LYS  22          1HE       LYS  22  -2.062   2.327   2.910
  146   1HZ   LYS  22          1HZ       LYS  22  -4.534   1.887   4.502
  147   2HZ   LYS  22          2HZ       LYS  22  -4.315   3.141   3.386
  148   3HZ   LYS  22          3HZ       LYS  22  -3.357   3.073   4.784
  149    H    LYS  23           H        LYS  23  -6.886  -0.909  -1.140
  150    HA   LYS  23           HA       LYS  23  -8.232   0.691  -2.991
  151   1HB   LYS  23          1HB       LYS  23  -7.427  -1.897  -2.934
  152   2HB   LYS  23          2HB       LYS  23  -9.163  -2.099  -2.750
  153   1HG   LYS  23          1HG       LYS  23  -9.246  -2.022  -4.959
  154   2HG   LYS  23          2HG       LYS  23  -8.982  -0.286  -4.790
  155   1HD   LYS  23          1HD       LYS  23  -6.461  -0.988  -4.708
  156   2HD   LYS  23          2HD       LYS  23  -7.051  -2.441  -5.517
  157   1HE   LYS  23          2HE       LYS  23  -8.276  -0.405  -6.911
  158   2HE   LYS  23          1HE       LYS  23  -6.684   0.262  -6.547
  159   1HZ   LYS  23          1HZ       LYS  23  -5.626  -1.371  -7.745
  160   2HZ   LYS  23          2HZ       LYS  23  -7.025  -1.143  -8.673
  161   3HZ   LYS  23          3HZ       LYS  23  -6.911  -2.470  -7.622
  162    H    THR  24           H        THR  24  -9.512  -1.319  -0.365
  163    HA   THR  24           HA       THR  24 -12.220  -0.760  -0.778
  164    HB   THR  24           HB       THR  24 -10.550  -1.921   1.358
  165    HG1  THR  24           1HG      THR  24 -12.536  -3.395   1.175
  166   1HG2  THR  24          1HG2      THR  24 -11.687  -0.732   2.939
  167   2HG2  THR  24          2HG2      THR  24 -12.798  -2.087   2.723
  168   3HG2  THR  24          3HG2      THR  24 -13.121  -0.544   1.931
  169    H    ALA  25           H        ALA  25  -9.734   0.908   1.102
  170    HA   ALA  25           HA       ALA  25 -11.382   2.799   2.364
  171   1HB   ALA  25          1HB       ALA  25  -9.460   3.816   3.040
  172   2HB   ALA  25          2HB       ALA  25  -8.776   2.273   2.532
  173   3HB   ALA  25          3HB       ALA  25  -8.694   3.667   1.458
  174    H    ALA  26           H        ALA  26  -9.631   2.954  -0.715
  175    HA   ALA  26           HA       ALA  26 -10.643   5.449  -1.544
  176   1HB   ALA  26          1HB       ALA  26  -8.735   4.697  -2.664
  177   2HB   ALA  26          2HB       ALA  26  -9.452   3.126  -3.020
  178   3HB   ALA  26          3HB       ALA  26 -10.021   4.567  -3.862
  179    H    ASP  27           H        ASP  27 -11.847   2.167  -1.911
  180    HA   ASP  27           HA       ASP  27 -13.882   2.580  -3.764
  181   1HB   ASP  27          1HB       ASP  27 -13.016   0.406  -2.554
  182   2HB   ASP  27          2HB       ASP  27 -14.339   0.744  -1.448
  183    H    ALA  28           H        ALA  28 -13.930   2.940  -0.251
  184    HA   ALA  28           HA       ALA  28 -16.591   3.660   0.095
  185   1HB   ALA  28          1HB       ALA  28 -14.375   3.499   1.709
  186   2HB   ALA  28          2HB       ALA  28 -14.775   5.216   1.759
  187   3HB   ALA  28          3HB       ALA  28 -15.983   4.015   2.215
  188    H    ALA  29           H        ALA  29 -13.809   5.753  -0.618
  189    HA   ALA  29           HA       ALA  29 -15.325   8.150  -0.773
  190   1HB   ALA  29          1HB       ALA  29 -12.945   8.207  -0.311
  191   2HB   ALA  29          2HB       ALA  29 -12.600   7.499  -1.889
  192   3HB   ALA  29          3HB       ALA  29 -13.299   9.117  -1.782
  193    H    ALA  30           H        ALA  30 -14.567   5.629  -3.031
  194    HA   ALA  30           HA       ALA  30 -15.168   7.008  -5.427
  195   1HB   ALA  30          1HB       ALA  30 -14.441   4.356  -4.654
  196   2HB   ALA  30          2HB       ALA  30 -15.815   4.281  -5.756
  197   3HB   ALA  30          3HB       ALA  30 -14.339   5.114  -6.243
  198    H    ALA  31           H        ALA  31 -17.132   5.693  -2.928
  199    HA   ALA  31           HA       ALA  31 -19.499   5.438  -4.546
  200   1HB   ALA  31          1HB       ALA  31 -20.349   5.402  -1.931
  201   2HB   ALA  31          2HB       ALA  31 -19.896   3.991  -2.889
  202   3HB   ALA  31          3HB       ALA  31 -18.711   4.757  -1.831
  203    H    ALA  32           H        ALA  32 -17.877   8.008  -3.405
  204    HA   ALA  32           HA       ALA  32 -20.243   9.601  -2.737
  205   1HB   ALA  32          1HB       ALA  32 -18.904  10.778  -1.396
  206   2HB   ALA  32          2HB       ALA  32 -17.639   9.598  -1.738
  207   3HB   ALA  32          3HB       ALA  32 -17.753  11.072  -2.700
  208    H    ALA  33           H        ALA  33 -20.925   9.343  -5.027
  209    HA   ALA  33           HA       ALA  33 -19.453  10.432  -7.173
