*HEADER    METAL BINDING PROTEIN                   16-SEP-10   2L3M              
*TITLE     SOLUTION STRUCTURE OF THE PUTATIVE COPPER-ION-BINDING PROTEIN FROM    
*TITLE    2 BACILLUS ANTHRACIS STR. AMES                                         
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: COPPER-ION-BINDING PROTEIN;                                
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: BACILLUS ANTHRACIS;                             
*SOURCE   3 ORGANISM_COMMON: ANTHRAX,ANTHRAX BACTERIUM;                          
*SOURCE   4 ORGANISM_TAXID: 198094;                                              
*SOURCE   5 STRAIN: AMES;                                                        
*SOURCE   6 GENE: BAS3576, BA_3860, GBAA3860, GBAA_3860;                         
*SOURCE   7 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   8 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR: PMCSG7                                     
*KEYWDS    STRUCTURAL GENOMICS, CENTER FOR STRUCTURAL GENOMICS OF INFECTIOUS     
*KEYWDS   2 DISEASES, CSGID, METAL BINDING PROTEIN                               
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    Y.ZHANG, J.WINSOR, I.DUBROVSKA, W.ANDERSON, I.RADHAKRISHNAN, CENTER   
*AUTHOR   2 FOR STRUCTURAL GENOMICS OF INFECTIOUS DISEASES (CSGID)               
*REVDAT   1   12-JAN-11 2L3M    0                                                


 ASSI {    1}
   (( segid "ATXH" and resid 6    and name HE21))
   (( segid "ATXH" and resid 6    and name HE22))
      1.900     0.500     0.500 peak     1 spectrum    1 weight  0.10000E+01 volume  0.13864E-01 ppm1      6.698 ppm2      7.327 CV     1
 ASSI {    2}
   (( segid "ATXH" and resid 4    and name HA  ))
   (( segid "ATXH" and resid 5    and name HN  ))
      2.100     0.500     0.500 peak     2 spectrum    1 weight  0.10000E+01 volume  0.11993E-01 ppm1      9.159 ppm2      5.171 CV     1
 ASSI {    3}
   (( segid "ATXH" and resid 48   and name HA  ))
   (( segid "ATXH" and resid 49   and name HN  ))
      2.000     0.500     0.500 peak     3 spectrum    1 weight  0.10000E+01 volume  0.11773E-01 ppm1      9.252 ppm2      5.237 CV     1
 ASSI {    4}
   (( segid "ATXH" and resid 30   and name HA  ))
   (( segid "ATXH" and resid 31   and name HN  ))
      2.100     0.500     0.500 peak     4 spectrum    1 weight  0.10000E+01 volume  0.10838E-01 ppm1      8.606 ppm2      4.185 CV     1
 ASSI {    5}
   (( segid "ATXH" and resid 6    and name HA  ))
   (( segid "ATXH" and resid 7    and name HN  ))
      2.100     0.500     0.500 peak     5 spectrum    1 weight  0.10000E+01 volume  0.10684E-01 ppm1      9.267 ppm2      5.192 CV     1
 ASSI {    6}
   (( segid "ATXH" and resid 5    and name HA  ))
   (( segid "ATXH" and resid 6    and name HN  ))
      2.100     0.600     0.600 peak     6 spectrum    1 weight  0.10000E+01 volume  0.10475E-01 ppm1      8.621 ppm2      4.627 CV     1
 ASSI {    9}
   (( segid "ATXH" and resid 57   and name HB2 ))
   (( segid "ATXH" and resid 57   and name HN  ))
      2.100     0.600     0.600 peak     9 spectrum    1 weight  0.10000E+01 volume  0.10035E-01 ppm1      8.103 ppm2      1.754 CV     1
 OR {    9}
   (( segid "ATXH" and resid 57   and name HB3 ))
   (( segid "ATXH" and resid 57   and name HN  ))
 ASSI {   10}
   (( segid "ATXH" and resid 31   and name HA  ))
   (( segid "ATXH" and resid 32   and name HN  ))
      2.100     0.600     0.600 peak    10 spectrum    1 weight  0.10000E+01 volume  0.99911E-02 ppm1      8.560 ppm2      4.436 CV     1
 ASSI {   11}
   (( segid "ATXH" and resid 33   and name HB  ))
   (( segid "ATXH" and resid 33   and name HN  ))
      2.100     0.600     0.600 peak    11 spectrum    1 weight  0.10000E+01 volume  0.97926E-02 ppm1      7.523 ppm2      2.257 CV     1
 ASSI {   12}
   (( segid "ATXH" and resid 38   and name HA  ))
   (( segid "ATXH" and resid 39   and name HN  ))
      2.100     0.500     0.500 peak    12 spectrum    1 weight  0.10000E+01 volume  0.95617E-02 ppm1      8.890 ppm2      4.327 CV     1
 ASSI {   13}
   (  segid "ATXH" and resid 61   and name HB% )
   (( segid "ATXH" and resid 61   and name HN  ))
      2.200     0.600     0.600 peak    13 spectrum    1 weight  0.10000E+01 volume  0.93854E-02 ppm1      7.709 ppm2      1.494 CV     1
 ASSI {   14}
   (( segid "ATXH" and resid 54   and name HN  ))
   (( segid "ATXH" and resid 53   and name HN  ))
      2.100     0.600     0.600 peak    14 spectrum    1 weight  0.10000E+01 volume  0.91984E-02 ppm1      7.800 ppm2      8.018 CV     1
 ASSI {   15}
   (  segid "ATXH" and resid 55   and name HG2%)
   (( segid "ATXH" and resid 55   and name HN  ))
      2.200     0.600     0.600 peak    15 spectrum    1 weight  0.10000E+01 volume  0.86926E-02 ppm1      8.078 ppm2      1.172 CV     1
 ASSI {   16}
   (( segid "ATXH" and resid 49   and name HA  ))
   (( segid "ATXH" and resid 50   and name HN  ))
      2.200     0.600     0.600 peak    16 spectrum    1 weight  0.10000E+01 volume  0.86703E-02 ppm1      8.529 ppm2      5.300 CV     1
 ASSI {   17}
   (( segid "ATXH" and resid 34   and name HN  ))
   (( segid "ATXH" and resid 35   and name HN  ))
      2.200     0.600     0.600 peak    17 spectrum    1 weight  0.10000E+01 volume  0.86264E-02 ppm1      7.513 ppm2      8.780 CV     1
 ASSI {   19}
   (( segid "ATXH" and resid 33   and name HA  ))
   (( segid "ATXH" and resid 34   and name HN  ))
      2.100     0.600     0.600 peak    19 spectrum    1 weight  0.10000E+01 volume  0.85056E-02 ppm1      8.787 ppm2      4.069 CV     1
 ASSI {   20}
   (( segid "ATXH" and resid 44   and name HA  ))
   (( segid "ATXH" and resid 45   and name HN  ))
      2.200     0.600     0.600 peak    20 spectrum    1 weight  0.10000E+01 volume  0.83185E-02 ppm1      8.979 ppm2      5.496 CV     1
 ASSI {   21}
   (( segid "ATXH" and resid 54   and name HA  ))
   (( segid "ATXH" and resid 55   and name HN  ))
      2.200     0.600     0.600 peak    21 spectrum    1 weight  0.10000E+01 volume  0.76473E-02 ppm1      8.078 ppm2      4.647 CV     1
 ASSI {   22}
   (( segid "ATXH" and resid 10   and name HA  ))
   (( segid "ATXH" and resid 11   and name HN  ))
      2.200     0.600     0.600 peak    22 spectrum    1 weight  0.10000E+01 volume  0.73941E-02 ppm1      8.525 ppm2      4.655 CV     1
 ASSI {   23}
   (( segid "ATXH" and resid 46   and name HA  ))
   (( segid "ATXH" and resid 47   and name HN  ))
      2.200     0.600     0.600 peak    23 spectrum    1 weight  0.10000E+01 volume  0.72509E-02 ppm1      9.162 ppm2      5.245 CV     1
 ASSI {   24}
   (( segid "ATXH" and resid 55   and name HA  ))
   (( segid "ATXH" and resid 56   and name HN  ))
      2.300     0.600     0.600 peak    24 spectrum    1 weight  0.10000E+01 volume  0.71301E-02 ppm1      8.796 ppm2      4.833 CV     1
 ASSI {   26}
   (( segid "ATXH" and resid 14   and name HB3 ))
   (( segid "ATXH" and resid 14   and name HN  ))
      2.700     0.900     0.900 peak    26 spectrum    1 weight  0.10000E+01 volume  0.67340E-02 ppm1      8.890 ppm2      1.418 CV     1
 ASSI {   27}
   (( segid "ATXH" and resid 28   and name HB2 ))
   (( segid "ATXH" and resid 28   and name HN  ))
      2.200     0.600     0.600 peak    27 spectrum    1 weight  0.10000E+01 volume  0.66789E-02 ppm1      7.699 ppm2      1.865 CV     1
 OR {   27}
   (( segid "ATXH" and resid 28   and name HB3 ))
   (( segid "ATXH" and resid 28   and name HN  ))
 ASSI {   28}
   (( segid "ATXH" and resid 62   and name HB  ))
   (( segid "ATXH" and resid 62   and name HN  ))
      2.300     0.600     0.600 peak    28 spectrum    1 weight  0.10000E+01 volume  0.65249E-02 ppm1      7.188 ppm2      2.192 CV     1
 ASSI {   29}
   (( segid "ATXH" and resid 29   and name HB2 ))
   (( segid "ATXH" and resid 29   and name HN  ))
      2.300     0.700     0.700 peak    29 spectrum    1 weight  0.10000E+01 volume  0.62278E-02 ppm1      6.875 ppm2      2.025 CV     1
 OR {   29}
   (( segid "ATXH" and resid 29   and name HB3 ))
   (( segid "ATXH" and resid 29   and name HN  ))
 ASSI {   32}
   (  segid "ATXH" and resid 54   and name HG2%)
   (( segid "ATXH" and resid 54   and name HN  ))
      2.700     0.900     0.900 peak    32 spectrum    1 weight  0.10000E+01 volume  0.61288E-02 ppm1      8.018 ppm2      0.737 CV     1
 ASSI {   33}
   (( segid "ATXH" and resid 35   and name HA  ))
   (( segid "ATXH" and resid 36   and name HN  ))
      2.300     0.700     0.700 peak    33 spectrum    1 weight  0.10000E+01 volume  0.60297E-02 ppm1      8.666 ppm2      4.619 CV     1
 ASSI {   35}
   (( segid "ATXH" and resid 35   and name HB2 ))
   (( segid "ATXH" and resid 35   and name HN  ))
      2.300     0.700     0.700 peak    35 spectrum    1 weight  0.10000E+01 volume  0.58977E-02 ppm1      7.508 ppm2      2.309 CV     1
 OR {   35}
   (( segid "ATXH" and resid 35   and name HG2 ))
   (( segid "ATXH" and resid 35   and name HN  ))
 ASSI {   36}
   (( segid "ATXH" and resid 35   and name HG3 ))
   (( segid "ATXH" and resid 35   and name HN  ))
      2.500     0.800     0.800 peak    36 spectrum    1 weight  0.10000E+01 volume  0.58647E-02 ppm1      7.513 ppm2      1.933 CV     1
 OR {   36}
   (( segid "ATXH" and resid 35   and name HB3 ))
   (( segid "ATXH" and resid 35   and name HN  ))
 ASSI {   37}
   (( segid "ATXH" and resid 49   and name HB  ))
   (( segid "ATXH" and resid 50   and name HN  ))
      2.300     0.600     0.600 peak    37 spectrum    1 weight  0.10000E+01 volume  0.57217E-02 ppm1      8.529 ppm2      1.559 CV     1
 ASSI {   38}
   (( segid "ATXH" and resid 58   and name HB2 ))
   (( segid "ATXH" and resid 58   and name HN  ))
      2.300     0.700     0.700 peak    38 spectrum    1 weight  0.10000E+01 volume  0.53695E-02 ppm1      7.582 ppm2      3.011 CV     1
 ASSI {   39}
   (( segid "ATXH" and resid 50   and name HA  ))
   (( segid "ATXH" and resid 51   and name HN  ))
      2.300     0.700     0.700 peak    39 spectrum    1 weight  0.10000E+01 volume  0.53695E-02 ppm1      8.793 ppm2      5.034 CV     1
 ASSI {   40}
   (( segid "ATXH" and resid 53   and name HN  ))
   (( segid "ATXH" and resid 52   and name HN  ))
      2.400     0.700     0.700 peak    40 spectrum    1 weight  0.10000E+01 volume  0.53586E-02 ppm1      8.773 ppm2      7.807 CV     1
 ASSI {   41}
   (( segid "ATXH" and resid 47   and name HA  ))
   (( segid "ATXH" and resid 48   and name HN  ))
      2.300     0.700     0.700 peak    41 spectrum    1 weight  0.10000E+01 volume  0.52705E-02 ppm1      8.715 ppm2      5.076 CV     1
 ASSI {   42}
   (( segid "ATXH" and resid 31   and name HB3 ))
   (( segid "ATXH" and resid 31   and name HN  ))
      2.400     0.700     0.700 peak    42 spectrum    1 weight  0.10000E+01 volume  0.52595E-02 ppm1      8.606 ppm2      2.673 CV     1
 ASSI {   43}
   (( segid "ATXH" and resid 3    and name HA  ))
   (( segid "ATXH" and resid 4    and name HN  ))
      2.400     0.700     0.700 peak    43 spectrum    1 weight  0.10000E+01 volume  0.52045E-02 ppm1      8.150 ppm2      4.404 CV     1
 ASSI {   44}
   (( segid "ATXH" and resid 4    and name HB2 ))
   (( segid "ATXH" and resid 4    and name HN  ))
      2.400     0.700     0.700 peak    44 spectrum    1 weight  0.10000E+01 volume  0.51385E-02 ppm1      8.150 ppm2      1.953 CV     1
 ASSI {   45}
   (  segid "ATXH" and resid 62   and name HG1%)
   (( segid "ATXH" and resid 62   and name HN  ))
      2.800     1.000     1.000 peak    45 spectrum    1 weight  0.10000E+01 volume  0.50945E-02 ppm1      7.187 ppm2      1.151 CV     1
 ASSI {   46}
   (( segid "ATXH" and resid 55   and name HB  ))
   (( segid "ATXH" and resid 56   and name HN  ))
      2.400     0.700     0.700 peak    46 spectrum    1 weight  0.10000E+01 volume  0.50615E-02 ppm1      8.795 ppm2      4.422 CV     1
 ASSI {   47}
   (( segid "ATXH" and resid 69   and name HA  ))
   (( segid "ATXH" and resid 70   and name HN  ))
      2.400     0.700     0.700 peak    47 spectrum    1 weight  0.10000E+01 volume  0.50064E-02 ppm1      9.466 ppm2      5.037 CV     1
 ASSI {   49}
   (( segid "ATXH" and resid 39   and name HA  ))
   (( segid "ATXH" and resid 38   and name HN  ))
      2.500     2.500     3.500 peak    49 spectrum    1 weight  0.10000E+01 volume  0.49185E-02 ppm1      9.834 ppm2      4.760 CV     1
 ASSI {   50}
   (( segid "ATXH" and resid 32   and name HN  ))
   (( segid "ATXH" and resid 33   and name HN  ))
      2.400     0.700     0.700 peak    50 spectrum    1 weight  0.10000E+01 volume  0.48744E-02 ppm1      7.522 ppm2      8.560 CV     1
 ASSI {   52}
   (( segid "ATXH" and resid 68   and name HA  ))
   (( segid "ATXH" and resid 69   and name HN  ))
      2.400     0.700     0.700 peak    52 spectrum    1 weight  0.10000E+01 volume  0.48634E-02 ppm1      7.900 ppm2      4.636 CV     1
 ASSI {   54}
   (  segid "ATXH" and resid 27   and name HG2%)
   (( segid "ATXH" and resid 27   and name HN  ))
      2.400     0.700     0.700 peak    54 spectrum    1 weight  0.10000E+01 volume  0.47974E-02 ppm1      8.177 ppm2      0.907 CV     1
 ASSI {   55}
   (( segid "ATXH" and resid 56   and name HB3 ))
   (( segid "ATXH" and resid 56   and name HN  ))
      2.500     2.500     3.500 peak    55 spectrum    1 weight  0.10000E+01 volume  0.47644E-02 ppm1      8.796 ppm2      1.591 CV     1
 ASSI {   56}
   (( segid "ATXH" and resid 60   and name HB  ))
   (( segid "ATXH" and resid 61   and name HN  ))
      2.400     0.700     0.700 peak    56 spectrum    1 weight  0.10000E+01 volume  0.47534E-02 ppm1      7.709 ppm2      2.017 CV     1
 ASSI {   57}
   (( segid "ATXH" and resid 8    and name HA  ))
   (( segid "ATXH" and resid 9    and name HN  ))
      2.400     0.700     0.700 peak    57 spectrum    1 weight  0.10000E+01 volume  0.47204E-02 ppm1      9.295 ppm2      4.877 CV     1
 ASSI {   58}
   (( segid "ATXH" and resid 59   and name HB  ))
   (( segid "ATXH" and resid 59   and name HN  ))
      2.400     0.700     0.700 peak    58 spectrum    1 weight  0.10000E+01 volume  0.46984E-02 ppm1      7.360 ppm2      2.009 CV     1
 ASSI {   59}
   (( segid "ATXH" and resid 43   and name HA1 ))
   (( segid "ATXH" and resid 43   and name HN  ))
      2.400     0.700     0.700 peak    59 spectrum    1 weight  0.10000E+01 volume  0.46874E-02 ppm1      7.942 ppm2      3.628 CV     1
 ASSI {   60}
   (( segid "ATXH" and resid 32   and name HA1 ))
   (( segid "ATXH" and resid 32   and name HN  ))
      2.400     0.700     0.700 peak    60 spectrum    1 weight  0.10000E+01 volume  0.46544E-02 ppm1      8.561 ppm2      3.662 CV     1
 ASSI {   62}
   (  segid "ATXH" and resid 23   and name HG2%)
   (( segid "ATXH" and resid 24   and name HN  ))
      2.400     0.700     0.700 peak    62 spectrum    1 weight  0.10000E+01 volume  0.45553E-02 ppm1      8.601 ppm2      0.551 CV     1
 ASSI {   65}
   (( segid "ATXH" and resid 50   and name HB2 ))
   (( segid "ATXH" and resid 50   and name HN  ))
      2.500     0.800     0.800 peak    65 spectrum    1 weight  0.10000E+01 volume  0.44123E-02 ppm1      8.530 ppm2      2.943 CV     1
 ASSI {   66}
   (( segid "ATXH" and resid 57   and name HN  ))
   (( segid "ATXH" and resid 58   and name HN  ))
      2.500     0.800     0.800 peak    66 spectrum    1 weight  0.10000E+01 volume  0.43793E-02 ppm1      7.582 ppm2      8.097 CV     1
 ASSI {   67}
   (  segid "ATXH" and resid 60   and name HG1%)
   (( segid "ATXH" and resid 60   and name HN  ))
      2.900     1.100     1.100 peak    67 spectrum    1 weight  0.10000E+01 volume  0.43683E-02 ppm1      8.537 ppm2      0.981 CV     1
 ASSI {   68}
   (( segid "ATXH" and resid 27   and name HB  ))
   (( segid "ATXH" and resid 27   and name HN  ))
      2.400     0.700     0.700 peak    68 spectrum    1 weight  0.10000E+01 volume  0.43573E-02 ppm1      8.177 ppm2      2.069 CV     1
 ASSI {   69}
   (( segid "ATXH" and resid 64   and name HB2 ))
   (( segid "ATXH" and resid 64   and name HN  ))
      2.400     0.700     0.700 peak    69 spectrum    1 weight  0.10000E+01 volume  0.43133E-02 ppm1      9.007 ppm2      2.109 CV     1
 ASSI {   71}
   (( segid "ATXH" and resid 63   and name HB  ))
   (( segid "ATXH" and resid 63   and name HN  ))
      2.400     0.700     0.700 peak    71 spectrum    1 weight  0.10000E+01 volume  0.42583E-02 ppm1      7.636 ppm2      1.812 CV     1
 ASSI {   72}
   (( segid "ATXH" and resid 65   and name HB2 ))
   (( segid "ATXH" and resid 65   and name HN  ))
      2.500     0.800     0.800 peak    72 spectrum    1 weight  0.10000E+01 volume  0.42362E-02 ppm1      8.427 ppm2      2.908 CV     1
 ASSI {   75}
   (( segid "ATXH" and resid 21   and name HB2 ))
   (( segid "ATXH" and resid 21   and name HN  ))
      2.500     0.800     0.800 peak    75 spectrum    1 weight  0.10000E+01 volume  0.41702E-02 ppm1      7.836 ppm2      2.799 CV     1
 OR {   75}
   (( segid "ATXH" and resid 21   and name HB3 ))
   (( segid "ATXH" and resid 21   and name HN  ))
 ASSI {   76}
   (( segid "ATXH" and resid 67   and name HA1 ))
   (( segid "ATXH" and resid 67   and name HN  ))
      2.400     0.700     0.700 peak    76 spectrum    1 weight  0.10000E+01 volume  0.41702E-02 ppm1      7.883 ppm2      3.548 CV     1
 ASSI {   77}
   (  segid "ATXH" and resid 22   and name HB% )
   (( segid "ATXH" and resid 22   and name HN  ))
      2.500     0.800     0.800 peak    77 spectrum    1 weight  0.10000E+01 volume  0.41042E-02 ppm1      8.535 ppm2      1.589 CV     1
 ASSI {   78}
   (  segid "ATXH" and resid 61   and name HB% )
   (( segid "ATXH" and resid 62   and name HN  ))
      2.500     0.800     0.800 peak    78 spectrum    1 weight  0.10000E+01 volume  0.40272E-02 ppm1      7.187 ppm2      1.496 CV     1
 ASSI {   79}
   (( segid "ATXH" and resid 4    and name HG3 ))
   (( segid "ATXH" and resid 4    and name HN  ))
      3.000     1.100     1.100 peak    79 spectrum    1 weight  0.10000E+01 volume  0.39832E-02 ppm1      8.150 ppm2      2.447 CV     1
 ASSI {   81}
   (( segid "ATXH" and resid 49   and name HG12))
   (( segid "ATXH" and resid 49   and name HN  ))
      2.500     0.800     0.800 peak    81 spectrum    1 weight  0.10000E+01 volume  0.38622E-02 ppm1      9.252 ppm2      0.873 CV     1
 ASSI {   82}
   (( segid "ATXH" and resid 68   and name HB3 ))
   (( segid "ATXH" and resid 68   and name HN  ))
      2.900     1.100     1.100 peak    82 spectrum    1 weight  0.10000E+01 volume  0.38622E-02 ppm1      6.775 ppm2      2.272 CV     1
 ASSI {   83}
   (  segid "ATXH" and resid 49   and name HG2%)
   (( segid "ATXH" and resid 49   and name HN  ))
      2.500     0.800     0.800 peak    83 spectrum    1 weight  0.10000E+01 volume  0.38071E-02 ppm1      9.253 ppm2      0.708 CV     1
 ASSI {   84}
   (( segid "ATXH" and resid 61   and name HA  ))
   (( segid "ATXH" and resid 61   and name HN  ))
      2.600     0.800     0.800 peak    84 spectrum    1 weight  0.10000E+01 volume  0.38071E-02 ppm1      7.710 ppm2      4.201 CV     1
 ASSI {   86}
   (  segid "ATXH" and resid 53   and name HG2%)
   (( segid "ATXH" and resid 53   and name HN  ))
      2.700     0.900     0.900 peak    86 spectrum    1 weight  0.10000E+01 volume  0.37741E-02 ppm1      7.801 ppm2      0.815 CV     1
 OR {   86}
   (  segid "ATXH" and resid 53   and name HG1%)
   (( segid "ATXH" and resid 53   and name HN  ))
 ASSI {   87}
   (( segid "ATXH" and resid 48   and name HB  ))
   (( segid "ATXH" and resid 35   and name HN  ))
      2.500     0.800     0.800 peak    87 spectrum    1 weight  0.10000E+01 volume  0.37081E-02 ppm1      7.512 ppm2      3.882 CV     1
 ASSI {   89}
   (( segid "ATXH" and resid 58   and name HN  ))
   (( segid "ATXH" and resid 59   and name HN  ))
      2.500     0.800     0.800 peak    89 spectrum    1 weight  0.10000E+01 volume  0.36860E-02 ppm1      7.360 ppm2      7.583 CV     1
 ASSI {   91}
   (  segid "ATXH" and resid 30   and name HD2%)
   (( segid "ATXH" and resid 30   and name HN  ))
      2.600     0.900     0.900 peak    91 spectrum    1 weight  0.10000E+01 volume  0.36641E-02 ppm1      7.448 ppm2      0.852 CV     1
 OR {   91}
   (  segid "ATXH" and resid 30   and name HD1%)
   (( segid "ATXH" and resid 30   and name HN  ))
 ASSI {   92}
   (( segid "ATXH" and resid 66   and name HN  ))
   (( segid "ATXH" and resid 67   and name HN  ))
      2.500     0.800     0.800 peak    92 spectrum    1 weight  0.10000E+01 volume  0.36421E-02 ppm1      7.880 ppm2      7.508 CV     1
 ASSI {   93}
   (  segid "ATXH" and resid 38   and name HG1%)
   (( segid "ATXH" and resid 20   and name HN  ))
      2.900     2.900     3.100 peak    93 spectrum    1 weight  0.10000E+01 volume  0.36311E-02 ppm1      7.018 ppm2      0.993 CV     1
 ASSI {   94}
   (( segid "ATXH" and resid 10   and name HB3 ))
   (( segid "ATXH" and resid 10   and name HN  ))
      2.600     2.600     3.400 peak    94 spectrum    1 weight  0.10000E+01 volume  0.36201E-02 ppm1      9.034 ppm2      1.965 CV     1
 ASSI {   96}
   (( segid "ATXH" and resid 43   and name HN  ))
   (( segid "ATXH" and resid 42   and name HN  ))
      2.500     0.800     0.800 peak    96 spectrum    1 weight  0.10000E+01 volume  0.35870E-02 ppm1      7.561 ppm2      7.950 CV     1
 ASSI {   97}
   (  segid "ATXH" and resid 33   and name HG2%)
   (( segid "ATXH" and resid 35   and name HN  ))
      2.800     1.000     1.000 peak    97 spectrum    1 weight  0.10000E+01 volume  0.35760E-02 ppm1      7.513 ppm2      0.643 CV     1
 ASSI {   98}
   (( segid "ATXH" and resid 57   and name HB3 ))
   (( segid "ATXH" and resid 58   and name HN  ))
      2.600     0.800     0.800 peak    98 spectrum    1 weight  0.10000E+01 volume  0.35430E-02 ppm1      7.580 ppm2      1.741 CV     1
 OR {   98}
   (( segid "ATXH" and resid 57   and name HB2 ))
   (( segid "ATXH" and resid 58   and name HN  ))
 ASSI {   99}
   (( segid "ATXH" and resid 53   and name HB  ))
   (( segid "ATXH" and resid 53   and name HN  ))
      2.600     0.800     0.800 peak    99 spectrum    1 weight  0.10000E+01 volume  0.35320E-02 ppm1      7.801 ppm2      1.996 CV     1
 ASSI {  100}
   (( segid "ATXH" and resid 62   and name HA  ))
   (( segid "ATXH" and resid 62   and name HN  ))
      2.600     0.800     0.800 peak   100 spectrum    1 weight  0.10000E+01 volume  0.35210E-02 ppm1      7.187 ppm2      3.873 CV     1
 ASSI {  103}
   (( segid "ATXH" and resid 59   and name HG12))
   (( segid "ATXH" and resid 59   and name HN  ))
      2.500     0.800     0.800 peak   103 spectrum    1 weight  0.10000E+01 volume  0.34990E-02 ppm1      7.360 ppm2      1.561 CV     1
 ASSI {  104}
   (( segid "ATXH" and resid 56   and name HB2 ))
   (( segid "ATXH" and resid 56   and name HN  ))
      2.600     0.800     0.800 peak   104 spectrum    1 weight  0.10000E+01 volume  0.34880E-02 ppm1      8.796 ppm2      1.742 CV     1
 ASSI {  105}
   (( segid "ATXH" and resid 6    and name HB2 ))
   (( segid "ATXH" and resid 6    and name HN  ))
      2.500     0.800     0.800 peak   105 spectrum    1 weight  0.10000E+01 volume  0.34770E-02 ppm1      8.621 ppm2      1.993 CV     1
 OR {  105}
   (( segid "ATXH" and resid 6    and name HG3 ))
   (( segid "ATXH" and resid 6    and name HN  ))
 ASSI {  108}
   (( segid "ATXH" and resid 44   and name HB  ))
   (( segid "ATXH" and resid 45   and name HN  ))
      2.500     0.800     0.800 peak   108 spectrum    1 weight  0.10000E+01 volume  0.33780E-02 ppm1      8.975 ppm2      3.980 CV     1
 ASSI {  109}
   (  segid "ATXH" and resid 33   and name HG2%)
   (( segid "ATXH" and resid 34   and name HN  ))
      3.000     1.200     1.200 peak   109 spectrum    1 weight  0.10000E+01 volume  0.33670E-02 ppm1      8.787 ppm2      0.655 CV     1
 ASSI {  113}
   (( segid "ATXH" and resid 67   and name HN  ))
   (( segid "ATXH" and resid 68   and name HN  ))
      2.500     0.800     0.800 peak   113 spectrum    1 weight  0.10000E+01 volume  0.33450E-02 ppm1      6.775 ppm2      7.889 CV     1
 ASSI {  114}
   (( segid "ATXH" and resid 20   and name HB  ))
   (( segid "ATXH" and resid 20   and name HN  ))
      2.600     0.800     0.800 peak   114 spectrum    1 weight  0.10000E+01 volume  0.33340E-02 ppm1      7.018 ppm2      2.242 CV     1
 ASSI {  115}
   (( segid "ATXH" and resid 11   and name HA  ))
   (( segid "ATXH" and resid 12   and name HN  ))
      2.600     0.800     0.800 peak   115 spectrum    1 weight  0.10000E+01 volume  0.33230E-02 ppm1      9.284 ppm2      4.766 CV     1
 ASSI {  116}
   (( segid "ATXH" and resid 60   and name HN  ))
   (( segid "ATXH" and resid 59   and name HN  ))
      2.500     0.800     0.800 peak   116 spectrum    1 weight  0.10000E+01 volume  0.33230E-02 ppm1      7.360 ppm2      8.537 CV     1
 ASSI {  119}
   (( segid "ATXH" and resid 30   and name HN  ))
   (( segid "ATXH" and resid 29   and name HN  ))
      2.600     0.800     0.800 peak   119 spectrum    1 weight  0.10000E+01 volume  0.32350E-02 ppm1      6.874 ppm2      7.457 CV     1
 ASSI {  121}
   (( segid "ATXH" and resid 42   and name HB3 ))
   (( segid "ATXH" and resid 42   and name HN  ))
      2.900     1.000     1.000 peak   121 spectrum    1 weight  0.10000E+01 volume  0.32130E-02 ppm1      7.560 ppm2      1.907 CV     1
 ASSI {  123}
   (( segid "ATXH" and resid 7    and name HB2 ))
   (( segid "ATXH" and resid 7    and name HN  ))
      2.500     0.800     0.800 peak   123 spectrum    1 weight  0.10000E+01 volume  0.31469E-02 ppm1      9.266 ppm2      1.573 CV     1
 ASSI {  124}
   (( segid "ATXH" and resid 64   and name HG2 ))
   (( segid "ATXH" and resid 64   and name HN  ))
      3.000     1.100     1.100 peak   124 spectrum    1 weight  0.10000E+01 volume  0.31249E-02 ppm1      9.007 ppm2      2.704 CV     1
 ASSI {  125}
   (( segid "ATXH" and resid 31   and name HA  ))
   (( segid "ATXH" and resid 31   and name HN  ))
      2.600     0.900     0.900 peak   125 spectrum    1 weight  0.10000E+01 volume  0.30919E-02 ppm1      8.606 ppm2      4.436 CV     1
 ASSI {  126}
   (( segid "ATXH" and resid 62   and name HN  ))
   (( segid "ATXH" and resid 61   and name HN  ))
      2.600     0.800     0.800 peak   126 spectrum    1 weight  0.10000E+01 volume  0.30919E-02 ppm1      7.708 ppm2      7.187 CV     1
 ASSI {  127}
   (  segid "ATXH" and resid 62   and name HG2%)
   (( segid "ATXH" and resid 62   and name HN  ))
      2.600     0.900     0.900 peak   127 spectrum    1 weight  0.10000E+01 volume  0.30699E-02 ppm1      7.187 ppm2      0.887 CV     1
 ASSI {  128}
   (( segid "ATXH" and resid 25   and name HB2 ))
   (( segid "ATXH" and resid 25   and name HN  ))
      2.700     0.900     0.900 peak   128 spectrum    1 weight  0.10000E+01 volume  0.30589E-02 ppm1      8.210 ppm2      3.930 CV     1
 ASSI {  129}