  210   1HB   ALA  33          1HB       ALA  33 -22.387  10.499  -7.391
  211   2HB   ALA  33          2HB       ALA  33 -21.183   9.776  -8.456
  212   3HB   ALA  33          3HB       ALA  33 -21.683   8.932  -6.992
  213    H    ALA  34           H        ALA  34 -22.074  11.781  -5.204
  214    HA   ALA  34           HA       ALA  34 -21.083  14.462  -5.875
  215   1HB   ALA  34          1HB       ALA  34 -22.957  14.430  -7.250
  216   2HB   ALA  34          2HB       ALA  34 -23.892  13.452  -6.120
  217   3HB   ALA  34          3HB       ALA  34 -23.582  15.152  -5.767
  218    H    ALA  35           H        ALA  35 -20.331  13.137  -3.644
  219    HA   ALA  35           HA       ALA  35 -21.805  14.504  -1.508
  220   1HB   ALA  35          1HB       ALA  35 -22.524  12.127  -1.574
  221   2HB   ALA  35          2HB       ALA  35 -20.847  11.648  -1.310
  222   3HB   ALA  35          3HB       ALA  35 -21.708  12.565  -0.074
  Start of MODEL   19
    1   1H    GLY   1          1H        GLY   1  20.758 -12.914   2.673
    2   2H    GLY   1          2H        GLY   1  20.326 -11.674   1.604
    3   3H    GLY   1          3H        GLY   1  19.310 -13.019   1.799
    4   1HA   GLY   1          2HA       GLY   1  19.880 -11.663   4.266
    5   2HA   GLY   1          1HA       GLY   1  19.057 -10.648   3.088
    6    H    SER   2           H        SER   2  16.971 -11.221   2.380
    7    HA   SER   2           HA       SER   2  15.539 -12.804   4.370
    8   1HB   SER   2          1HB       SER   2  13.914 -11.482   2.333
    9   2HB   SER   2          2HB       SER   2  13.850 -11.335   4.089
   10    HG   SER   2           HG       SER   2  15.592  -9.971   2.294
   11    H    MET   3           H        MET   3  15.995 -14.902   3.694
   12    HA   MET   3           HA       MET   3  14.662 -15.686   1.175
   13   1HB   MET   3          1HB       MET   3  17.317 -15.889   1.534
   14   2HB   MET   3          2HB       MET   3  16.819 -17.407   2.269
   15   1HG   MET   3          1HG       MET   3  16.765 -18.301   0.250
   16   2HG   MET   3          2HG       MET   3  15.402 -17.247  -0.129
   17   1HE   MET   3          1HE       MET   3  16.370 -14.949  -2.580
   18   2HE   MET   3          2HE       MET   3  15.323 -15.346  -1.215
   19   3HE   MET   3          3HE       MET   3  16.632 -14.181  -1.014
   20    H    ASN   4           H        ASN   4  14.027 -15.543   4.178
   21    HA   ASN   4           HA       ASN   4  13.650 -18.295   4.949
   22   1HB   ASN   4          1HB       ASN   4  13.652 -15.721   6.242
   23   2HB   ASN   4          2HB       ASN   4  12.206 -16.619   6.687
   24   1HD2  ASN   4          1HD2      ASN   4  15.630 -16.402   6.936
   25   2HD2  ASN   4          2HD2      ASN   4  15.842 -17.685   8.085
   26    H    ALA   5           H        ALA   5  11.631 -19.237   5.461
   27    HA   ALA   5           HA       ALA   5   9.600 -18.907   3.572
   28   1HB   ALA   5          1HB       ALA   5   8.479 -20.614   4.631
   29   2HB   ALA   5          2HB       ALA   5  10.146 -20.897   5.139
   30   3HB   ALA   5          3HB       ALA   5   9.012 -20.110   6.237
   31    HA   PRO   6           HA       PRO   6   7.026 -16.514   6.927
   32   1HB   PRO   6          1HB       PRO   6   8.494 -15.233   8.849
   33   2HB   PRO   6          2HB       PRO   6   7.746 -16.815   9.078
   34   1HG   PRO   6          1HG       PRO   6  10.576 -16.141   8.403
   35   2HG   PRO   6          2HG       PRO   6   9.948 -17.362   9.528
   36   1HD   PRO   6          1HD       PRO   6  10.825 -18.002   7.069
   37   2HD   PRO   6          2HD       PRO   6   9.484 -18.861   7.832
   38    H    ALA   7           H        ALA   7  10.198 -15.594   5.861
   39    HA   ALA   7           HA       ALA   7   9.741 -12.806   5.668
   40   1HB   ALA   7          1HB       ALA   7  11.917 -12.809   5.221
   41   2HB   ALA   7          2HB       ALA   7  11.886 -14.571   5.142
   42   3HB   ALA   7          3HB       ALA   7  11.606 -13.620   3.685
   43    H    ARG   8           H        ARG   8   9.358 -15.481   3.478
   44    HA   ARG   8           HA       ARG   8   8.500 -13.963   1.229
   45   1HB   ARG   8          1HB       ARG   8   8.886 -16.750   1.901
   46   2HB   ARG   8          2HB       ARG   8   7.358 -16.531   1.056
   47   1HG   ARG   8          1HG       ARG   8   8.400 -15.686  -0.855
   48   2HG   ARG   8          2HG       ARG   8   9.903 -15.351   0.007
   49   1HD   ARG   8          1HD       ARG   8   8.828 -18.134  -0.389
   50   2HD   ARG   8          2HD       ARG   8   9.923 -17.355  -1.529
   51    HE   ARG   8           HE       ARG   8  11.485 -17.145   0.431
   52   1HH1  ARG   8          2HH1      ARG   8   9.104 -19.717   0.196