   (( segid "ATXH" and resid 50   and name HB3 ))
   (( segid "ATXH" and resid 50   and name HN  ))
      2.600     0.900     0.900 peak   129 spectrum    1 weight  0.10000E+01 volume  0.30369E-02 ppm1      8.529 ppm2      2.473 CV     1
 ASSI {  131}
   (( segid "ATXH" and resid 27   and name HN  ))
   (( segid "ATXH" and resid 28   and name HN  ))
      2.600     0.800     0.800 peak   131 spectrum    1 weight  0.10000E+01 volume  0.30369E-02 ppm1      7.697 ppm2      8.179 CV     1
 ASSI {  132}
   (  segid "ATXH" and resid 70   and name HG2%)
   (( segid "ATXH" and resid 71   and name HN  ))
      2.800     1.000     1.000 peak   132 spectrum    1 weight  0.10000E+01 volume  0.30259E-02 ppm1      8.788 ppm2      0.965 CV     1
 OR {  132}
   (  segid "ATXH" and resid 70   and name HG1%)
   (( segid "ATXH" and resid 71   and name HN  ))
 ASSI {  133}
   (( segid "ATXH" and resid 23   and name HB  ))
   (( segid "ATXH" and resid 24   and name HN  ))
      2.800     1.000     1.000 peak   133 spectrum    1 weight  0.10000E+01 volume  0.30039E-02 ppm1      8.600 ppm2      1.641 CV     1
 OR {  133}
   (( segid "ATXH" and resid 23   and name HG12))
   (( segid "ATXH" and resid 24   and name HN  ))
 ASSI {  135}
   (( segid "ATXH" and resid 43   and name HA2 ))
   (( segid "ATXH" and resid 43   and name HN  ))
      2.800     1.000     1.000 peak   135 spectrum    1 weight  0.10000E+01 volume  0.29929E-02 ppm1      7.943 ppm2      4.055 CV     1
 ASSI {  138}
   (( segid "ATXH" and resid 40   and name HB2 ))
   (( segid "ATXH" and resid 40   and name HN  ))
      2.600     0.800     0.800 peak   138 spectrum    1 weight  0.10000E+01 volume  0.29599E-02 ppm1      8.606 ppm2      1.572 CV     1
 ASSI {  139}
   (( segid "ATXH" and resid 10   and name HB2 ))
   (( segid "ATXH" and resid 10   and name HN  ))
      2.800     1.000     1.000 peak   139 spectrum    1 weight  0.10000E+01 volume  0.29379E-02 ppm1      9.034 ppm2      2.092 CV     1
 ASSI {  140}
   (  segid "ATXH" and resid 41   and name HB% )
   (( segid "ATXH" and resid 42   and name HN  ))
      2.700     0.900     0.900 peak   140 spectrum    1 weight  0.10000E+01 volume  0.29268E-02 ppm1      7.560 ppm2      1.374 CV     1
 ASSI {  141}
   (( segid "ATXH" and resid 34   and name HB3 ))
   (( segid "ATXH" and resid 34   and name HN  ))
      2.600     0.800     0.800 peak   141 spectrum    1 weight  0.10000E+01 volume  0.29268E-02 ppm1      8.787 ppm2      1.678 CV     1
 ASSI {  142}
   (( segid "ATXH" and resid 42   and name HB2 ))
   (( segid "ATXH" and resid 42   and name HN  ))
      2.600     0.800     0.800 peak   142 spectrum    1 weight  0.10000E+01 volume  0.28828E-02 ppm1      7.561 ppm2      2.085 CV     1
 ASSI {  144}
   (( segid "ATXH" and resid 58   and name HB2 ))
   (( segid "ATXH" and resid 59   and name HN  ))
      2.600     0.800     0.800 peak   144 spectrum    1 weight  0.10000E+01 volume  0.28718E-02 ppm1      7.361 ppm2      3.009 CV     1
 ASSI {  146}
   (( segid "ATXH" and resid 38   and name HB  ))
   (( segid "ATXH" and resid 38   and name HN  ))
      2.600     0.900     0.900 peak   146 spectrum    1 weight  0.10000E+01 volume  0.28608E-02 ppm1      9.833 ppm2      2.082 CV     1
 ASSI {  147}
   (( segid "ATXH" and resid 69   and name HB3 ))
   (( segid "ATXH" and resid 69   and name HN  ))
      2.900     1.000     1.000 peak   147 spectrum    1 weight  0.10000E+01 volume  0.28498E-02 ppm1      7.901 ppm2      2.443 CV     1
 ASSI {  148}
   (( segid "ATXH" and resid 46   and name HA  ))
   (( segid "ATXH" and resid 46   and name HN  ))
      2.600     0.900     0.900 peak   148 spectrum    1 weight  0.10000E+01 volume  0.28168E-02 ppm1      9.023 ppm2      5.249 CV     1
 ASSI {  149}
   (( segid "ATXH" and resid 59   and name HG13))
   (( segid "ATXH" and resid 59   and name HN  ))
      2.900     1.000     1.000 peak   149 spectrum    1 weight  0.10000E+01 volume  0.27838E-02 ppm1      7.359 ppm2      1.050 CV     1
 ASSI {  150}
   (( segid "ATXH" and resid 43   and name HN  ))
   (( segid "ATXH" and resid 44   and name HN  ))
      2.600     0.900     0.900 peak   150 spectrum    1 weight  0.10000E+01 volume  0.27508E-02 ppm1      7.596 ppm2      7.941 CV     1
 ASSI {  151}
   (( segid "ATXH" and resid 20   and name HB  ))
   (( segid "ATXH" and resid 21   and name HN  ))
      2.700     0.900     0.900 peak   151 spectrum    1 weight  0.10000E+01 volume  0.27288E-02 ppm1      7.836 ppm2      2.241 CV     1
 ASSI {  152}
   (( segid "ATXH" and resid 40   and name HB3 ))
   (( segid "ATXH" and resid 40   and name HN  ))
      2.800     0.900     0.900 peak   152 spectrum    1 weight  0.10000E+01 volume  0.27288E-02 ppm1      8.609 ppm2      1.418 CV     1
 ASSI {  153}
   (( segid "ATXH" and resid 59   and name HA  ))
   (( segid "ATXH" and resid 59   and name HN  ))
      2.700     0.900     0.900 peak   153 spectrum    1 weight  0.10000E+01 volume  0.27288E-02 ppm1      7.360 ppm2      3.489 CV     1
 ASSI {  154}
   (( segid "ATXH" and resid 24   and name HB3 ))
   (( segid "ATXH" and resid 24   and name HN  ))
      2.600     0.800     0.800 peak   154 spectrum    1 weight  0.10000E+01 volume  0.27288E-02 ppm1      8.599 ppm2      1.915 CV     1
 ASSI {  155}
   (( segid "ATXH" and resid 53   and name HB  ))
   (( segid "ATXH" and resid 54   and name HN  ))
      2.500     0.800     0.800 peak   155 spectrum    1 weight  0.10000E+01 volume  0.26407E-02 ppm1      8.022 ppm2      2.003 CV     1
 ASSI {  156}
   (( segid "ATXH" and resid 34   and name HB2 ))
   (( segid "ATXH" and resid 34   and name HN  ))
      2.700     0.900     0.900 peak   156 spectrum    1 weight  0.10000E+01 volume  0.26298E-02 ppm1      8.787 ppm2      1.869 CV     1
 ASSI {  157}
   (( segid "ATXH" and resid 10   and name HG2 ))
   (( segid "ATXH" and resid 10   and name HN  ))
      2.700     0.900     0.900 peak   157 spectrum    1 weight  0.10000E+01 volume  0.26188E-02 ppm1      9.033 ppm2      2.285 CV     1
 OR {  157}
   (( segid "ATXH" and resid 10   and name HG3 ))
   (( segid "ATXH" and resid 10   and name HN  ))
 ASSI {  158}
   (( segid "ATXH" and resid 60   and name HN  ))
   (( segid "ATXH" and resid 61   and name HN  ))
      2.700     0.900     0.900 peak   158 spectrum    1 weight  0.10000E+01 volume  0.26078E-02 ppm1      7.710 ppm2      8.536 CV     1
 ASSI {  159}
   (( segid "ATXH" and resid 14   and name HG3 ))
   (( segid "ATXH" and resid 14   and name HN  ))
      2.700     0.900     0.900 peak   159 spectrum    1 weight  0.10000E+01 volume  0.26078E-02 ppm1      8.890 ppm2      2.055 CV     1
 OR {  159}
   (( segid "ATXH" and resid 14   and name HG2 ))
   (( segid "ATXH" and resid 14   and name HN  ))
 ASSI {  160}
   (( segid "ATXH" and resid 6    and name HA  ))
   (( segid "ATXH" and resid 6    and name HN  ))
      2.700     0.900     0.900 peak   160 spectrum    1 weight  0.10000E+01 volume  0.25968E-02 ppm1      8.620 ppm2      5.191 CV     1
 ASSI {  163}
   (( segid "ATXH" and resid 70   and name HB  ))
   (( segid "ATXH" and resid 70   and name HN  ))
      2.800     1.000     1.000 peak   163 spectrum    1 weight  0.10000E+01 volume  0.25858E-02 ppm1      9.465 ppm2      2.089 CV     1
 ASSI {  164}
   (( segid "ATXH" and resid 64   and name HN  ))
   (( segid "ATXH" and resid 65   and name HN  ))
      2.700     0.900     0.900 peak   164 spectrum    1 weight  0.10000E+01 volume  0.25638E-02 ppm1      8.427 ppm2      9.011 CV     1
 ASSI {  165}
   (( segid "ATXH" and resid 32   and name HA2 ))
   (( segid "ATXH" and resid 32   and name HN  ))
      2.900     1.000     1.000 peak   165 spectrum    1 weight  0.10000E+01 volume  0.25638E-02 ppm1      8.561 ppm2      4.227 CV     1
 ASSI {  166}
   (( segid "ATXH" and resid 52   and name HA  ))
   (( segid "ATXH" and resid 52   and name HN  ))
      2.800     0.900     0.900 peak   166 spectrum    1 weight  0.10000E+01 volume  0.25528E-02 ppm1      8.773 ppm2      4.467 CV     1
 ASSI {  168}
   (( segid "ATXH" and resid 25   and name HA  ))
   (( segid "ATXH" and resid 25   and name HN  ))
      2.700     0.900     0.900 peak   168 spectrum    1 weight  0.10000E+01 volume  0.25307E-02 ppm1      8.210 ppm2      4.054 CV     1
 ASSI {  169}
   (( segid "ATXH" and resid 53   and name HA  ))
   (( segid "ATXH" and resid 53   and name HN  ))
      2.700     0.900     0.900 peak   169 spectrum    1 weight  0.10000E+01 volume  0.25307E-02 ppm1      7.801 ppm2      4.173 CV     1
 ASSI {  170}
   (( segid "ATXH" and resid 30   and name HA  ))
   (( segid "ATXH" and resid 30   and name HN  ))
      2.700     0.900     0.900 peak   170 spectrum    1 weight  0.10000E+01 volume  0.24977E-02 ppm1      7.448 ppm2      4.187 CV     1
 ASSI {  172}
   (( segid "ATXH" and resid 9    and name HN  ))
   (( segid "ATXH" and resid 45   and name HN  ))
      2.700     0.900     0.900 peak   172 spectrum    1 weight  0.10000E+01 volume  0.24207E-02 ppm1      8.973 ppm2      9.278 CV     1
 ASSI {  173}
   (  segid "ATXH" and resid 33   and name HG2%)
   (( segid "ATXH" and resid 33   and name HN  ))
      2.800     0.900     0.900 peak   173 spectrum    1 weight  0.10000E+01 volume  0.24097E-02 ppm1      7.522 ppm2      0.679 CV     1
 ASSI {  174}
   (( segid "ATXH" and resid 34   and name HB3 ))
   (( segid "ATXH" and resid 35   and name HN  ))
      2.600     0.800     0.800 peak   174 spectrum    1 weight  0.10000E+01 volume  0.24097E-02 ppm1      7.513 ppm2      1.679 CV     1
 ASSI {  175}
   (( segid "ATXH" and resid 48   and name HA  ))
   (( segid "ATXH" and resid 48   and name HN  ))
      2.700     0.900     0.900 peak   175 spectrum    1 weight  0.10000E+01 volume  0.23987E-02 ppm1      8.716 ppm2      5.234 CV     1
 ASSI {  177}
   (( segid "ATXH" and resid 39   and name HA  ))
   (( segid "ATXH" and resid 40   and name HN  ))
      2.700     0.900     0.900 peak   177 spectrum    1 weight  0.10000E+01 volume  0.23877E-02 ppm1      8.608 ppm2      4.725 CV     1
 ASSI {  178}
   (( segid "ATXH" and resid 27   and name HB  ))
   (( segid "ATXH" and resid 28   and name HN  ))
      2.700     0.900     0.900 peak   178 spectrum    1 weight  0.10000E+01 volume  0.23877E-02 ppm1      7.699 ppm2      2.064 CV     1
 ASSI {  179}
   (( segid "ATXH" and resid 58   and name HA  ))
   (( segid "ATXH" and resid 58   and name HN  ))
      2.800     1.000     1.000 peak   179 spectrum    1 weight  0.10000E+01 volume  0.23767E-02 ppm1      7.582 ppm2      4.367 CV     1
 ASSI {  180}
   (( segid "ATXH" and resid 39   and name HB2 ))
   (( segid "ATXH" and resid 39   and name HN  ))
      2.600     0.800     0.800 peak   180 spectrum    1 weight  0.10000E+01 volume  0.23767E-02 ppm1      8.892 ppm2      2.330 CV     1
 ASSI {  182}
   (( segid "ATXH" and resid 12   and name HB3 ))
   (( segid "ATXH" and resid 12   and name HN  ))
      2.900     1.100     1.100 peak   182 spectrum    1 weight  0.10000E+01 volume  0.23547E-02 ppm1      9.284 ppm2      1.972 CV     1
 ASSI {  185}
   (( segid "ATXH" and resid 45   and name HB  ))
   (( segid "ATXH" and resid 45   and name HN  ))
      2.700     0.900     0.900 peak   185 spectrum    1 weight  0.10000E+01 volume  0.23437E-02 ppm1      8.974 ppm2      1.732 CV     1
 ASSI {  186}
   (( segid "ATXH" and resid 67   and name HA2 ))
   (( segid "ATXH" and resid 67   and name HN  ))
      2.900     1.100     1.100 peak   186 spectrum    1 weight  0.10000E+01 volume  0.23327E-02 ppm1      7.881 ppm2      3.957 CV     1
 ASSI {  187}
   (( segid "ATXH" and resid 30   and name HB3 ))
   (( segid "ATXH" and resid 30   and name HN  ))
      3.300     1.400     1.400 peak   187 spectrum    1 weight  0.10000E+01 volume  0.23217E-02 ppm1      7.447 ppm2      1.309 CV     1
 ASSI {  188}
   (( segid "ATXH" and resid 26   and name HA  ))
   (( segid "ATXH" and resid 26   and name HN  ))
      2.800     1.000     1.000 peak   188 spectrum    1 weight  0.10000E+01 volume  0.23107E-02 ppm1      7.528 ppm2      4.137 CV     1
 ASSI {  191}
   (( segid "ATXH" and resid 42   and name HB3 ))
   (( segid "ATXH" and resid 44   and name HN  ))
      2.800     1.000     1.000 peak   191 spectrum    1 weight  0.10000E+01 volume  0.22997E-02 ppm1      7.594 ppm2      1.893 CV     1
 ASSI {  193}
   (  segid "ATXH" and resid 48   and name HG2%)
   (( segid "ATXH" and resid 49   and name HN  ))
      2.900     1.000     1.000 peak   193 spectrum    1 weight  0.10000E+01 volume  0.22777E-02 ppm1      9.252 ppm2      1.104 CV     1
 ASSI {  194}
   (( segid "ATXH" and resid 49   and name HA  ))
   (( segid "ATXH" and resid 34   and name HN  ))
      2.700     0.900     0.900 peak   194 spectrum    1 weight  0.10000E+01 volume  0.22556E-02 ppm1      8.788 ppm2      5.302 CV     1
 ASSI {  195}
   (( segid "ATXH" and resid 63   and name HN  ))
   (( segid "ATXH" and resid 64   and name HN  ))
      2.700     0.900     0.900 peak   195 spectrum    1 weight  0.10000E+01 volume  0.22556E-02 ppm1      9.006 ppm2      7.636 CV     1
 ASSI {  196}
   (( segid "ATXH" and resid 48   and name HB  ))
   (( segid "ATXH" and resid 48   and name HN  ))
      2.700     0.900     0.900 peak   196 spectrum    1 weight  0.10000E+01 volume  0.22446E-02 ppm1      8.715 ppm2      3.879 CV     1
 ASSI {  199}
   (( segid "ATXH" and resid 68   and name HB2 ))
   (( segid "ATXH" and resid 69   and name HN  ))
      3.300     1.400     1.400 peak   199 spectrum    1 weight  0.10000E+01 volume  0.22116E-02 ppm1      7.900 ppm2      3.007 CV     1
 ASSI {  200}
   (( segid "ATXH" and resid 9    and name HB2 ))
   (( segid "ATXH" and resid 9    and name HN  ))
      2.800     1.000     1.000 peak   200 spectrum    1 weight  0.10000E+01 volume  0.22116E-02 ppm1      9.294 ppm2      1.559 CV     1
 ASSI {  201}
   (( segid "ATXH" and resid 28   and name HN  ))
   (( segid "ATXH" and resid 29   and name HN  ))
      2.800     1.000     1.000 peak   201 spectrum    1 weight  0.10000E+01 volume  0.21787E-02 ppm1      6.874 ppm2      7.700 CV     1
 ASSI {  202}
   (( segid "ATXH" and resid 25   and name HB3 ))
   (( segid "ATXH" and resid 28   and name HN  ))
      3.200     3.200     2.800 peak   202 spectrum    1 weight  0.10000E+01 volume  0.21566E-02 ppm1      7.699 ppm2      3.823 CV     1
 ASSI {  206}
   (( segid "ATXH" and resid 4    and name HB3 ))
   (( segid "ATXH" and resid 4    and name HN  ))
      3.100     1.200     1.200 peak   206 spectrum    1 weight  0.10000E+01 volume  0.21236E-02 ppm1      8.151 ppm2      1.802 CV     1
 ASSI {  207}
   (  segid "ATXH" and resid 47   and name HG2%)
   (( segid "ATXH" and resid 47   and name HN  ))
      2.800     1.000     1.000 peak   207 spectrum    1 weight  0.10000E+01 volume  0.21126E-02 ppm1      9.162 ppm2      0.809 CV     1
 ASSI {  208}
   (  segid "ATXH" and resid 70   and name HG1%)
   (( segid "ATXH" and resid 70   and name HN  ))
      2.800     1.000     1.000 peak   208 spectrum    1 weight  0.10000E+01 volume  0.21016E-02 ppm1      9.465 ppm2      0.981 CV     1
 OR {  208}
   (  segid "ATXH" and resid 70   and name HG2%)
   (( segid "ATXH" and resid 70   and name HN  ))
 ASSI {  210}
   (( segid "ATXH" and resid 34   and name HA  ))
   (( segid "ATXH" and resid 34   and name HN  ))
      2.800     1.000     1.000 peak   210 spectrum    1 weight  0.10000E+01 volume  0.20576E-02 ppm1      8.789 ppm2      4.378 CV     1
 ASSI {  212}
   (( segid "ATXH" and resid 14   and name HN  ))
   (( segid "ATXH" and resid 13   and name HN  ))
      2.800     1.000     1.000 peak   212 spectrum    1 weight  0.10000E+01 volume  0.20466E-02 ppm1      8.569 ppm2      8.891 CV     1
 ASSI {  215}
   (( segid "ATXH" and resid 60   and name HA  ))
   (( segid "ATXH" and resid 60   and name HN  ))
      2.800     1.000     1.000 peak   215 spectrum    1 weight  0.10000E+01 volume  0.20026E-02 ppm1      8.537 ppm2      3.254 CV     1
 ASSI {  216}
   (( segid "ATXH" and resid 24   and name HB2 ))
   (( segid "ATXH" and resid 24   and name HN  ))
      2.800     1.000     1.000 peak   216 spectrum    1 weight  0.10000E+01 volume  0.19696E-02 ppm1      8.600 ppm2      2.095 CV     1
 ASSI {  217}
   (( segid "ATXH" and resid 65   and name HB3 ))
   (( segid "ATXH" and resid 65   and name HN  ))
      2.900     1.000     1.000 peak   217 spectrum    1 weight  0.10000E+01 volume  0.19586E-02 ppm1      8.427 ppm2      2.678 CV     1
 ASSI {  218}
   (( segid "ATXH" and resid 26   and name HB3 ))
   (( segid "ATXH" and resid 26   and name HN  ))
      2.800     1.000     1.000 peak   218 spectrum    1 weight  0.10000E+01 volume  0.19476E-02 ppm1      7.528 ppm2      3.679 CV     1
 ASSI {  219}
   (( segid "ATXH" and resid 55   and name HB  ))
   (( segid "ATXH" and resid 57   and name HN  ))
      2.800     1.000     1.000 peak   219 spectrum    1 weight  0.10000E+01 volume  0.19476E-02 ppm1      8.105 ppm2      4.420 CV     1
 ASSI {  220}
   (( segid "ATXH" and resid 62   and name HN  ))
   (( segid "ATXH" and resid 63   and name HN  ))
      2.800     1.000     1.000 peak   220 spectrum    1 weight  0.10000E+01 volume  0.19256E-02 ppm1      7.635 ppm2      7.189 CV     1
 ASSI {  221}
   (  segid "ATXH" and resid 33   and name HG1%)
   (( segid "ATXH" and resid 34   and name HN  ))
      2.800     1.000     1.000 peak   221 spectrum    1 weight  0.10000E+01 volume  0.19256E-02 ppm1      8.788 ppm2      0.819 CV     1
 ASSI {  222}
   (( segid "ATXH" and resid 44   and name HA  ))
   (( segid "ATXH" and resid 44   and name HN  ))
      2.800     1.000     1.000 peak   222 spectrum    1 weight  0.10000E+01 volume  0.19256E-02 ppm1      7.597 ppm2      5.498 CV     1
 ASSI {  223}
   (  segid "ATXH" and resid 44   and name HG2%)
   (( segid "ATXH" and resid 44   and name HN  ))
      2.900     1.000     1.000 peak   223 spectrum    1 weight  0.10000E+01 volume  0.19146E-02 ppm1      7.599 ppm2      0.941 CV     1
 ASSI {  224}
   (( segid "ATXH" and resid 22   and name HN  ))
   (( segid "ATXH" and resid 21   and name HN  ))
      2.800     1.000     1.000 peak   224 spectrum    1 weight  0.10000E+01 volume  0.19036E-02 ppm1      7.835 ppm2      8.534 CV     1
 ASSI {  225}
   (  segid "ATXH" and resid 11   and name HG2%)
   (( segid "ATXH" and resid 11   and name HN  ))
      2.900     1.000     1.000 peak   225 spectrum    1 weight  0.10000E+01 volume  0.19036E-02 ppm1      8.526 ppm2      0.748 CV     1
 ASSI {  226}
   (( segid "ATXH" and resid 65   and name HN  ))
   (( segid "ATXH" and resid 66   and name HN  ))
      2.800     1.000     1.000 peak   226 spectrum    1 weight  0.10000E+01 volume  0.19036E-02 ppm1      7.508 ppm2      8.431 CV     1
 ASSI {  227}
   (( segid "ATXH" and resid 23   and name HN  ))
   (( segid "ATXH" and resid 22   and name HN  ))
      2.800     1.000     1.000 peak   227 spectrum    1 weight  0.10000E+01 volume  0.18926E-02 ppm1      8.535 ppm2      8.272 CV     1
 ASSI {  228}
   (( segid "ATXH" and resid 49   and name HG13))
   (( segid "ATXH" and resid 49   and name HN  ))
      2.800     1.000     1.000 peak   228 spectrum    1 weight  0.10000E+01 volume  0.18705E-02 ppm1      9.252 ppm2      1.422 CV     1
 ASSI {  229}
   (( segid "ATXH" and resid 21   and name HA  ))
   (( segid "ATXH" and resid 21   and name HN  ))
      2.900     1.000     1.000 peak   229 spectrum    1 weight  0.10000E+01 volume  0.18705E-02 ppm1      7.836 ppm2      4.458 CV     1
 ASSI {  230}
   (( segid "ATXH" and resid 42   and name HA  ))
   (( segid "ATXH" and resid 42   and name HN  ))
      2.900     1.000     1.000 peak   230 spectrum    1 weight  0.10000E+01 volume  0.18595E-02 ppm1      7.560 ppm2      4.222 CV     1
 ASSI {  231}
   (( segid "ATXH" and resid 63   and name HG13))
   (( segid "ATXH" and resid 63   and name HN  ))
      2.700     0.900     0.900 peak   231 spectrum    1 weight  0.10000E+01 volume  0.18595E-02 ppm1      7.637 ppm2      0.570 CV     1
 ASSI {  235}
   (( segid "ATXH" and resid 11   and name HB  ))
   (( segid "ATXH" and resid 11   and name HN  ))
      2.800     1.000     1.000 peak   235 spectrum    1 weight  0.10000E+01 volume  0.18265E-02 ppm1      8.525 ppm2      1.639 CV     1
 ASSI {  236}
   (( segid "ATXH" and resid 62   and name HB  ))
   (( segid "ATXH" and resid 63   and name HN  ))
      2.800     1.000     1.000 peak   236 spectrum    1 weight  0.10000E+01 volume  0.18265E-02 ppm1      7.636 ppm2      2.188 CV     1
 ASSI {  237}
   (( segid "ATXH" and resid 65   and name HA  ))
   (( segid "ATXH" and resid 65   and name HN  ))
      2.900     1.100     1.100 peak   237 spectrum    1 weight  0.10000E+01 volume  0.18045E-02 ppm1      8.427 ppm2      4.509 CV     1
 ASSI {  238}
   (  segid "ATXH" and resid 38   and name HG1%)
   (( segid "ATXH" and resid 38   and name HN  ))
      2.900     1.100     1.100 peak   238 spectrum    1 weight  0.10000E+01 volume  0.17935E-02 ppm1      9.834 ppm2      1.013 CV     1
 ASSI {  239}
   (  segid "ATXH" and resid 47   and name HG1%)
   (( segid "ATXH" and resid 48   and name HN  ))
      2.900     1.000     1.000 peak   239 spectrum    1 weight  0.10000E+01 volume  0.17495E-02 ppm1      8.715 ppm2      0.877 CV     1
 ASSI {  240}
   (( segid "ATXH" and resid 24   and name HN  ))
   (( segid "ATXH" and resid 25   and name HN  ))
      2.900     1.000     1.000 peak   240 spectrum    1 weight  0.10000E+01 volume  0.17385E-02 ppm1      8.211 ppm2      8.601 CV     1
 ASSI {  241}
   (( segid "ATXH" and resid 9    and name HB3 ))
   (( segid "ATXH" and resid 10   and name HN  ))
      3.200     1.300     1.300 peak   241 spectrum    1 weight  0.10000E+01 volume  0.17275E-02 ppm1      9.033 ppm2      1.280 CV     1
 ASSI {  242}
   (( segid "ATXH" and resid 14   and name HB2 ))
   (( segid "ATXH" and resid 14   and name HN  ))
      2.800     1.000     1.000 peak   242 spectrum    1 weight  0.10000E+01 volume  0.17275E-02 ppm1      8.889 ppm2      2.318 CV     1
 ASSI {  243}
   (( segid "ATXH" and resid 69   and name HB2 ))
   (( segid "ATXH" and resid 69   and name HN  ))
      2.900     1.000     1.000 peak   243 spectrum    1 weight  0.10000E+01 volume  0.17165E-02 ppm1      7.900 ppm2      2.588 CV     1
 ASSI {  244}
   (( segid "ATXH" and resid 13   and name HA1 ))
   (( segid "ATXH" and resid 13   and name HN  ))
      2.800     1.000     1.000 peak   244 spectrum    1 weight  0.10000E+01 volume  0.17165E-02 ppm1      8.568 ppm2      3.745 CV     1
 ASSI {  246}
   (( segid "ATXH" and resid 68   and name HB3 ))
   (( segid "ATXH" and resid 69   and name HN  ))
      2.800     1.000     1.000 peak   246 spectrum    1 weight  0.10000E+01 volume  0.16945E-02 ppm1      7.899 ppm2      2.268 CV     1
 ASSI {  247}
   (( segid "ATXH" and resid 56   and name HN  ))
   (( segid "ATXH" and resid 57   and name HN  ))
      2.800     1.000     1.000 peak   247 spectrum    1 weight  0.10000E+01 volume  0.16945E-02 ppm1      8.105 ppm2      8.796 CV     1
 ASSI {  249}
   (( segid "ATXH" and resid 26   and name HN  ))
   (( segid "ATXH" and resid 27   and name HN  ))
      2.900     1.000     1.000 peak   249 spectrum    1 weight  0.10000E+01 volume  0.16725E-02 ppm1      8.177 ppm2      7.528 CV     1
 ASSI {  250}
   (( segid "ATXH" and resid 63   and name HA  ))
   (( segid "ATXH" and resid 63   and name HN  ))
      2.900     1.100     1.100 peak   250 spectrum    1 weight  0.10000E+01 volume  0.16615E-02 ppm1      7.636 ppm2      3.467 CV     1
 ASSI {  252}
   (( segid "ATXH" and resid 50   and name HA  ))
   (( segid "ATXH" and resid 50   and name HN  ))
      2.900     1.000     1.000 peak   252 spectrum    1 weight  0.10000E+01 volume  0.16505E-02 ppm1      8.531 ppm2      5.033 CV     1
 ASSI {  253}
   (( segid "ATXH" and resid 33   and name HA  ))
   (( segid "ATXH" and resid 33   and name HN  ))
      2.900     1.000     1.000 peak   253 spectrum    1 weight  0.10000E+01 volume  0.16395E-02 ppm1      7.524 ppm2      4.070 CV     1
 ASSI {  257}
   (( segid "ATXH" and resid 66   and name HA  ))
   (( segid "ATXH" and resid 66   and name HN  ))
      2.900     1.100     1.100 peak   257 spectrum    1 weight  0.10000E+01 volume  0.16285E-02 ppm1      7.508 ppm2      4.284 CV     1
 ASSI {  258}
   (( segid "ATXH" and resid 54   and name HA  ))
   (( segid "ATXH" and resid 54   and name HN  ))
      2.800     1.000     1.000 peak   258 spectrum    1 weight  0.10000E+01 volume  0.16285E-02 ppm1      8.014 ppm2      4.650 CV     1
 ASSI {  259}
   (( segid "ATXH" and resid 39   and name HB2 ))
   (( segid "ATXH" and resid 44   and name HN  ))
      2.800     1.000     1.000 peak   259 spectrum    1 weight  0.10000E+01 volume  0.15954E-02 ppm1      7.597 ppm2      2.327 CV     1
 ASSI {  260}
   (( segid "ATXH" and resid 24   and name HB2 ))
   (( segid "ATXH" and resid 25   and name HN  ))
      3.600     1.600     1.600 peak   260 spectrum    1 weight  0.10000E+01 volume  0.15735E-02 ppm1      8.211 ppm2      2.096 CV     1
 ASSI {  262}
   (( segid "ATXH" and resid 5    and name HA  ))
   (( segid "ATXH" and resid 5    and name HN  ))
      2.900     1.100     1.100 peak   262 spectrum    1 weight  0.10000E+01 volume  0.15515E-02 ppm1      9.158 ppm2      4.623 CV     1
 ASSI {  263}
   (( segid "ATXH" and resid 7    and name HN  ))
   (( segid "ATXH" and resid 6    and name HN  ))
      3.200     1.200     1.200 peak   263 spectrum    1 weight  0.10000E+01 volume  0.15515E-02 ppm1      8.618 ppm2      9.254 CV     1
 ASSI {  264}
   (( segid "ATXH" and resid 4    and name HA  ))
   (( segid "ATXH" and resid 4    and name HN  ))
      2.900     1.100     1.100 peak   264 spectrum    1 weight  0.10000E+01 volume  0.15405E-02 ppm1      8.151 ppm2      5.165 CV     1
 ASSI {  265}
   (( segid "ATXH" and resid 35   and name HB2 ))
   (( segid "ATXH" and resid 36   and name HN  ))
      3.200     1.300     1.300 peak   265 spectrum    1 weight  0.10000E+01 volume  0.15405E-02 ppm1      8.668 ppm2      2.257 CV     1
 OR {  265}
   (( segid "ATXH" and resid 35   and name HG2 ))
   (( segid "ATXH" and resid 36   and name HN  ))
 ASSI {  266}
   (( segid "ATXH" and resid 46   and name HG3 ))
   (( segid "ATXH" and resid 47   and name HN  ))
      3.400     1.400     1.400 peak   266 spectrum    1 weight  0.10000E+01 volume  0.15295E-02 ppm1      9.166 ppm2      2.145 CV     1
 OR {  266}
   (( segid "ATXH" and resid 46   and name HG2 ))
   (( segid "ATXH" and resid 47   and name HN  ))
 ASSI {  268}
   (( segid "ATXH" and resid 57   and name HG2 ))
   (( segid "ATXH" and resid 58   and name HN  ))
      3.400     1.500     1.500 peak   268 spectrum    1 weight  0.10000E+01 volume  0.14964E-02 ppm1      7.581 ppm2      1.432 CV     1
 OR {  268}
   (( segid "ATXH" and resid 57   and name HG3 ))