   53   2HH1  ARG   8          1HH1      ARG   8  10.011 -20.817   1.197
   54   1HH2  ARG   8          2HH2      ARG   8  12.669 -18.600   1.751
   55   2HH2  ARG   8          1HH2      ARG   8  12.023 -20.178   2.093
   56    H    ALA   9           H        ALA   9   6.824 -15.747   3.787
   57    HA   ALA   9           HA       ALA   9   4.199 -15.362   2.911
   58   1HB   ALA   9          1HB       ALA   9   5.213 -15.632   5.743
   59   2HB   ALA   9          2HB       ALA   9   3.542 -15.844   5.223
   60   3HB   ALA   9          3HB       ALA   9   4.788 -16.956   4.659
   61    H    ALA  10           H        ALA  10   6.206 -13.377   5.066
   62    HA   ALA  10           HA       ALA  10   4.239 -11.437   5.616
   63   1HB   ALA  10          1HB       ALA  10   7.164 -11.657   5.948
   64   2HB   ALA  10          2HB       ALA  10   6.507 -10.020   5.890
   65   3HB   ALA  10          3HB       ALA  10   5.920 -11.161   7.098
   66    H    ALA  11           H        ALA  11   6.880 -11.477   3.229
   67    HA   ALA  11           HA       ALA  11   6.527  -8.921   2.203
   68   1HB   ALA  11          1HB       ALA  11   7.398 -10.414   0.045
   69   2HB   ALA  11          2HB       ALA  11   8.409  -9.627   1.258
   70   3HB   ALA  11          3HB       ALA  11   7.956 -11.320   1.450
   71    H    LYS  12           H        LYS  12   4.920 -11.935   1.277
   72    HA   LYS  12           HA       LYS  12   3.588 -10.756  -0.965
   73   1HB   LYS  12          1HB       LYS  12   4.059 -13.329  -0.192
   74   2HB   LYS  12          2HB       LYS  12   2.356 -13.153   0.214
   75   1HG   LYS  12          1HG       LYS  12   3.368 -12.328  -2.479
   76   2HG   LYS  12          2HG       LYS  12   3.011 -14.020  -2.128
   77   1HD   LYS  12          1HD       LYS  12   0.724 -13.468  -1.582
   78   2HD   LYS  12          2HD       LYS  12   1.062 -11.745  -1.759
   79   1HE   LYS  12          2HE       LYS  12   1.743 -12.313  -4.161
   80   2HE   LYS  12          1HE       LYS  12   0.945 -13.861  -3.891
   81   1HZ   LYS  12          1HZ       LYS  12  -0.901 -12.834  -4.523
   82   2HZ   LYS  12          2HZ       LYS  12  -0.203 -11.295  -4.413
   83   3HZ   LYS  12          3HZ       LYS  12  -0.879 -12.017  -3.033
   84    H    THR  13           H        THR  13   2.346 -11.945   2.166
   85    HA   THR  13           HA       THR  13  -0.274 -11.039   1.653
   86    HB   THR  13           HB       THR  13   0.594 -11.543   4.452
   87    HG1  THR  13           1HG      THR  13   1.714 -13.203   3.582
   88   1HG2  THR  13          1HG2      THR  13  -1.813 -11.243   3.305
   89   2HG2  THR  13          2HG2      THR  13  -1.543 -12.255   4.725
   90   3HG2  THR  13          3HG2      THR  13  -1.620 -12.987   3.121
   91    H    ALA  14           H        ALA  14   2.458  -9.458   3.186
   92    HA   ALA  14           HA       ALA  14   0.976  -7.536   4.666
   93   1HB   ALA  14          1HB       ALA  14   3.707  -8.092   4.211
   94   2HB   ALA  14          2HB       ALA  14   3.441  -6.407   3.762
   95   3HB   ALA  14          3HB       ALA  14   3.006  -6.970   5.376
   96    H    ALA  15           H        ALA  15   2.528  -7.396   1.474
   97    HA   ALA  15           HA       ALA  15   1.396  -4.865   0.792
   98   1HB   ALA  15          1HB       ALA  15   2.584  -5.025  -1.147
   99   2HB   ALA  15          2HB       ALA  15   3.464  -6.214  -0.188
  100   3HB   ALA  15          3HB       ALA  15   2.242  -6.745  -1.344
  101    H    ASP  16           H        ASP  16   0.398  -8.183   0.510
  102    HA   ASP  16           HA       ASP  16  -1.610  -7.871  -1.458
  103   1HB   ASP  16          1HB       ASP  16  -0.526 -10.018  -0.179
  104   2HB   ASP  16          2HB       ASP  16  -2.078  -9.891   0.650
  105    H    ALA  17           H        ALA  17  -1.664  -7.765   2.076
  106    HA   ALA  17           HA       ALA  17  -4.456  -7.264   2.288
  107   1HB   ALA  17          1HB       ALA  17  -4.129  -7.212   4.542
  108   2HB   ALA  17          2HB       ALA  17  -2.639  -8.033   4.076
  109   3HB   ALA  17          3HB       ALA  17  -2.622  -6.302   4.414
  110    H    LEU  18           H        LEU  18  -1.582  -5.255   2.024
  111    HA   LEU  18           HA       LEU  18  -2.752  -2.761   2.586
  112   1HB   LEU  18          1HB       LEU  18  -0.398  -3.574   0.902
  113   2HB   LEU  18          2HB       LEU  18  -0.879  -1.895   1.068
  114    HG   LEU  18           HG       LEU  18   0.023  -3.729   3.284
  115   1HD1  LEU  18          1HD1      LEU  18   1.752  -1.774   3.390
  116   2HD1  LEU  18          2HD1      LEU  18   1.956  -3.086   2.228
  117   3HD1  LEU  18          3HD1      LEU  18   1.284  -1.541   1.707
  118   1HD2  LEU  18          1HD2      LEU  18  -1.444  -2.388   4.422