   (( segid "ATXH" and resid 58   and name HN  ))
 ASSI {  270}
   (( segid "ATXH" and resid 12   and name HA  ))
   (( segid "ATXH" and resid 12   and name HN  ))
      3.000     1.100     1.100 peak   270 spectrum    1 weight  0.10000E+01 volume  0.14634E-02 ppm1      9.283 ppm2      4.636 CV     1
 ASSI {  271}
   (( segid "ATXH" and resid 12   and name HB2 ))
   (( segid "ATXH" and resid 12   and name HN  ))
      2.900     1.100     1.100 peak   271 spectrum    1 weight  0.10000E+01 volume  0.14524E-02 ppm1      9.283 ppm2      2.152 CV     1
 ASSI {  272}
   (( segid "ATXH" and resid 52   and name HB3 ))
   (( segid "ATXH" and resid 52   and name HN  ))
      3.100     1.200     1.200 peak   272 spectrum    1 weight  0.10000E+01 volume  0.14524E-02 ppm1      8.772 ppm2      3.848 CV     1
 ASSI {  273}
   (( segid "ATXH" and resid 24   and name HB3 ))
   (( segid "ATXH" and resid 25   and name HN  ))
      2.800     1.000     1.000 peak   273 spectrum    1 weight  0.10000E+01 volume  0.14524E-02 ppm1      8.210 ppm2      1.904 CV     1
 ASSI {  275}
   (( segid "ATXH" and resid 4    and name HG2 ))
   (( segid "ATXH" and resid 4    and name HN  ))
      2.900     1.000     1.000 peak   275 spectrum    1 weight  0.10000E+01 volume  0.14084E-02 ppm1      8.149 ppm2      2.630 CV     1
 ASSI {  277}
   (( segid "ATXH" and resid 26   and name HN  ))
   (( segid "ATXH" and resid 25   and name HN  ))
      3.000     1.100     1.100 peak   277 spectrum    1 weight  0.10000E+01 volume  0.13974E-02 ppm1      8.212 ppm2      7.529 CV     1
 ASSI {  278}
   (( segid "ATXH" and resid 54   and name HB  ))
   (( segid "ATXH" and resid 54   and name HN  ))
      2.900     1.100     1.100 peak   278 spectrum    1 weight  0.10000E+01 volume  0.13864E-02 ppm1      8.017 ppm2      2.392 CV     1
 ASSI {  279}
   (( segid "ATXH" and resid 31   and name HB2 ))
   (( segid "ATXH" and resid 31   and name HN  ))
      3.000     1.100     1.100 peak   279 spectrum    1 weight  0.10000E+01 volume  0.13754E-02 ppm1      8.606 ppm2      2.748 CV     1
 ASSI {  280}
   (( segid "ATXH" and resid 9    and name HB2 ))
   (( segid "ATXH" and resid 10   and name HN  ))
      3.100     1.200     1.200 peak   280 spectrum    1 weight  0.10000E+01 volume  0.13644E-02 ppm1      9.035 ppm2      1.559 CV     1
 ASSI {  282}
   (( segid "ATXH" and resid 8    and name HB  ))
   (( segid "ATXH" and resid 8    and name HN  ))
      3.000     1.100     1.100 peak   282 spectrum    1 weight  0.10000E+01 volume  0.13204E-02 ppm1      8.805 ppm2      3.874 CV     1
 ASSI {  283}
   (( segid "ATXH" and resid 32   and name HA2 ))
   (( segid "ATXH" and resid 33   and name HN  ))
      3.000     1.100     1.100 peak   283 spectrum    1 weight  0.10000E+01 volume  0.13204E-02 ppm1      7.522 ppm2      4.218 CV     1
 ASSI {  284}
   (( segid "ATXH" and resid 45   and name HA  ))
   (( segid "ATXH" and resid 45   and name HN  ))
      3.000     1.100     1.100 peak   284 spectrum    1 weight  0.10000E+01 volume  0.13204E-02 ppm1      8.975 ppm2      4.470 CV     1
 ASSI {  285}
   (( segid "ATXH" and resid 68   and name HB2 ))
   (( segid "ATXH" and resid 68   and name HN  ))
      2.900     1.000     1.000 peak   285 spectrum    1 weight  0.10000E+01 volume  0.13094E-02 ppm1      6.774 ppm2      3.002 CV     1
 ASSI {  286}
   (( segid "ATXH" and resid 49   and name HG13))
   (( segid "ATXH" and resid 5    and name HN  ))
      3.000     1.100     1.100 peak   286 spectrum    1 weight  0.10000E+01 volume  0.13094E-02 ppm1      9.161 ppm2      1.421 CV     1
 ASSI {  287}
   (( segid "ATXH" and resid 33   and name HB  ))
   (( segid "ATXH" and resid 30   and name HN  ))
      3.100     1.200     1.200 peak   287 spectrum    1 weight  0.10000E+01 volume  0.13094E-02 ppm1      7.447 ppm2      2.260 CV     1
 ASSI {  288}
   (( segid "ATXH" and resid 30   and name HB3 ))
   (( segid "ATXH" and resid 31   and name HN  ))
      3.000     1.100     1.100 peak   288 spectrum    1 weight  0.10000E+01 volume  0.13094E-02 ppm1      8.606 ppm2      1.316 CV     1
 ASSI {  289}
   (( segid "ATXH" and resid 69   and name HA  ))
   (( segid "ATXH" and resid 69   and name HN  ))
      3.100     1.200     1.200 peak   289 spectrum    1 weight  0.10000E+01 volume  0.12984E-02 ppm1      7.903 ppm2      5.037 CV     1
 ASSI {  291}
   (( segid "ATXH" and resid 23   and name HA  ))
   (( segid "ATXH" and resid 23   and name HN  ))
      3.000     1.100     1.100 peak   291 spectrum    1 weight  0.10000E+01 volume  0.12984E-02 ppm1      8.268 ppm2      3.389 CV     1
 ASSI {  292}
   (( segid "ATXH" and resid 28   and name HB3 ))
   (( segid "ATXH" and resid 29   and name HN  ))
      2.900     1.100     1.100 peak   292 spectrum    1 weight  0.10000E+01 volume  0.12984E-02 ppm1      6.875 ppm2      1.850 CV     1
 OR {  292}
   (( segid "ATXH" and resid 28   and name HB2 ))
   (( segid "ATXH" and resid 29   and name HN  ))
 ASSI {  293}
   (( segid "ATXH" and resid 43   and name HA2 ))
   (( segid "ATXH" and resid 44   and name HN  ))
      3.200     1.300     1.300 peak   293 spectrum    1 weight  0.10000E+01 volume  0.12874E-02 ppm1      7.597 ppm2      4.032 CV     1
 ASSI {  294}
   (( segid "ATXH" and resid 69   and name HB3 ))
   (( segid "ATXH" and resid 70   and name HN  ))
      3.300     1.400     1.400 peak   294 spectrum    1 weight  0.10000E+01 volume  0.12764E-02 ppm1      9.464 ppm2      2.493 CV     1
 ASSI {  296}
   (( segid "ATXH" and resid 50   and name HA  ))
   (( segid "ATXH" and resid 52   and name HN  ))
      3.100     1.200     1.200 peak   296 spectrum    1 weight  0.10000E+01 volume  0.12654E-02 ppm1      8.772 ppm2      5.015 CV     1
 ASSI {  297}
   (( segid "ATXH" and resid 49   and name HG12))
   (( segid "ATXH" and resid 5    and name HN  ))
      3.400     1.400     1.400 peak   297 spectrum    1 weight  0.10000E+01 volume  0.12544E-02 ppm1      9.161 ppm2      0.840 CV     1
 ASSI {  298}
   (( segid "ATXH" and resid 20   and name HN  ))
   (( segid "ATXH" and resid 21   and name HN  ))
      3.100     1.200     1.200 peak   298 spectrum    1 weight  0.10000E+01 volume  0.12434E-02 ppm1      7.836 ppm2      7.017 CV     1
 ASSI {  299}
   (( segid "ATXH" and resid 64   and name HB2 ))
   (( segid "ATXH" and resid 65   and name HN  ))
      3.000     1.100     1.100 peak   299 spectrum    1 weight  0.10000E+01 volume  0.12323E-02 ppm1      8.428 ppm2      2.111 CV     1
 ASSI {  300}
   (  segid "ATXH" and resid 11   and name HG1%)
   (( segid "ATXH" and resid 12   and name HN  ))
      3.300     1.300     1.300 peak   300 spectrum    1 weight  0.10000E+01 volume  0.12323E-02 ppm1      9.284 ppm2      0.679 CV     1
 OR {  300}
   (  segid "ATXH" and resid 11   and name HG2%)
   (( segid "ATXH" and resid 12   and name HN  ))
 ASSI {  301}
   (( segid "ATXH" and resid 67   and name HA1 ))
   (( segid "ATXH" and resid 68   and name HN  ))
      3.100     1.200     1.200 peak   301 spectrum    1 weight  0.10000E+01 volume  0.12323E-02 ppm1      6.776 ppm2      3.546 CV     1
 ASSI {  302}
   (( segid "ATXH" and resid 29   and name HA  ))
   (( segid "ATXH" and resid 30   and name HN  ))
      3.200     1.200     1.200 peak   302 spectrum    1 weight  0.10000E+01 volume  0.12213E-02 ppm1      7.447 ppm2      4.061 CV     1
 ASSI {  306}
   (( segid "ATXH" and resid 5    and name HG2 ))
   (( segid "ATXH" and resid 5    and name HN  ))
      3.100     1.200     1.200 peak   306 spectrum    1 weight  0.10000E+01 volume  0.11993E-02 ppm1      9.160 ppm2      2.190 CV     1
 ASSI {  307}
   (  segid "ATXH" and resid 3    and name HB% )
   (( segid "ATXH" and resid 4    and name HN  ))
      3.400     1.500     1.500 peak   307 spectrum    1 weight  0.10000E+01 volume  0.11993E-02 ppm1      8.150 ppm2      1.358 CV     1
 ASSI {  308}
   (( segid "ATXH" and resid 28   and name HG2 ))
   (( segid "ATXH" and resid 28   and name HN  ))
      3.600     1.600     1.600 peak   308 spectrum    1 weight  0.10000E+01 volume  0.11883E-02 ppm1      7.699 ppm2      1.493 CV     1
 ASSI {  309}
   (( segid "ATXH" and resid 48   and name HB  ))
   (( segid "ATXH" and resid 34   and name HN  ))
      3.200     1.300     1.300 peak   309 spectrum    1 weight  0.10000E+01 volume  0.11883E-02 ppm1      8.792 ppm2      3.897 CV     1
 ASSI {  310}
   (  segid "ATXH" and resid 30   and name HD1%)
   (( segid "ATXH" and resid 31   and name HN  ))
      3.400     1.500     1.500 peak   310 spectrum    1 weight  0.10000E+01 volume  0.11773E-02 ppm1      8.606 ppm2      0.837 CV     1
 OR {  310}
   (  segid "ATXH" and resid 30   and name HD2%)
   (( segid "ATXH" and resid 31   and name HN  ))
 ASSI {  311}
   (( segid "ATXH" and resid 66   and name HB2 ))
   (( segid "ATXH" and resid 64   and name HN  ))
      3.200     1.300     1.300 peak   311 spectrum    1 weight  0.10000E+01 volume  0.11773E-02 ppm1      9.007 ppm2      2.492 CV     1
 OR {  311}
   (( segid "ATXH" and resid 66   and name HG3 ))
   (( segid "ATXH" and resid 64   and name HN  ))
 OR {  311}
   (( segid "ATXH" and resid 66   and name HG2 ))
   (( segid "ATXH" and resid 64   and name HN  ))
 ASSI {  313}
   (  segid "ATXH" and resid 60   and name HG1%)
   (( segid "ATXH" and resid 61   and name HN  ))
      3.300     1.300     1.300 peak   313 spectrum    1 weight  0.10000E+01 volume  0.11663E-02 ppm1      7.709 ppm2      0.973 CV     1
 ASSI {  317}
   (( segid "ATXH" and resid 58   and name HB3 ))
   (( segid "ATXH" and resid 55   and name HN  ))
      3.600     1.600     1.600 peak   317 spectrum    1 weight  0.10000E+01 volume  0.11444E-02 ppm1      8.077 ppm2      2.599 CV     1
 ASSI {  318}
   (( segid "ATXH" and resid 58   and name HA  ))
   (( segid "ATXH" and resid 61   and name HN  ))
      3.200     1.300     1.300 peak   318 spectrum    1 weight  0.10000E+01 volume  0.11444E-02 ppm1      7.710 ppm2      4.362 CV     1
 ASSI {  319}
   (( segid "ATXH" and resid 34   and name HG3 ))
   (( segid "ATXH" and resid 34   and name HN  ))
      3.500     1.500     1.500 peak   319 spectrum    1 weight  0.10000E+01 volume  0.11334E-02 ppm1      8.786 ppm2      2.069 CV     1
 ASSI {  320}
   (( segid "ATXH" and resid 56   and name HG  ))
   (( segid "ATXH" and resid 56   and name HN  ))
      3.200     1.300     1.300 peak   320 spectrum    1 weight  0.10000E+01 volume  0.11334E-02 ppm1      8.795 ppm2      0.868 CV     1
 OR {  320}
   (  segid "ATXH" and resid 56   and name HD2%)
   (( segid "ATXH" and resid 56   and name HN  ))
 OR {  320}
   (  segid "ATXH" and resid 56   and name HD1%)
   (( segid "ATXH" and resid 56   and name HN  ))
 ASSI {  321}
   (  segid "ATXH" and resid 53   and name HG1%)
   (( segid "ATXH" and resid 32   and name HN  ))
      3.300     1.300     1.300 peak   321 spectrum    1 weight  0.10000E+01 volume  0.11334E-02 ppm1      8.561 ppm2      0.811 CV     1
 OR {  321}
   (  segid "ATXH" and resid 53   and name HG2%)
   (( segid "ATXH" and resid 32   and name HN  ))
 ASSI {  322}
   (( segid "ATXH" and resid 43   and name HA1 ))
   (( segid "ATXH" and resid 44   and name HN  ))
      3.100     1.200     1.200 peak   322 spectrum    1 weight  0.10000E+01 volume  0.11223E-02 ppm1      7.597 ppm2      3.627 CV     1
 ASSI {  323}
   (( segid "ATXH" and resid 44   and name HA  ))
   (( segid "ATXH" and resid 11   and name HN  ))
      3.100     1.200     1.200 peak   323 spectrum    1 weight  0.10000E+01 volume  0.10948E-02 ppm1      8.525 ppm2      5.496 CV     1
 ASSI {  324}
   (( segid "ATXH" and resid 65   and name HB2 ))
   (( segid "ATXH" and resid 66   and name HN  ))
      3.600     1.600     1.600 peak   324 spectrum    1 weight  0.10000E+01 volume  0.10805E-02 ppm1      7.509 ppm2      2.911 CV     1
 ASSI {  326}
   (( segid "ATXH" and resid 42   and name HB2 ))
   (( segid "ATXH" and resid 43   and name HN  ))
      3.200     1.300     1.300 peak   326 spectrum    1 weight  0.10000E+01 volume  0.10684E-02 ppm1      7.939 ppm2      2.086 CV     1
 ASSI {  328}
   (( segid "ATXH" and resid 43   and name HA1 ))
   (( segid "ATXH" and resid 42   and name HN  ))
      3.800     1.800     1.800 peak   328 spectrum    1 weight  0.10000E+01 volume  0.10618E-02 ppm1      7.558 ppm2      3.641 CV     1
 ASSI {  329}
   (  segid "ATXH" and resid 38   and name HG1%)
   (( segid "ATXH" and resid 21   and name HN  ))
      2.900     2.900     3.100 peak   329 spectrum    1 weight  0.10000E+01 volume  0.10618E-02 ppm1      7.836 ppm2      0.980 CV     1
 ASSI {  330}
   (( segid "ATXH" and resid 55   and name HB  ))
   (( segid "ATXH" and resid 55   and name HN  ))
      3.300     1.300     1.300 peak   330 spectrum    1 weight  0.10000E+01 volume  0.10596E-02 ppm1      8.080 ppm2      4.409 CV     1
 ASSI {  333}
   (  segid "ATXH" and resid 36   and name HG2%)
   (( segid "ATXH" and resid 36   and name HN  ))
      3.200     1.300     1.300 peak   333 spectrum    1 weight  0.10000E+01 volume  0.10464E-02 ppm1      8.668 ppm2      0.873 CV     1
 ASSI {  334}
   (( segid "ATXH" and resid 58   and name HB3 ))
   (( segid "ATXH" and resid 59   and name HN  ))
      3.400     1.500     1.500 peak   334 spectrum    1 weight  0.10000E+01 volume  0.10255E-02 ppm1      7.362 ppm2      2.599 CV     1
 ASSI {  335}
   (( segid "ATXH" and resid 57   and name HG3 ))