  119   2HD2  LEU  18          2HD2      LEU  18   0.003  -1.383   4.475
  120   3HD2  LEU  18          3HD2      LEU  18  -1.261  -1.044   3.295
  121    H    ALA  19           H        ALA  19  -2.262  -4.480  -0.469
  122    HA   ALA  19           HA       ALA  19  -3.306  -2.649  -2.245
  123   1HB   ALA  19          1HB       ALA  19  -3.711  -5.632  -2.421
  124   2HB   ALA  19          2HB       ALA  19  -3.685  -4.478  -3.753
  125   3HB   ALA  19          3HB       ALA  19  -2.214  -4.804  -2.840
  126    H    ALA  20           H        ALA  20  -5.090  -5.213  -0.545
  127    HA   ALA  20           HA       ALA  20  -7.610  -4.474  -1.616
  128   1HB   ALA  20          1HB       ALA  20  -6.575  -6.478   0.205
  129   2HB   ALA  20          2HB       ALA  20  -8.151  -5.866   0.710
  130   3HB   ALA  20          3HB       ALA  20  -7.947  -6.554  -0.900
  131    H    ALA  21           H        ALA  21  -6.086  -3.890   1.547
  132    HA   ALA  21           HA       ALA  21  -8.311  -2.671   2.748
  133   1HB   ALA  21          1HB       ALA  21  -5.627  -1.789   3.609
  134   2HB   ALA  21          2HB       ALA  21  -6.992  -2.376   4.559
  135   3HB   ALA  21          3HB       ALA  21  -5.968  -3.518   3.688
  136    H    LYS  22           H        LYS  22  -5.517  -1.223   1.073
  137    HA   LYS  22           HA       LYS  22  -6.352   1.444   1.610
  138   1HB   LYS  22          1HB       LYS  22  -4.210   0.135   0.036
  139   2HB   LYS  22          2HB       LYS  22  -4.667   1.762  -0.457
  140   1HG   LYS  22          1HG       LYS  22  -2.896   2.051   1.045
  141   2HG   LYS  22          2HG       LYS  22  -4.353   2.424   1.973
  142   1HD   LYS  22          1HD       LYS  22  -4.217  -0.137   2.578
  143   2HD   LYS  22          2HD       LYS  22  -2.514   0.085   2.174
  144   1HE   LYS  22          2HE       LYS  22  -2.141   1.021   4.148
  145   2HE   LYS  22          1HE       LYS  22  -3.354   2.256   3.814
  146   1HZ   LYS  22          1HZ       LYS  22  -3.816   0.990   5.851
  147   2HZ   LYS  22          2HZ       LYS  22  -3.938  -0.434   4.938
  148   3HZ   LYS  22          3HZ       LYS  22  -5.052   0.825   4.703
  149    H    LYS  23           H        LYS  23  -6.718  -0.784  -1.095
  150    HA   LYS  23           HA       LYS  23  -7.905   1.000  -2.907
  151   1HB   LYS  23          1HB       LYS  23  -7.106  -1.317  -3.437
  152   2HB   LYS  23          2HB       LYS  23  -8.531  -1.942  -2.622
  153   1HG   LYS  23          1HG       LYS  23  -9.882  -1.480  -4.357
  154   2HG   LYS  23          2HG       LYS  23  -9.093   0.062  -4.689
  155   1HD   LYS  23          1HD       LYS  23  -7.173  -1.292  -5.639
  156   2HD   LYS  23          2HD       LYS  23  -8.242  -2.691  -5.561
  157   1HE   LYS  23          2HE       LYS  23  -9.206  -2.096  -7.474
  158   2HE   LYS  23          1HE       LYS  23  -9.649  -0.534  -6.785
  159   1HZ   LYS  23          1HZ       LYS  23  -6.913  -0.481  -7.420
  160   2HZ   LYS  23          2HZ       LYS  23  -8.165   0.434  -8.102
  161   3HZ   LYS  23          3HZ       LYS  23  -7.747  -1.066  -8.774
  162    H    THR  24           H        THR  24  -9.383  -1.216  -0.563
  163    HA   THR  24           HA       THR  24 -12.042  -0.586  -1.110
  164    HB   THR  24           HB       THR  24 -10.582  -2.093   0.888
  165    HG1  THR  24           1HG      THR  24 -12.832  -2.253  -0.688
  166   1HG2  THR  24          1HG2      THR  24 -13.160  -0.859   1.839
  167   2HG2  THR  24          2HG2      THR  24 -11.558  -0.376   2.396
  168   3HG2  THR  24          3HG2      THR  24 -12.141  -2.013   2.703
  169    H    ALA  25           H        ALA  25  -9.753   0.928   1.149
  170    HA   ALA  25           HA       ALA  25 -11.527   2.691   2.397
  171   1HB   ALA  25          1HB       ALA  25  -9.635   3.883   3.137
  172   2HB   ALA  25          2HB       ALA  25  -9.100   2.210   2.987
  173   3HB   ALA  25          3HB       ALA  25  -8.676   3.387   1.744
  174    H    ALA  26           H        ALA  26  -9.514   3.185  -0.493
  175    HA   ALA  26           HA       ALA  26 -10.529   5.767  -1.081
  176   1HB   ALA  26          1HB       ALA  26  -9.008   3.721  -2.649
  177   2HB   ALA  26          2HB       ALA  26  -9.614   5.183  -3.426
  178   3HB   ALA  26          3HB       ALA  26  -8.484   5.305  -2.079
  179    H    ASP  27           H        ASP  27 -11.398   2.530  -2.136
  180    HA   ASP  27           HA       ASP  27 -13.225   3.188  -4.145
  181   1HB   ASP  27          1HB       ASP  27 -12.174   0.914  -3.484
  182   2HB   ASP  27          2HB       ASP  27 -13.547   0.771  -2.393
  183    H    ALA  28           H        ALA  28 -13.835   2.377  -0.736
  184    HA   ALA  28           HA       ALA  28 -16.633   2.691  -0.844
  185   1HB   ALA  28          1HB       ALA  28 -15.685   1.483   0.972
  186   2HB   ALA  28          2HB       ALA  28 -14.709   2.869   1.464
  187   3HB   ALA  28          3HB       ALA  28 -16.463   2.914   1.646
  188    H    ALA  29           H        ALA  29 -14.042   4.967  -0.445
  189    HA   ALA  29           HA       ALA  29 -15.723   7.160   0.348
  190   1HB   ALA  29          1HB       ALA  29 -13.288   8.101  -0.757
  191   2HB   ALA  29          2HB       ALA  29 -13.761   8.008   0.941
  192   3HB   ALA  29          3HB       ALA  29 -12.934   6.649   0.179
  193    H    ALA  30           H        ALA  30 -14.507   5.829  -2.645
  194    HA   ALA  30           HA       ALA  30 -15.155   8.099  -4.274
  195   1HB   ALA  30          1HB       ALA  30 -15.038   5.989  -6.010
  196   2HB   ALA  30          2HB       ALA  30 -13.656   6.953  -5.489
  197   3HB   ALA  30          3HB       ALA  30 -14.025   5.430  -4.680
  198    H    ALA  31           H        ALA  31 -16.693   5.071  -3.388
  199    HA   ALA  31           HA       ALA  31 -19.018   5.598  -5.039
  200   1HB   ALA  31          1HB       ALA  31 -18.031   3.329  -3.418
  201   2HB   ALA  31          2HB       ALA  31 -19.781   3.490  -3.566
  202   3HB   ALA  31          3HB       ALA  31 -18.782   3.344  -5.014
  203    H    ALA  32           H        ALA  32 -18.086   7.185  -2.529
  204    HA   ALA  32           HA       ALA  32 -20.560   7.019  -0.968
  205   1HB   ALA  32          1HB       ALA  32 -18.985   8.858   0.317
  206   2HB   ALA  32          2HB       ALA  32 -19.073   7.141   0.702
  207   3HB   ALA  32          3HB       ALA  32 -17.797   7.744  -0.358
  208    H    ALA  33           H        ALA  33 -20.425   8.181  -3.619
  209    HA   ALA  33           HA       ALA  33 -20.824  11.029  -3.160
  210   1HB   ALA  33          1HB       ALA  33 -19.987  11.044  -5.240
  211   2HB   ALA  33          2HB       ALA  33 -20.333   9.331  -5.483
  212   3HB   ALA  33          3HB       ALA  33 -21.594  10.535  -5.760
  213    H    ALA  34           H        ALA  34 -22.673   8.378  -4.633
  214    HA   ALA  34           HA       ALA  34 -25.191   9.662  -3.961
  215   1HB   ALA  34          1HB       ALA  34 -25.474   6.958  -4.892
  216   2HB   ALA  34          2HB       ALA  34 -25.981   8.462  -5.661
  217   3HB   ALA  34          3HB       ALA  34 -24.351   7.843  -5.925
  218    H    ALA  35           H        ALA  35 -24.415   9.549  -1.653
  219    HA   ALA  35           HA       ALA  35 -24.198   7.098  -0.272
  220   1HB   ALA  35          1HB       ALA  35 -24.908   9.826   0.800
  221   2HB   ALA  35          2HB       ALA  35 -24.356   8.446   1.751
  222   3HB   ALA  35          3HB       ALA  35 -23.272   9.199   0.577
  Start of MODEL   20
    1   1H    GLY   1          1H        GLY   1  17.304 -21.644  -7.635
    2   2H    GLY   1          2H        GLY   1  18.057 -20.932  -8.978
    3   3H    GLY   1          3H        GLY   1  16.944 -22.192  -9.196
    4   1HA   GLY   1          2HA       GLY   1  16.441 -19.463  -9.184
    5   2HA   GLY   1          1HA       GLY   1  15.278 -20.773  -9.326
    6    H    SER   2           H        SER   2  14.691 -18.340  -8.085
    7    HA   SER   2           HA       SER   2  14.891 -18.626  -5.240
    8   1HB   SER   2          1HB       SER   2  12.796 -16.832  -5.930
    9   2HB   SER   2          2HB       SER   2  14.421 -16.438  -5.366
   10    HG   SER   2           HG       SER   2  14.051 -15.471  -7.372
   11    H    MET   3           H        MET   3  13.972 -20.610  -4.713
   12    HA   MET   3           HA       MET   3  11.213 -21.094  -5.553
   13   1HB   MET   3          1HB       MET   3  13.187 -22.816  -5.604
   14   2HB   MET   3          2HB       MET   3  12.795 -23.022  -3.903
   15   1HG   MET   3          1HG       MET   3  10.365 -23.340  -4.798
   16   2HG   MET   3          2HG       MET   3  11.183 -23.700  -6.316
   17   1HE   MET   3          1HE       MET   3  12.811 -25.874  -6.660
   18   2HE   MET   3          2HE       MET   3  11.911 -27.277  -6.078
   19   3HE   MET   3          3HE       MET   3  11.069 -25.974  -6.920
   20    H    ASN   4           H        ASN   4  13.026 -20.087  -2.818
   21    HA   ASN   4           HA       ASN   4  11.338 -20.934  -0.735
   22   1HB   ASN   4          1HB       ASN   4  13.673 -19.829  -0.632
   23   2HB   ASN   4          2HB       ASN   4  12.783 -18.312  -0.629
   24   1HD2  ASN   4          1HD2      ASN   4  13.532 -17.837   1.468
   25   2HD2  ASN   4          2HD2      ASN   4  12.888 -18.651   2.856
   26    H    ALA   5           H        ALA   5   9.501 -20.226   0.065