   (( segid "ATXH" and resid 57   and name HN  ))
      3.800     1.800     1.800 peak   335 spectrum    1 weight  0.10000E+01 volume  0.10255E-02 ppm1      8.103 ppm2      1.419 CV     1
 OR {  335}
   (( segid "ATXH" and resid 57   and name HG2 ))
   (( segid "ATXH" and resid 57   and name HN  ))
 ASSI {  337}
   (( segid "ATXH" and resid 21   and name HB3 ))
   (( segid "ATXH" and resid 22   and name HN  ))
      3.200     1.300     1.300 peak   337 spectrum    1 weight  0.10000E+01 volume  0.10101E-02 ppm1      8.534 ppm2      2.800 CV     1
 OR {  337}
   (( segid "ATXH" and resid 21   and name HB2 ))
   (( segid "ATXH" and resid 22   and name HN  ))
 ASSI {  338}
   (( segid "ATXH" and resid 32   and name HA1 ))
   (( segid "ATXH" and resid 33   and name HN  ))
      3.300     1.400     1.400 peak   338 spectrum    1 weight  0.10000E+01 volume  0.10090E-02 ppm1      7.523 ppm2      3.664 CV     1
 ASSI {  340}
   (( segid "ATXH" and resid 29   and name HG3 ))
   (( segid "ATXH" and resid 29   and name HN  ))
      3.100     1.200     1.200 peak   340 spectrum    1 weight  0.10000E+01 volume  0.10002E-02 ppm1      6.874 ppm2      2.329 CV     1
 ASSI {  341}
   (( segid "ATXH" and resid 49   and name HB  ))
   (( segid "ATXH" and resid 5    and name HN  ))
      3.400     3.400     2.600 peak   341 spectrum    1 weight  0.10000E+01 volume  0.99027E-03 ppm1      9.160 ppm2      1.573 CV     1
 ASSI {  343}
   (( segid "ATXH" and resid 51   and name HA  ))
   (( segid "ATXH" and resid 54   and name HN  ))
      3.200     1.300     1.300 peak   343 spectrum    1 weight  0.10000E+01 volume  0.97926E-03 ppm1      8.013 ppm2      4.890 CV     1
 ASSI {  344}
   (( segid "ATXH" and resid 25   and name HB3 ))
   (( segid "ATXH" and resid 29   and name HN  ))
      3.500     1.500     1.500 peak   344 spectrum    1 weight  0.10000E+01 volume  0.97271E-03 ppm1      6.874 ppm2      3.825 CV     1
 ASSI {  345}
   (( segid "ATXH" and resid 65   and name HB3 ))
   (( segid "ATXH" and resid 66   and name HN  ))
      3.200     1.200     1.200 peak   345 spectrum    1 weight  0.10000E+01 volume  0.96501E-03 ppm1      7.507 ppm2      2.662 CV     1
 ASSI {  346}
   (( segid "ATXH" and resid 42   and name HA  ))
   (( segid "ATXH" and resid 43   and name HN  ))
      3.300     1.300     1.300 peak   346 spectrum    1 weight  0.10000E+01 volume  0.96056E-03 ppm1      7.936 ppm2      4.203 CV     1
 ASSI {  348}
   (  segid "ATXH" and resid 63   and name HG2%)
   (( segid "ATXH" and resid 68   and name HN  ))
      3.400     1.500     1.500 peak   348 spectrum    1 weight  0.10000E+01 volume  0.95401E-03 ppm1      6.775 ppm2      0.767 CV     1
 ASSI {  349}
   (( segid "ATXH" and resid 19   and name HA  ))
   (( segid "ATXH" and resid 19   and name HN  ))
      3.200     1.300     1.300 peak   349 spectrum    1 weight  0.10000E+01 volume  0.95070E-03 ppm1      7.841 ppm2      4.106 CV     1
 ASSI {  350}
   (( segid "ATXH" and resid 63   and name HB  ))
   (( segid "ATXH" and resid 62   and name HN  ))
      3.700     1.700     1.700 peak   350 spectrum    1 weight  0.10000E+01 volume  0.94408E-03 ppm1      7.187 ppm2      1.818 CV     1
 ASSI {  352}
   (( segid "ATXH" and resid 25   and name HB3 ))
   (( segid "ATXH" and resid 30   and name HN  ))
      3.500     3.500     2.500 peak   352 spectrum    1 weight  0.10000E+01 volume  0.93854E-03 ppm1      7.447 ppm2      3.823 CV     1
 ASSI {  354}
   (( segid "ATXH" and resid 35   and name HN  ))
   (( segid "ATXH" and resid 48   and name HN  ))
      3.200     1.300     1.300 peak   354 spectrum    1 weight  0.10000E+01 volume  0.92869E-03 ppm1      8.715 ppm2      7.515 CV     1
 ASSI {  356}
   (( segid "ATXH" and resid 54   and name HB  ))
   (( segid "ATXH" and resid 55   and name HN  ))
      3.800     1.800     1.800 peak   356 spectrum    1 weight  0.10000E+01 volume  0.92207E-03 ppm1      8.078 ppm2      2.386 CV     1
 ASSI {  358}
   (( segid "ATXH" and resid 47   and name HA  ))
   (( segid "ATXH" and resid 47   and name HN  ))
      3.200     1.300     1.300 peak   358 spectrum    1 weight  0.10000E+01 volume  0.91106E-03 ppm1      9.158 ppm2      5.074 CV     1
 ASSI {  359}
   (( segid "ATXH" and resid 60   and name HA  ))
   (( segid "ATXH" and resid 61   and name HN  ))
      3.300     1.300     1.300 peak   359 spectrum    1 weight  0.10000E+01 volume  0.90998E-03 ppm1      7.709 ppm2      3.253 CV     1
 ASSI {  360}
   (( segid "ATXH" and resid 32   and name HA1 ))
   (( segid "ATXH" and resid 54   and name HN  ))
      3.800     1.800     1.800 peak   360 spectrum    1 weight  0.10000E+01 volume  0.90775E-03 ppm1      8.033 ppm2      3.675 CV     1
 ASSI {  361}
   (( segid "ATXH" and resid 7    and name HG  ))
   (( segid "ATXH" and resid 7    and name HN  ))
      3.400     1.500     1.500 peak   361 spectrum    1 weight  0.10000E+01 volume  0.90444E-03 ppm1      9.260 ppm2      0.820 CV     1
 OR {  361}
   (  segid "ATXH" and resid 7    and name HD1%)
   (( segid "ATXH" and resid 7    and name HN  ))
 OR {  361}
   (  segid "ATXH" and resid 7    and name HD2%)
   (( segid "ATXH" and resid 7    and name HN  ))
 ASSI {  362}
   (( segid "ATXH" and resid 19   and name HB3 ))
   (( segid "ATXH" and resid 19   and name HN  ))
      3.300     1.300     1.300 peak   362 spectrum    1 weight  0.10000E+01 volume  0.90444E-03 ppm1      7.839 ppm2      2.764 CV     1
 ASSI {  363}
   (( segid "ATXH" and resid 61   and name HA  ))
   (( segid "ATXH" and resid 62   and name HN  ))
      3.400     1.400     1.400 peak   363 spectrum    1 weight  0.10000E+01 volume  0.90444E-03 ppm1      7.187 ppm2      4.198 CV     1
 ASSI {  364}
   (( segid "ATXH" and resid 36   and name HA  ))
   (( segid "ATXH" and resid 38   and name HN  ))
      3.600     3.600     2.400 peak   364 spectrum    1 weight  0.10000E+01 volume  0.90444E-03 ppm1      9.836 ppm2      4.925 CV     1
 ASSI {  365}
   (( segid "ATXH" and resid 33   and name HA  ))
   (( segid "ATXH" and resid 35   and name HN  ))
      3.900     1.900     1.900 peak   365 spectrum    1 weight  0.10000E+01 volume  0.89675E-03 ppm1      7.512 ppm2      4.059 CV     1
 ASSI {  367}
   (( segid "ATXH" and resid 61   and name HA  ))
   (( segid "ATXH" and resid 64   and name HN  ))
      3.300     1.300     1.300 peak   367 spectrum    1 weight  0.10000E+01 volume  0.89567E-03 ppm1      9.007 ppm2      4.201 CV     1
 ASSI {  368}
   (  segid "ATXH" and resid 11   and name HG1%)
   (( segid "ATXH" and resid 69   and name HN  ))
      3.400     1.500     1.500 peak   368 spectrum    1 weight  0.10000E+01 volume  0.88905E-03 ppm1      7.901 ppm2      0.676 CV     1
 OR {  368}
   (  segid "ATXH" and resid 11   and name HG2%)
   (( segid "ATXH" and resid 69   and name HN  ))
 ASSI {  369}
   (( segid "ATXH" and resid 60   and name HN  ))
   (( segid "ATXH" and resid 58   and name HN  ))
      3.300     1.400     1.400 peak   369 spectrum    1 weight  0.10000E+01 volume  0.88358E-03 ppm1      7.580 ppm2      8.544 CV     1
 ASSI {  370}
   (( segid "ATXH" and resid 27   and name HA  ))
   (( segid "ATXH" and resid 30   and name HN  ))
      3.300     1.400     1.400 peak   370 spectrum    1 weight  0.10000E+01 volume  0.86156E-03 ppm1      7.448 ppm2      3.687 CV     1
 ASSI {  371}
   (( segid "ATXH" and resid 70   and name HA  ))
   (( segid "ATXH" and resid 70   and name HN  ))
      3.200     1.300     1.300 peak   371 spectrum    1 weight  0.10000E+01 volume  0.85718E-03 ppm1      9.466 ppm2      4.541 CV     1
 ASSI {  372}
   (( segid "ATXH" and resid 10   and name HG3 ))
   (( segid "ATXH" and resid 11   and name HN  ))
      3.600     1.600     1.600 peak   372 spectrum    1 weight  0.10000E+01 volume  0.85056E-03 ppm1      8.525 ppm2      2.286 CV     1
 OR {  372}
   (( segid "ATXH" and resid 10   and name HG2 ))
   (( segid "ATXH" and resid 11   and name HN  ))
 ASSI {  375}
   (( segid "ATXH" and resid 35   and name HB2 ))
   (( segid "ATXH" and resid 48   and name HN  ))
      3.300     1.400     1.400 peak   375 spectrum    1 weight  0.10000E+01 volume  0.83732E-03 ppm1      8.720 ppm2      2.260 CV     1
 OR {  375}
   (( segid "ATXH" and resid 35   and name HG2 ))
   (( segid "ATXH" and resid 48   and name HN  ))
 ASSI {  376}
   (( segid "ATXH" and resid 31   and name HB3 ))
   (( segid "ATXH" and resid 32   and name HN  ))
      3.400     1.400     1.400 peak   376 spectrum    1 weight  0.10000E+01 volume  0.83516E-03 ppm1      8.560 ppm2      2.660 CV     1
 ASSI {  377}
   (  segid "ATXH" and resid 33   and name HG2%)
   (( segid "ATXH" and resid 30   and name HN  ))
      3.400     1.500     1.500 peak   377 spectrum    1 weight  0.10000E+01 volume  0.83516E-03 ppm1      7.446 ppm2      0.650 CV     1
 ASSI {  378}
   (  segid "ATXH" and resid 8    and name HG2%)
   (( segid "ATXH" and resid 9    and name HN  ))
      3.400     1.400     1.400 peak   378 spectrum    1 weight  0.10000E+01 volume  0.83401E-03 ppm1      9.295 ppm2      1.080 CV     1
 ASSI {  379}
   (  segid "ATXH" and resid 48   and name HG2%)
   (( segid "ATXH" and resid 5    and name HN  ))
      3.300     1.400     1.400 peak   379 spectrum    1 weight  0.10000E+01 volume  0.83293E-03 ppm1      9.161 ppm2      1.098 CV     1
 ASSI {  380}
   (  segid "ATXH" and resid 48   and name HG2%)
   (( segid "ATXH" and resid 35   and name HN  ))
      3.700     1.700     1.700 peak   380 spectrum    1 weight  0.10000E+01 volume  0.83077E-03 ppm1      7.512 ppm2      1.108 CV     1
 ASSI {  383}
   (( segid "ATXH" and resid 6    and name HG2 ))
   (( segid "ATXH" and resid 6    and name HE21))
      3.200     1.300     1.300 peak   383 spectrum    1 weight  0.10000E+01 volume  0.81315E-03 ppm1      7.328 ppm2      2.205 CV     1
 ASSI {  384}
   (  segid "ATXH" and resid 55   and name HG2%)
   (( segid "ATXH" and resid 56   and name HN  ))
      3.700     1.700     1.700 peak   384 spectrum    1 weight  0.10000E+01 volume  0.81092E-03 ppm1      8.796 ppm2      1.182 CV     1
 ASSI {  385}
   (( segid "ATXH" and resid 7    and name HA  ))
   (( segid "ATXH" and resid 7    and name HN  ))
      3.300     1.300     1.300 peak   385 spectrum    1 weight  0.10000E+01 volume  0.80761E-03 ppm1      9.258 ppm2      4.838 CV     1
 ASSI {  386}
   (( segid "ATXH" and resid 37   and name HG3 ))
   (( segid "ATXH" and resid 37   and name HN  ))
      3.400     1.400     1.400 peak   386 spectrum    1 weight  0.10000E+01 volume  0.80322E-03 ppm1      8.996 ppm2      1.225 CV     1
 OR {  386}
   (( segid "ATXH" and resid 37   and name HG2 ))
   (( segid "ATXH" and resid 37   and name HN  ))
 ASSI {  387}
   (( segid "ATXH" and resid 70   and name HB  ))
   (( segid "ATXH" and resid 71   and name HN  ))
      3.400     1.500     1.500 peak   387 spectrum    1 weight  0.10000E+01 volume  0.79991E-03 ppm1      8.789 ppm2      2.080 CV     1
 ASSI {  388}
   (( segid "ATXH" and resid 37   and name HG2 ))
   (( segid "ATXH" and resid 38   and name HN  ))
      3.900     1.900     1.900 peak   388 spectrum    1 weight  0.10000E+01 volume  0.79444E-03 ppm1      9.834 ppm2      1.214 CV     1
 OR {  388}
   (( segid "ATXH" and resid 37   and name HG3 ))
   (( segid "ATXH" and resid 38   and name HN  ))
 ASSI {  389}
   (( segid "ATXH" and resid 42   and name HB3 ))
   (( segid "ATXH" and resid 43   and name HN  ))
      3.500     1.500     1.500 peak   389 spectrum    1 weight  0.10000E+01 volume  0.78783E-03 ppm1      7.941 ppm2      1.905 CV     1
 ASSI {  390}
   (( segid "ATXH" and resid 12   and name HB2 ))
   (( segid "ATXH" and resid 13   and name HN  ))
      3.800     1.800     1.800 peak   390 spectrum    1 weight  0.10000E+01 volume  0.78236E-03 ppm1      8.567 ppm2      2.150 CV     1
 ASSI {  392}
   (( segid "ATXH" and resid 52   and name HB2 ))
   (( segid "ATXH" and resid 52   and name HN  ))
      3.300     1.300     1.300 peak   392 spectrum    1 weight  0.10000E+01 volume  0.77574E-03 ppm1      8.772 ppm2      3.995 CV     1
 ASSI {  393}
   (( segid "ATXH" and resid 16   and name HN  ))
   (( segid "ATXH" and resid 19   and name HN  ))
      3.300     1.400     1.400 peak   393 spectrum    1 weight  0.10000E+01 volume  0.76581E-03 ppm1      7.831 ppm2      8.606 CV     1
 ASSI {  395}
   (( segid "ATXH" and resid 31   and name HA  ))
   (( segid "ATXH" and resid 33   and name HN  ))
      3.400     1.400     1.400 peak   395 spectrum    1 weight  0.10000E+01 volume  0.75919E-03 ppm1      7.523 ppm2      4.430 CV     1
 ASSI {  398}
   (( segid "ATXH" and resid 58   and name HN  ))
   (( segid "ATXH" and resid 55   and name HN  ))
      3.400     1.500     1.500 peak   398 spectrum    1 weight  0.10000E+01 volume  0.75481E-03 ppm1      8.078 ppm2      7.581 CV     1
 ASSI {  399}
   (( segid "ATXH" and resid 19   and name HB2 ))
   (( segid "ATXH" and resid 16   and name HN  ))
      3.500     1.500     1.500 peak   399 spectrum    1 weight  0.10000E+01 volume  0.75042E-03 ppm1      8.632 ppm2      3.270 CV     1
 ASSI {  400}
   (( segid "ATXH" and resid 13   and name HA1 ))
   (( segid "ATXH" and resid 14   and name HN  ))
      3.300     1.400     1.400 peak   400 spectrum    1 weight  0.10000E+01 volume  0.74934E-03 ppm1      8.889 ppm2      3.744 CV     1
 ASSI {  401}
   (( segid "ATXH" and resid 54   and name HN  ))
   (( segid "ATXH" and resid 52   and name HN  ))