   27    HA   ALA   5           HA       ALA   5   7.927 -18.426  -1.538
   28   1HB   ALA   5          1HB       ALA   5   6.271 -18.960   0.490
   29   2HB   ALA   5          2HB       ALA   5   6.534 -20.068  -0.857
   30   3HB   ALA   5          3HB       ALA   5   7.388 -20.315   0.667
   31    HA   PRO   6           HA       PRO   6   7.975 -15.870   2.713
   32   1HB   PRO   6          1HB       PRO   6  10.718 -16.538   3.539
   33   2HB   PRO   6          2HB       PRO   6   9.280 -16.285   4.513
   34   1HG   PRO   6          1HG       PRO   6  10.305 -18.726   4.100
   35   2HG   PRO   6          2HG       PRO   6   8.567 -18.439   4.294
   36   1HD   PRO   6          1HD       PRO   6  10.120 -19.069   1.848
   37   2HD   PRO   6          2HD       PRO   6   8.436 -19.427   2.259
   38    H    ALA   7           H        ALA   7  10.360 -16.396   0.310
   39    HA   ALA   7           HA       ALA   7  11.793 -13.960   0.546
   40   1HB   ALA   7          1HB       ALA   7  12.395 -16.091  -0.784
   41   2HB   ALA   7          2HB       ALA   7  11.400 -15.383  -2.057
   42   3HB   ALA   7          3HB       ALA   7  12.819 -14.520  -1.464
   43    H    ARG   8           H        ARG   8   8.693 -14.752  -0.606
   44    HA   ARG   8           HA       ARG   8   8.418 -12.099  -1.870
   45   1HB   ARG   8          1HB       ARG   8   6.952 -14.681  -2.430
   46   2HB   ARG   8          2HB       ARG   8   6.460 -13.125  -3.081
   47   1HG   ARG   8          1HG       ARG   8   8.000 -13.188  -4.686
   48   2HG   ARG   8          2HG       ARG   8   9.262 -13.735  -3.580
   49   1HD   ARG   8          1HD       ARG   8   8.547 -15.299  -5.498
   50   2HD   ARG   8          2HD       ARG   8   8.727 -15.979  -3.881
   51    HE   ARG   8           HE       ARG   8   6.049 -15.101  -4.538
   52   1HH1  ARG   8          2HH1      ARG   8   8.317 -17.779  -4.589
   53   2HH1  ARG   8          1HH1      ARG   8   7.071 -18.991  -4.655
   54   1HH2  ARG   8          2HH2      ARG   8   4.428 -16.672  -4.617
   55   2HH2  ARG   8          1HH2      ARG   8   4.843 -18.359  -4.680
   56    H    ALA   9           H        ALA   9   7.941 -13.417   0.961
   57    HA   ALA   9           HA       ALA   9   5.193 -13.434   1.475
   58   1HB   ALA   9          1HB       ALA   9   7.583 -13.783   2.965
   59   2HB   ALA   9          2HB       ALA   9   6.536 -12.671   3.848
   60   3HB   ALA   9          3HB       ALA   9   5.938 -14.262   3.385
   61    H    ALA  10           H        ALA  10   7.525 -10.809   1.604
   62    HA   ALA  10           HA       ALA  10   6.010  -8.891   2.942
   63   1HB   ALA  10          1HB       ALA  10   7.910  -7.785   2.651
   64   2HB   ALA  10          2HB       ALA  10   8.440  -8.961   1.451
   65   3HB   ALA  10          3HB       ALA  10   7.502  -7.554   0.953
   66    H    ALA  11           H        ALA  11   5.952  -9.885  -0.429
   67    HA   ALA  11           HA       ALA  11   4.039  -7.773  -1.081
   68   1HB   ALA  11          1HB       ALA  11   4.520  -9.509  -3.291
   69   2HB   ALA  11          2HB       ALA  11   4.994  -7.821  -3.082
   70   3HB   ALA  11          3HB       ALA  11   6.062  -9.112  -2.531
   71    H    LYS  12           H        LYS  12   4.150 -11.126  -0.337
   72    HA   LYS  12           HA       LYS  12   1.669 -11.755  -1.676
   73   1HB   LYS  12          1HB       LYS  12   3.879 -13.224  -0.655
   74   2HB   LYS  12          2HB       LYS  12   2.423 -13.811   0.140
   75   1HG   LYS  12          1HG       LYS  12   2.816 -13.592  -2.836
   76   2HG   LYS  12          2HG       LYS  12   2.948 -15.074  -1.889
   77   1HD   LYS  12          1HD       LYS  12   0.759 -15.388  -2.138
   78   2HD   LYS  12          2HD       LYS  12   0.469 -13.904  -1.229
   79   1HE   LYS  12          2HE       LYS  12   1.087 -12.875  -3.644
   80   2HE   LYS  12          1HE       LYS  12   0.363 -14.407  -4.135
   81   1HZ   LYS  12          1HZ       LYS  12  -1.482 -13.674  -2.465
   82   2HZ   LYS  12          2HZ       LYS  12  -1.460 -13.063  -4.042
   83   3HZ   LYS  12          3HZ       LYS  12  -0.872 -12.119  -2.760
   84    H    THR  13           H        THR  13   2.740 -11.158   1.641
   85    HA   THR  13           HA       THR  13  -0.065 -11.453   2.472
   86    HB   THR  13           HB       THR  13   2.031 -11.182   4.538
   87    HG1  THR  13           1HG      THR  13   3.041 -12.996   4.041
   88   1HG2  THR  13          1HG2      THR  13  -0.659 -12.124   4.285
   89   2HG2  THR  13          2HG2      THR  13   0.301 -11.912   5.749
   90   3HG2  THR  13          3HG2      THR  13   0.356 -13.440   4.874
   91    H    ALA  14           H        ALA  14   2.766  -9.386   3.208