      3.800     1.800     1.800 peak   401 spectrum    1 weight  0.10000E+01 volume  0.74495E-03 ppm1      8.772 ppm2      8.023 CV     1
 ASSI {  402}
   (( segid "ATXH" and resid 27   and name HA  ))
   (( segid "ATXH" and resid 28   and name HN  ))
      3.400     1.500     1.500 peak   402 spectrum    1 weight  0.10000E+01 volume  0.73718E-03 ppm1      7.699 ppm2      3.673 CV     1
 ASSI {  403}
   (( segid "ATXH" and resid 37   and name HB3 ))
   (( segid "ATXH" and resid 38   and name HN  ))
      3.700     1.700     1.700 peak   403 spectrum    1 weight  0.10000E+01 volume  0.73610E-03 ppm1      9.833 ppm2      1.622 CV     1
 ASSI {  404}
   (( segid "ATXH" and resid 32   and name HA1 ))
   (( segid "ATXH" and resid 50   and name HN  ))
      3.500     1.500     1.500 peak   404 spectrum    1 weight  0.10000E+01 volume  0.73394E-03 ppm1      8.531 ppm2      3.666 CV     1
 ASSI {  405}
   (( segid "ATXH" and resid 12   and name HN  ))
   (( segid "ATXH" and resid 69   and name HN  ))
      3.300     1.400     1.400 peak   405 spectrum    1 weight  0.10000E+01 volume  0.73394E-03 ppm1      7.901 ppm2      9.288 CV     1
 ASSI {  406}
   (( segid "ATXH" and resid 64   and name HA  ))
   (( segid "ATXH" and resid 65   and name HN  ))
      3.400     1.400     1.400 peak   406 spectrum    1 weight  0.10000E+01 volume  0.72840E-03 ppm1      8.427 ppm2      4.669 CV     1
 ASSI {  407}
   (( segid "ATXH" and resid 14   and name HA  ))
   (( segid "ATXH" and resid 14   and name HN  ))
      3.300     1.400     1.400 peak   407 spectrum    1 weight  0.10000E+01 volume  0.72732E-03 ppm1      8.891 ppm2      5.008 CV     1
 ASSI {  408}
   (( segid "ATXH" and resid 49   and name HB  ))
   (( segid "ATXH" and resid 49   and name HN  ))
      3.500     1.500     1.500 peak   408 spectrum    1 weight  0.10000E+01 volume  0.72401E-03 ppm1      9.253 ppm2      1.556 CV     1
 ASSI {  409}
   (( segid "ATXH" and resid 20   and name HA  ))
   (( segid "ATXH" and resid 21   and name HN  ))
      3.400     1.500     1.500 peak   409 spectrum    1 weight  0.10000E+01 volume  0.71962E-03 ppm1      7.836 ppm2      3.235 CV     1
 ASSI {  410}
   (( segid "ATXH" and resid 59   and name HA  ))
   (( segid "ATXH" and resid 60   and name HN  ))
      3.400     1.500     1.500 peak   410 spectrum    1 weight  0.10000E+01 volume  0.71740E-03 ppm1      8.538 ppm2      3.487 CV     1
 ASSI {  411}
   (( segid "ATXH" and resid 52   and name HA  ))
   (( segid "ATXH" and resid 53   and name HN  ))
      3.400     1.500     1.500 peak   411 spectrum    1 weight  0.10000E+01 volume  0.71632E-03 ppm1      7.802 ppm2      4.467 CV     1
 ASSI {  413}
   (  segid "ATXH" and resid 62   and name HG1%)
   (( segid "ATXH" and resid 63   and name HN  ))
      3.500     1.500     1.500 peak   413 spectrum    1 weight  0.10000E+01 volume  0.70531E-03 ppm1      7.635 ppm2      1.151 CV     1
 ASSI {  414}
   (  segid "ATXH" and resid 54   and name HG2%)
   (( segid "ATXH" and resid 55   and name HN  ))
      3.300     1.400     1.400 peak   414 spectrum    1 weight  0.10000E+01 volume  0.69761E-03 ppm1      8.078 ppm2      0.728 CV     1
 ASSI {  416}
   (( segid "ATXH" and resid 64   and name HA  ))
   (( segid "ATXH" and resid 67   and name HN  ))
      3.700     1.700     1.700 peak   416 spectrum    1 weight  0.10000E+01 volume  0.69322E-03 ppm1      7.877 ppm2      4.674 CV     1
 ASSI {  418}
   (( segid "ATXH" and resid 66   and name HA  ))
   (( segid "ATXH" and resid 67   and name HN  ))
      3.400     1.500     1.500 peak   418 spectrum    1 weight  0.10000E+01 volume  0.67120E-03 ppm1      7.881 ppm2      4.276 CV     1
 ASSI {  419}
   (( segid "ATXH" and resid 62   and name HA  ))
   (( segid "ATXH" and resid 65   and name HN  ))
      3.500     1.500     1.500 peak   419 spectrum    1 weight  0.10000E+01 volume  0.66679E-03 ppm1      8.426 ppm2      3.874 CV     1
 ASSI {  420}
   (( segid "ATXH" and resid 65   and name HA  ))
   (( segid "ATXH" and resid 67   and name HN  ))
      3.400     1.500     1.500 peak   420 spectrum    1 weight  0.10000E+01 volume  0.65799E-03 ppm1      7.882 ppm2      4.510 CV     1
 ASSI {  423}
   (  segid "ATXH" and resid 44   and name HG2%)
   (( segid "ATXH" and resid 11   and name HN  ))
      3.800     1.800     1.800 peak   423 spectrum    1 weight  0.10000E+01 volume  0.64809E-03 ppm1      8.525 ppm2      0.951 CV     1
 ASSI {  424}
   (( segid "ATXH" and resid 39   and name HN  ))
   (( segid "ATXH" and resid 44   and name HN  ))
      3.600     1.600     1.600 peak   424 spectrum    1 weight  0.10000E+01 volume  0.64809E-03 ppm1      7.597 ppm2      8.904 CV     1
 ASSI {  425}
   (  segid "ATXH" and resid 53   and name HG2%)
   (( segid "ATXH" and resid 52   and name HN  ))
      3.600     1.600     1.600 peak   425 spectrum    1 weight  0.10000E+01 volume  0.64809E-03 ppm1      8.773 ppm2      0.816 CV     1
 ASSI {  426}
   (( segid "ATXH" and resid 68   and name HN  ))
   (( segid "ATXH" and resid 66   and name HN  ))
      3.900     1.900     1.900 peak   426 spectrum    1 weight  0.10000E+01 volume  0.64479E-03 ppm1      7.512 ppm2      6.787 CV     1
 ASSI {  427}
   (( segid "ATXH" and resid 12   and name HB3 ))
   (( segid "ATXH" and resid 69   and name HN  ))
      3.500     1.600     1.600 peak   427 spectrum    1 weight  0.10000E+01 volume  0.64149E-03 ppm1      7.901 ppm2      1.975 CV     1
 ASSI {  428}
   (( segid "ATXH" and resid 37   and name HB3 ))
   (( segid "ATXH" and resid 36   and name HN  ))
      3.500     3.500     2.500 peak   428 spectrum    1 weight  0.10000E+01 volume  0.64039E-03 ppm1      8.669 ppm2      1.582 CV     1
 OR {  428}
   (( segid "ATXH" and resid 37   and name HD2 ))
   (( segid "ATXH" and resid 36   and name HN  ))
 ASSI {  429}
   (( segid "ATXH" and resid 58   and name HA  ))
   (( segid "ATXH" and resid 59   and name HN  ))
      3.500     1.500     1.500 peak   429 spectrum    1 weight  0.10000E+01 volume  0.63379E-03 ppm1      7.358 ppm2      4.371 CV     1
 ASSI {  430}
   (( segid "ATXH" and resid 6    and name HB3 ))
   (( segid "ATXH" and resid 6    and name HE21))
      3.500     1.500     1.500 peak   430 spectrum    1 weight  0.10000E+01 volume  0.63048E-03 ppm1      7.326 ppm2      1.907 CV     1
 ASSI {  432}
   (  segid "ATXH" and resid 20   and name HG2%)
   (( segid "ATXH" and resid 21   and name HN  ))
      3.700     1.700     1.700 peak   432 spectrum    1 weight  0.10000E+01 volume  0.62058E-03 ppm1      7.836 ppm2      0.881 CV     1
 ASSI {  433}
   (( segid "ATXH" and resid 67   and name HA2 ))
   (( segid "ATXH" and resid 68   and name HN  ))
      3.800     1.800     1.800 peak   433 spectrum    1 weight  0.10000E+01 volume  0.61618E-03 ppm1      6.775 ppm2      3.954 CV     1
 ASSI {  435}
   (( segid "ATXH" and resid 66   and name HB3 ))
   (( segid "ATXH" and resid 66   and name HE21))
      3.300     1.300     1.300 peak   435 spectrum    1 weight  0.10000E+01 volume  0.61068E-03 ppm1      7.521 ppm2      2.254 CV     1
 ASSI {  436}
   (( segid "ATXH" and resid 38   and name HA  ))
   (( segid "ATXH" and resid 38   and name HN  ))
      3.400     1.400     1.400 peak   436 spectrum    1 weight  0.10000E+01 volume  0.60958E-03 ppm1      9.835 ppm2      4.342 CV     1
 ASSI {  437}
   (( segid "ATXH" and resid 23   and name HA  ))
   (( segid "ATXH" and resid 26   and name HN  ))
      3.500     1.500     1.500 peak   437 spectrum    1 weight  0.10000E+01 volume  0.60848E-03 ppm1      7.529 ppm2      3.397 CV     1
 ASSI {  438}
   (  segid "ATXH" and resid 54   and name HG1%)
   (( segid "ATXH" and resid 54   and name HN  ))
      3.300     1.400     1.400 peak   438 spectrum    1 weight  0.10000E+01 volume  0.60407E-03 ppm1      8.019 ppm2      1.175 CV     1
 ASSI {  439}
   (( segid "ATXH" and resid 56   and name HG  ))
   (( segid "ATXH" and resid 57   and name HN  ))
      3.500     1.500     1.500 peak   439 spectrum    1 weight  0.10000E+01 volume  0.60297E-03 ppm1      8.103 ppm2      0.872 CV     1
 OR {  439}
   (  segid "ATXH" and resid 56   and name HD1%)
   (( segid "ATXH" and resid 57   and name HN  ))
 OR {  439}
   (  segid "ATXH" and resid 56   and name HD2%)
   (( segid "ATXH" and resid 57   and name HN  ))
 ASSI {  441}
   (( segid "ATXH" and resid 34   and name HN  ))
   (( segid "ATXH" and resid 33   and name HN  ))
      3.900     1.900     1.900 peak   441 spectrum    1 weight  0.10000E+01 volume  0.60187E-03 ppm1      7.529 ppm2      8.797 CV     1
 ASSI {  442}
   (( segid "ATXH" and resid 58   and name HB3 ))
   (( segid "ATXH" and resid 58   and name HN  ))
      4.100     2.100     1.900 peak   442 spectrum    1 weight  0.10000E+01 volume  0.59748E-03 ppm1      7.584 ppm2      2.585 CV     1
 ASSI {  443}
   (  segid "ATXH" and resid 54   and name HG1%)
   (( segid "ATXH" and resid 33   and name HN  ))
      3.500     1.600     1.600 peak   443 spectrum    1 weight  0.10000E+01 volume  0.59197E-03 ppm1      7.526 ppm2      1.163 CV     1
 ASSI {  445}
   (( segid "ATXH" and resid 5    and name HG3 ))
   (( segid "ATXH" and resid 51   and name HN  ))
      3.500     1.500     1.500 peak   445 spectrum    1 weight  0.10000E+01 volume  0.58317E-03 ppm1      8.793 ppm2      1.986 CV     1
 OR {  445}
   (( segid "ATXH" and resid 5    and name HB2 ))
   (( segid "ATXH" and resid 51   and name HN  ))
 ASSI {  446}
   (( segid "ATXH" and resid 33   and name HA  ))
   (( segid "ATXH" and resid 50   and name HN  ))
      3.600     1.600     1.600 peak   446 spectrum    1 weight  0.10000E+01 volume  0.58317E-03 ppm1      8.529 ppm2      4.067 CV     1
 ASSI {  447}
   (( segid "ATXH" and resid 14   and name HA  ))
   (( segid "ATXH" and resid 16   and name HN  ))
      4.000     2.000     2.000 peak   447 spectrum    1 weight  0.10000E+01 volume  0.57987E-03 ppm1      8.635 ppm2      5.051 CV     1
 ASSI {  448}
   (( segid "ATXH" and resid 5    and name HN  ))
   (( segid "ATXH" and resid 4    and name HN  ))
      3.900     1.900     1.900 peak   448 spectrum    1 weight  0.10000E+01 volume  0.57547E-03 ppm1      8.151 ppm2      9.161 CV     1
 ASSI {  450}
   (( segid "ATXH" and resid 33   and name HB  ))
   (( segid "ATXH" and resid 32   and name HN  ))
      4.100     2.100     1.900 peak   450 spectrum    1 weight  0.10000E+01 volume  0.56777E-03 ppm1      8.559 ppm2      2.262 CV     1
 ASSI {  451}
   (( segid "ATXH" and resid 9    and name HG  ))
   (( segid "ATXH" and resid 9    and name HN  ))
      3.500     3.500     2.500 peak   451 spectrum    1 weight  0.10000E+01 volume  0.55896E-03 ppm1      9.296 ppm2      0.633 CV     1
 OR {  451}
   (  segid "ATXH" and resid 9    and name HD1%)
   (( segid "ATXH" and resid 9    and name HN  ))
 ASSI {  453}
   (  segid "ATXH" and resid 11   and name HG1%)
   (( segid "ATXH" and resid 14   and name HN  ))
      3.700     1.700     1.700 peak   453 spectrum    1 weight  0.10000E+01 volume  0.55346E-03 ppm1      8.891 ppm2      0.653 CV     1
 ASSI {  454}
   (( segid "ATXH" and resid 2    and name HA  ))
   (( segid "ATXH" and resid 3    and name HN  ))
      3.500     1.600     1.600 peak   454 spectrum    1 weight  0.10000E+01 volume  0.55016E-03 ppm1      8.436 ppm2      4.706 CV     1
 ASSI {  456}
   (( segid "ATXH" and resid 60   and name HA  ))
   (( segid "ATXH" and resid 63   and name HN  ))
      3.600     1.600     1.600 peak   456 spectrum    1 weight  0.10000E+01 volume  0.54026E-03 ppm1      7.636 ppm2      3.257 CV     1
 ASSI {  460}
   (( segid "ATXH" and resid 9    and name HB3 ))
   (( segid "ATXH" and resid 9    and name HN  ))
      3.600     1.700     1.700 peak   460 spectrum    1 weight  0.10000E+01 volume  0.52045E-03 ppm1      9.295 ppm2      1.278 CV     1
 ASSI {  461}
   (( segid "ATXH" and resid 25   and name HA  ))
   (( segid "ATXH" and resid 28   and name HN  ))
      3.700     1.700     1.700 peak   461 spectrum    1 weight  0.10000E+01 volume  0.51055E-03 ppm1      7.694 ppm2      4.064 CV     1
 ASSI {  462}
   (  segid "ATXH" and resid 27   and name HG1%)
   (( segid "ATXH" and resid 26   and name HN  ))
      3.800     1.800     1.800 peak   462 spectrum    1 weight  0.10000E+01 volume  0.50835E-03 ppm1      7.527 ppm2      0.896 CV     1
 OR {  462}
   (  segid "ATXH" and resid 27   and name HG2%)
   (( segid "ATXH" and resid 26   and name HN  ))
 ASSI {  464}
   (( segid "ATXH" and resid 6    and name HG2 ))
   (( segid "ATXH" and resid 7    and name HN  ))
      4.000     2.000     2.000 peak   464 spectrum    1 weight  0.10000E+01 volume  0.50285E-03 ppm1      9.259 ppm2      2.199 CV     1
 ASSI {  465}
   (( segid "ATXH" and resid 47   and name HA  ))
   (( segid "ATXH" and resid 37   and name HN  ))
      3.700     1.700     1.700 peak   465 spectrum    1 weight  0.10000E+01 volume  0.49295E-03 ppm1      8.994 ppm2      5.003 CV     1
 ASSI {  466}
   (( segid "ATXH" and resid 64   and name HN  ))
   (( segid "ATXH" and resid 66   and name HN  ))
      3.800     1.800     1.800 peak   466 spectrum    1 weight  0.10000E+01 volume  0.49075E-03 ppm1      7.507 ppm2      9.000 CV     1
 ASSI {  467}
   (( segid "ATXH" and resid 26   and name HB2 ))
   (( segid "ATXH" and resid 27   and name HN  ))
      3.800     1.800     1.800 peak   467 spectrum    1 weight  0.10000E+01 volume  0.48854E-03 ppm1      8.176 ppm2      3.876 CV     1