   92    HA   ALA  14           HA       ALA  14   1.265  -7.503   4.686
   93   1HB   ALA  14          1HB       ALA  14   3.636  -7.748   5.048
   94   2HB   ALA  14          2HB       ALA  14   3.975  -7.235   3.396
   95   3HB   ALA  14          3HB       ALA  14   3.286  -6.094   4.551
   96    H    ALA  15           H        ALA  15   2.827  -7.084   1.506
   97    HA   ALA  15           HA       ALA  15   1.530  -4.650   0.923
   98   1HB   ALA  15          1HB       ALA  15   2.793  -6.648  -0.948
   99   2HB   ALA  15          2HB       ALA  15   2.332  -5.000  -1.375
  100   3HB   ALA  15          3HB       ALA  15   3.591  -5.280  -0.173
  101    H    ASP  16           H        ASP  16   0.500  -7.927   0.625
  102    HA   ASP  16           HA       ASP  16  -1.498  -7.519  -1.372
  103   1HB   ASP  16          1HB       ASP  16  -0.374  -9.733  -0.228
  104   2HB   ASP  16          2HB       ASP  16  -1.949  -9.690   0.559
  105    H    ALA  17           H        ALA  17  -1.512  -7.678   2.162
  106    HA   ALA  17           HA       ALA  17  -4.265  -7.406   2.575
  107   1HB   ALA  17          1HB       ALA  17  -3.087  -7.993   4.477
  108   2HB   ALA  17          2HB       ALA  17  -1.842  -6.770   4.211
  109   3HB   ALA  17          3HB       ALA  17  -3.443  -6.291   4.780
  110    H    LEU  18           H        LEU  18  -1.717  -4.938   2.458
  111    HA   LEU  18           HA       LEU  18  -3.412  -2.729   2.842
  112   1HB   LEU  18          1HB       LEU  18  -0.788  -2.757   1.365
  113   2HB   LEU  18          2HB       LEU  18  -1.560  -1.370   2.107
  114    HG   LEU  18           HG       LEU  18  -0.554  -3.760   3.650
  115   1HD1  LEU  18          1HD1      LEU  18   1.020  -1.587   4.264
  116   2HD1  LEU  18          2HD1      LEU  18   1.477  -2.948   3.234
  117   3HD1  LEU  18          3HD1      LEU  18   0.824  -1.473   2.515
  118   1HD2  LEU  18          1HD2      LEU  18  -2.387  -2.358   4.660
  119   2HD2  LEU  18          2HD2      LEU  18  -0.889  -2.424   5.593
  120   3HD2  LEU  18          3HD2      LEU  18  -1.263  -0.999   4.624
  121    H    ALA  19           H        ALA  19  -2.394  -4.439  -0.056
  122    HA   ALA  19           HA       ALA  19  -3.187  -2.624  -1.999
  123   1HB   ALA  19          1HB       ALA  19  -2.492  -4.244  -3.346
  124   2HB   ALA  19          2HB       ALA  19  -2.331  -5.300  -1.941
  125   3HB   ALA  19          3HB       ALA  19  -3.839  -5.276  -2.858
  126    H    ALA  20           H        ALA  20  -5.090  -5.287  -0.599
  127    HA   ALA  20           HA       ALA  20  -7.490  -4.537  -1.938
  128   1HB   ALA  20          1HB       ALA  20  -8.321  -6.068   0.164
  129   2HB   ALA  20          2HB       ALA  20  -7.774  -6.690  -1.393
  130   3HB   ALA  20          3HB       ALA  20  -6.649  -6.594  -0.037
  131    H    ALA  21           H        ALA  21  -6.220  -3.992   1.320
  132    HA   ALA  21           HA       ALA  21  -8.566  -2.918   2.444
  133   1HB   ALA  21          1HB       ALA  21  -6.620  -1.724   3.894
  134   2HB   ALA  21          2HB       ALA  21  -7.177  -3.377   4.146
  135   3HB   ALA  21          3HB       ALA  21  -5.733  -3.072   3.184
  136    H    LYS  22           H        LYS  22  -5.791  -1.333   0.871
  137    HA   LYS  22           HA       LYS  22  -6.797   1.297   1.352
  138   1HB   LYS  22          1HB       LYS  22  -4.471   0.105  -0.001
  139   2HB   LYS  22          2HB       LYS  22  -5.036   1.609  -0.714
  140   1HG   LYS  22          1HG       LYS  22  -3.258   1.459   1.307
  141   2HG   LYS  22          2HG       LYS  22  -4.298   2.852   1.000
  142   1HD   LYS  22          1HD       LYS  22  -5.301   2.587   2.967
  143   2HD   LYS  22          2HD       LYS  22  -5.711   0.917   2.580
  144   1HE   LYS  22          2HE       LYS  22  -3.737   0.091   3.524
  145   2HE   LYS  22          1HE       LYS  22  -2.966   1.677   3.514
  146   1HZ   LYS  22          1HZ       LYS  22  -3.930   0.686   5.711
  147   2HZ   LYS  22          2HZ       LYS  22  -5.398   1.297   5.117
  148   3HZ   LYS  22          3HZ       LYS  22  -4.091   2.343   5.376
  149    H    LYS  23           H        LYS  23  -7.018  -1.033  -1.257
  150    HA   LYS  23           HA       LYS  23  -8.174   0.641  -3.201
  151   1HB   LYS  23          1HB       LYS  23  -7.295  -1.739  -3.492
  152   2HB   LYS  23          2HB       LYS  23  -8.839  -2.282  -2.850
  153   1HG   LYS  23          1HG       LYS  23  -9.124  -2.376  -5.152
  154   2HG   LYS  23          2HG       LYS  23  -9.893  -0.856  -4.693
  155   1HD   LYS  23          1HD       LYS  23  -8.646  -0.044  -6.394
  156   2HD   LYS  23          2HD       LYS  23  -7.392   0.016  -5.153
  157   1HE   LYS  23          2HE       LYS  23  -6.993  -2.469  -5.937
  158   2HE   LYS  23          1HE       LYS  23  -7.741  -1.876  -7.419
  159   1HZ   LYS  23          1HZ       LYS  23  -5.301  -0.818  -6.101
  160   2HZ   LYS  23          2HZ       LYS  23  -6.073  -0.068  -7.414
  161   3HZ   LYS  23          3HZ       LYS  23  -5.396  -1.610  -7.600
  162    H    THR  24           H        THR  24  -9.652  -1.449  -0.745
  163    HA   THR  24           HA       THR  24 -12.320  -0.810  -1.349
  164    HB   THR  24           HB       THR  24 -10.858  -2.160   0.837
  165    HG1  THR  24           1HG      THR  24 -13.078  -2.700  -0.845
  166   1HG2  THR  24          1HG2      THR  24 -13.741  -1.425   1.244
  167   2HG2  THR  24          2HG2      THR  24 -12.407  -0.541   1.983
  168   3HG2  THR  24          3HG2      THR  24 -12.656  -2.244   2.366
  169    H    ALA  25           H        ALA  25  -9.992   0.567   0.957
  170    HA   ALA  25           HA       ALA  25 -11.693   2.418   2.181
  171   1HB   ALA  25          1HB       ALA  25  -9.081   3.548   1.890
  172   2HB   ALA  25          2HB       ALA  25  -9.844   2.861   3.325
  173   3HB   ALA  25          3HB       ALA  25  -8.937   1.821   2.224
  174    H    ALA  26           H        ALA  26  -9.515   2.862  -0.597
  175    HA   ALA  26           HA       ALA  26 -10.271   5.476  -1.248
  176   1HB   ALA  26          1HB       ALA  26  -9.653   3.793  -3.557
  177   2HB   ALA  26          2HB       ALA  26  -8.840   5.237  -2.954
  178   3HB   ALA  26          3HB       ALA  26  -8.482   3.662  -2.243
  179    H    ASP  27           H        ASP  27 -11.622   2.378  -2.237
  180    HA   ASP  27           HA       ASP  27 -13.489   3.271  -4.116
  181   1HB   ASP  27          1HB       ASP  27 -12.790   0.860  -3.491
  182   2HB   ASP  27          2HB       ASP  27 -14.024   0.976  -2.242
  183    H    ALA  28           H        ALA  28 -13.950   2.582  -0.653
  184    HA   ALA  28           HA       ALA  28 -16.638   3.411  -0.553
  185   1HB   ALA  28          1HB       ALA  28 -14.866   2.202   1.177
  186   2HB   ALA  28          2HB       ALA  28 -15.205   3.751   1.951
  187   3HB   ALA  28          3HB       ALA  28 -16.528   2.658   1.540
  188    H    ALA  29           H        ALA  29 -13.610   5.150  -0.096
  189    HA   ALA  29           HA       ALA  29 -14.752   7.533   0.928
  190   1HB   ALA  29          1HB       ALA  29 -12.155   6.583   0.274
  191   2HB   ALA  29          2HB       ALA  29 -12.387   8.155  -0.494
  192   3HB   ALA  29          3HB       ALA  29 -12.604   7.985   1.249
  193    H    ALA  30           H        ALA  30 -14.001   6.399  -2.331
  194    HA   ALA  30           HA       ALA  30 -14.611   8.833  -3.662
  195   1HB   ALA  30          1HB       ALA  30 -14.790   7.309  -5.687
  196   2HB   ALA  30          2HB       ALA  30 -13.250   7.310  -4.830
  197   3HB   ALA  30          3HB       ALA  30 -14.389   5.985  -4.594
  198    H    ALA  31           H        ALA  31 -16.508   6.112  -2.594
  199    HA   ALA  31           HA       ALA  31 -18.877   7.144  -3.979
  200   1HB   ALA  31          1HB       ALA  31 -17.936   4.555  -3.467
  201   2HB   ALA  31          2HB       ALA  31 -19.376   4.759  -2.465
  202   3HB   ALA  31          3HB       ALA  31 -19.470   5.019  -4.208
  203    H    ALA  32           H        ALA  32 -17.541   8.218  -1.430
  204    HA   ALA  32           HA       ALA  32 -19.620   7.761   0.558
  205   1HB   ALA  32          1HB       ALA  32 -17.056   9.343   0.705
  206   2HB   ALA  32          2HB       ALA  32 -18.174   9.094   2.047
  207   3HB   ALA  32          3HB       ALA  32 -17.332   7.720   1.333
  208    H    ALA  33           H        ALA  33 -20.703   9.021  -1.593
  209    HA   ALA  33           HA       ALA  33 -20.757  11.875  -1.189
  210   1HB   ALA  33          1HB       ALA  33 -21.460  11.779  -3.294
  211   2HB   ALA  33          2HB       ALA  33 -21.701  10.035  -3.183
  212   3HB   ALA  33          3HB       ALA  33 -22.996  11.135  -2.706
  213    H    ALA  34           H        ALA  34 -22.952   9.164  -0.606
  214    HA   ALA  34           HA       ALA  34 -24.385  10.852   1.338
  215   1HB   ALA  34          1HB       ALA  34 -25.661  10.234  -0.774
  216   2HB   ALA  34          2HB       ALA  34 -25.657   8.578  -0.166
  217   3HB   ALA  34          3HB       ALA  34 -26.439   9.857   0.762
  218    H    ALA  35           H        ALA  35 -22.958  10.121   2.966
  219    HA   ALA  35           HA       ALA  35 -23.687   7.508   4.031
  220   1HB   ALA  35          1HB       ALA  35 -20.783   8.181   4.076
  221   2HB   ALA  35          2HB       ALA  35 -21.580   6.609   4.119
  222   3HB   ALA  35          3HB       ALA  35 -21.473   7.499   2.601