 ASSI {  468}
   (  segid "ATXH" and resid 55   and name HG2%)
   (( segid "ATXH" and resid 57   and name HN  ))
      4.000     2.000     2.000 peak   468 spectrum    1 weight  0.10000E+01 volume  0.48304E-03 ppm1      8.101 ppm2      1.181 CV     1
 ASSI {  469}
   (  segid "ATXH" and resid 40   and name HD2%)
   (( segid "ATXH" and resid 43   and name HN  ))
      3.300     1.400     1.400 peak   469 spectrum    1 weight  0.10000E+01 volume  0.48194E-03 ppm1      7.933 ppm2      0.771 CV     1
 ASSI {  470}
   (( segid "ATXH" and resid 51   and name HB2 ))
   (( segid "ATXH" and resid 51   and name HN  ))
      4.100     2.100     1.900 peak   470 spectrum    1 weight  0.10000E+01 volume  0.48084E-03 ppm1      8.793 ppm2      4.205 CV     1
 ASSI {  471}
   (( segid "ATXH" and resid 7    and name HB3 ))
   (( segid "ATXH" and resid 8    and name HN  ))
      3.600     1.600     1.600 peak   471 spectrum    1 weight  0.10000E+01 volume  0.47864E-03 ppm1      8.805 ppm2      1.410 CV     1
 ASSI {  472}
   (( segid "ATXH" and resid 53   and name HB  ))
   (( segid "ATXH" and resid 32   and name HN  ))
      4.100     2.100     1.900 peak   472 spectrum    1 weight  0.10000E+01 volume  0.47754E-03 ppm1      8.559 ppm2      2.004 CV     1
 ASSI {  473}
   (( segid "ATXH" and resid 68   and name HB3 ))
   (( segid "ATXH" and resid 67   and name HN  ))
      4.600     2.600     1.400 peak   473 spectrum    1 weight  0.10000E+01 volume  0.47754E-03 ppm1      7.880 ppm2      2.299 CV     1
 ASSI {  474}
   (( segid "ATXH" and resid 39   and name HA  ))
   (( segid "ATXH" and resid 39   and name HN  ))
      3.600     1.600     1.600 peak   474 spectrum    1 weight  0.10000E+01 volume  0.47644E-03 ppm1      8.890 ppm2      4.726 CV     1
 ASSI {  476}
   (( segid "ATXH" and resid 64   and name HG2 ))
   (( segid "ATXH" and resid 70   and name HN  ))
      3.500     1.500     1.500 peak   476 spectrum    1 weight  0.10000E+01 volume  0.46984E-03 ppm1      9.463 ppm2      2.679 CV     1
 ASSI {  478}
   (  segid "ATXH" and resid 38   and name HG1%)
   (( segid "ATXH" and resid 39   and name HN  ))
      3.700     1.800     1.800 peak   478 spectrum    1 weight  0.10000E+01 volume  0.45773E-03 ppm1      8.892 ppm2      0.990 CV     1
 ASSI {  481}
   (  segid "ATXH" and resid 38   and name HG1%)
   (( segid "ATXH" and resid 23   and name HN  ))
      3.400     1.400     1.400 peak   481 spectrum    1 weight  0.10000E+01 volume  0.44233E-03 ppm1      8.270 ppm2      1.005 CV     1
 ASSI {  482}
   (( segid "ATXH" and resid 19   and name HA  ))
   (( segid "ATXH" and resid 20   and name HN  ))
      3.700     1.700     1.700 peak   482 spectrum    1 weight  0.10000E+01 volume  0.43903E-03 ppm1      7.020 ppm2      4.102 CV     1
 ASSI {  483}
   (( segid "ATXH" and resid 50   and name HB2 ))
   (( segid "ATXH" and resid 53   and name HN  ))
      4.400     2.400     1.600 peak   483 spectrum    1 weight  0.10000E+01 volume  0.43793E-03 ppm1      7.803 ppm2      2.942 CV     1
 ASSI {  484}
   (( segid "ATXH" and resid 7    and name HB3 ))
   (( segid "ATXH" and resid 7    and name HN  ))
      4.200     2.200     1.800 peak   484 spectrum    1 weight  0.10000E+01 volume  0.42803E-03 ppm1      9.258 ppm2      1.413 CV     1
 ASSI {  485}
   (( segid "ATXH" and resid 51   and name HN  ))
   (( segid "ATXH" and resid 5    and name HN  ))
      3.700     1.700     1.700 peak   485 spectrum    1 weight  0.10000E+01 volume  0.42803E-03 ppm1      9.160 ppm2      8.791 CV     1
 ASSI {  486}
   (( segid "ATXH" and resid 20   and name HN  ))
   (( segid "ATXH" and resid 19   and name HN  ))
      3.600     1.700     1.700 peak   486 spectrum    1 weight  0.10000E+01 volume  0.42803E-03 ppm1      7.842 ppm2      7.019 CV     1
 ASSI {  489}
   (( segid "ATXH" and resid 23   and name HA  ))
   (( segid "ATXH" and resid 24   and name HN  ))
      3.700     1.700     1.700 peak   489 spectrum    1 weight  0.10000E+01 volume  0.42473E-03 ppm1      8.599 ppm2      3.388 CV     1
 ASSI {  494}
   (( segid "ATXH" and resid 30   and name HB3 ))
   (( segid "ATXH" and resid 33   and name HN  ))
      3.800     1.800     1.800 peak   494 spectrum    1 weight  0.10000E+01 volume  0.41372E-03 ppm1      7.526 ppm2      1.318 CV     1
 ASSI {  497}
   (( segid "ATXH" and resid 69   and name HB3 ))
   (( segid "ATXH" and resid 12   and name HN  ))
      3.900     1.900     1.900 peak   497 spectrum    1 weight  0.10000E+01 volume  0.40932E-03 ppm1      9.283 ppm2      2.443 CV     1
 ASSI {  498}
   (( segid "ATXH" and resid 47   and name HA  ))
   (( segid "ATXH" and resid 36   and name HN  ))
      3.400     3.400     2.600 peak   498 spectrum    1 weight  0.10000E+01 volume  0.40492E-03 ppm1      8.671 ppm2      5.005 CV     1
 ASSI {  499}
   (( segid "ATXH" and resid 64   and name HB3 ))
   (( segid "ATXH" and resid 65   and name HN  ))
      3.900     1.900     1.900 peak   499 spectrum    1 weight  0.10000E+01 volume  0.40052E-03 ppm1      8.425 ppm2      2.006 CV     1
 ASSI {  501}
   (( segid "ATXH" and resid 21   and name HA  ))
   (( segid "ATXH" and resid 25   and name HN  ))
      4.000     2.000     2.000 peak   501 spectrum    1 weight  0.10000E+01 volume  0.39832E-03 ppm1      8.209 ppm2      4.443 CV     1
 ASSI {  502}
   (( segid "ATXH" and resid 6    and name HB2 ))
   (( segid "ATXH" and resid 7    and name HN  ))
      4.200     2.300     1.800 peak   502 spectrum    1 weight  0.10000E+01 volume  0.39832E-03 ppm1      9.259 ppm2      1.997 CV     1
 OR {  502}
   (( segid "ATXH" and resid 6    and name HG3 ))
   (( segid "ATXH" and resid 7    and name HN  ))
 ASSI {  504}
   (( segid "ATXH" and resid 39   and name HB2 ))
   (( segid "ATXH" and resid 43   and name HN  ))
      3.800     1.800     1.800 peak   504 spectrum    1 weight  0.10000E+01 volume  0.39501E-03 ppm1      7.937 ppm2      2.301 CV     1
 ASSI {  505}
   (( segid "ATXH" and resid 63   and name HA  ))
   (( segid "ATXH" and resid 66   and name HN  ))
      3.700     1.700     1.700 peak   505 spectrum    1 weight  0.10000E+01 volume  0.39501E-03 ppm1      7.509 ppm2      3.461 CV     1
 ASSI {  507}
   (( segid "ATXH" and resid 51   and name HB3 ))
   (( segid "ATXH" and resid 5    and name HN  ))
      3.800     1.800     1.800 peak   507 spectrum    1 weight  0.10000E+01 volume  0.38732E-03 ppm1      9.135 ppm2      3.813 CV     1
 ASSI {  508}
   (  segid "ATXH" and resid 48   and name HG2%)
   (( segid "ATXH" and resid 48   and name HN  ))
      4.200     2.200     1.800 peak   508 spectrum    1 weight  0.10000E+01 volume  0.38732E-03 ppm1      8.716 ppm2      1.101 CV     1
 ASSI {  510}
   (( segid "ATXH" and resid 71   and name HN  ))
   (( segid "ATXH" and resid 10   and name HN  ))
      3.800     1.800     1.800 peak   510 spectrum    1 weight  0.10000E+01 volume  0.37741E-03 ppm1      9.038 ppm2      8.796 CV     1
 ASSI {  511}
   (( segid "ATXH" and resid 59   and name HA  ))
   (( segid "ATXH" and resid 61   and name HN  ))
      3.900     1.900     1.900 peak   511 spectrum    1 weight  0.10000E+01 volume  0.37081E-03 ppm1      7.709 ppm2      3.489 CV     1
 ASSI {  512}
   (( segid "ATXH" and resid 48   and name HB  ))
   (( segid "ATXH" and resid 49   and name HN  ))
      4.000     2.000     2.000 peak   512 spectrum    1 weight  0.10000E+01 volume  0.37081E-03 ppm1      9.254 ppm2      3.876 CV     1
 ASSI {  513}
   (( segid "ATXH" and resid 7    and name HB3 ))
   (( segid "ATXH" and resid 47   and name HN  ))
      3.800     1.800     1.800 peak   513 spectrum    1 weight  0.10000E+01 volume  0.37081E-03 ppm1      9.165 ppm2      1.395 CV     1
 ASSI {  516}
   (( segid "ATXH" and resid 32   and name HN  ))
   (( segid "ATXH" and resid 54   and name HN  ))
      4.400     2.500     1.600 peak   516 spectrum    1 weight  0.10000E+01 volume  0.36751E-03 ppm1      8.012 ppm2      8.595 CV     1
 ASSI {  517}
   (( segid "ATXH" and resid 63   and name HA  ))
   (( segid "ATXH" and resid 64   and name HN  ))
      3.800     1.800     1.800 peak   517 spectrum    1 weight  0.10000E+01 volume  0.36311E-03 ppm1      9.006 ppm2      3.462 CV     1
 ASSI {  520}
   (  segid "ATXH" and resid 61   and name HB% )
   (( segid "ATXH" and resid 65   and name HN  ))
      4.000     2.000     2.000 peak   520 spectrum    1 weight  0.10000E+01 volume  0.35760E-03 ppm1      8.423 ppm2      1.510 CV     1
 ASSI {  521}
   (( segid "ATXH" and resid 65   and name HB2 ))
   (( segid "ATXH" and resid 64   and name HN  ))
      4.400     2.400     1.600 peak   521 spectrum    1 weight  0.10000E+01 volume  0.35760E-03 ppm1      9.007 ppm2      2.894 CV     1
 ASSI {  525}
   (( segid "ATXH" and resid 63   and name HA  ))
   (( segid "ATXH" and resid 65   and name HN  ))
      3.900     1.900     1.900 peak   525 spectrum    1 weight  0.10000E+01 volume  0.34990E-03 ppm1      8.428 ppm2      3.481 CV     1
 ASSI {  526}
   (( segid "ATXH" and resid 70   and name HN  ))
   (( segid "ATXH" and resid 69   and name HN  ))
      3.900     1.900     1.900 peak   526 spectrum    1 weight  0.10000E+01 volume  0.34770E-03 ppm1      7.900 ppm2      9.472 CV     1
 ASSI {  527}
   (  segid "ATXH" and resid 8    and name HG2%)
   (( segid "ATXH" and resid 8    and name HN  ))
      4.300     2.300     1.700 peak   527 spectrum    1 weight  0.10000E+01 volume  0.34660E-03 ppm1      8.802 ppm2      1.082 CV     1
 ASSI {  528}
   (( segid "ATXH" and resid 39   and name HB2 ))
   (( segid "ATXH" and resid 40   and name HN  ))
      4.300     2.300     1.700 peak   528 spectrum    1 weight  0.10000E+01 volume  0.34440E-03 ppm1      8.606 ppm2      2.327 CV     1
 ASSI {  529}
   (  segid "ATXH" and resid 3    and name HB% )
   (( segid "ATXH" and resid 52   and name HN  ))
      3.900     1.900     1.900 peak   529 spectrum    1 weight  0.10000E+01 volume  0.33890E-03 ppm1      8.772 ppm2      1.359 CV     1
 ASSI {  530}
   (( segid "ATXH" and resid 6    and name HG2 ))
   (( segid "ATXH" and resid 6    and name HE22))
      4.400     2.400     1.600 peak   530 spectrum    1 weight  0.10000E+01 volume  0.33780E-03 ppm1      6.700 ppm2      2.201 CV     1
 ASSI {  531}
   (( segid "ATXH" and resid 54   and name HA  ))
   (( segid "ATXH" and resid 53   and name HN  ))
      4.100     2.100     1.900 peak   531 spectrum    1 weight  0.10000E+01 volume  0.33780E-03 ppm1      7.801 ppm2      4.646 CV     1
 ASSI {  532}
   (( segid "ATXH" and resid 58   and name HA  ))
   (( segid "ATXH" and resid 62   and name HN  ))
      3.900     1.900     1.900 peak   532 spectrum    1 weight  0.10000E+01 volume  0.33560E-03 ppm1      7.189 ppm2      4.361 CV     1
 ASSI {  533}
   (( segid "ATXH" and resid 4    and name HG3 ))
   (( segid "ATXH" and resid 5    and name HN  ))
      4.400     2.400     1.600 peak   533 spectrum    1 weight  0.10000E+01 volume  0.33450E-03 ppm1      9.157 ppm2      2.448 CV     1
 ASSI {  534}
   (( segid "ATXH" and resid 24   and name HA  ))
   (( segid "ATXH" and resid 25   and name HN  ))
      3.900     1.900     1.900 peak   534 spectrum    1 weight  0.10000E+01 volume  0.33119E-03 ppm1      8.209 ppm2      3.629 CV     1
 ASSI {  536}
   (  segid "ATXH" and resid 48   and name HG2%)
   (( segid "ATXH" and resid 34   and name HN  ))
      4.000     2.000     2.000 peak   536 spectrum    1 weight  0.10000E+01 volume  0.32679E-03 ppm1      8.783 ppm2      1.107 CV     1
 ASSI {  538}
   (( segid "ATXH" and resid 60   and name HN  ))
   (( segid "ATXH" and resid 62   and name HN  ))
      4.000     2.000     2.000 peak   538 spectrum    1 weight  0.10000E+01 volume  0.32019E-03 ppm1      7.191 ppm2      8.526 CV     1
 ASSI {  539}
   (( segid "ATXH" and resid 63   and name HG13))
   (( segid "ATXH" and resid 62   and name HN  ))
      4.300     2.300     1.700 peak   539 spectrum    1 weight  0.10000E+01 volume  0.31909E-03 ppm1      7.189 ppm2      0.576 CV     1
 ASSI {  540}
   (( segid "ATXH" and resid 26   and name HA  ))
   (( segid "ATXH" and resid 27   and name HN  ))
      3.900     1.900     1.900 peak   540 spectrum    1 weight  0.10000E+01 volume  0.31909E-03 ppm1      8.178 ppm2      4.143 CV     1
 ASSI {  541}
   (( segid "ATXH" and resid 50   and name HB3 ))
   (( segid "ATXH" and resid 51   and name HN  ))
      4.200     2.200     1.800 peak   541 spectrum    1 weight  0.10000E+01 volume  0.31799E-03 ppm1      8.792 ppm2      2.467 CV     1
 ASSI {  542}
   (  segid "ATXH" and resid 41   and name HB% )
   (( segid "ATXH" and resid 43   and name HN  ))
      4.400     2.500     1.600 peak   542 spectrum    1 weight  0.10000E+01 volume  0.31689E-03 ppm1      7.939 ppm2      1.388 CV     1
 ASSI {  543}
   (( segid "ATXH" and resid 45   and name HA  ))
   (( segid "ATXH" and resid 46   and name HN  ))
      3.700     1.700     1.700 peak   543 spectrum    1 weight  0.10000E+01 volume  0.31469E-03 ppm1      9.024 ppm2      4.460 CV     1
 ASSI {  544}
   (( segid "ATXH" and resid 23   and name HN  ))
   (( segid "ATXH" and resid 21   and name HN  ))
      4.100     2.100     1.900 peak   544 spectrum    1 weight  0.10000E+01 volume  0.31469E-03 ppm1      7.836 ppm2      8.271 CV     1
 ASSI {  545}
   (( segid "ATXH" and resid 12   and name HB3 ))
   (( segid "ATXH" and resid 13   and name HN  ))
      4.200     2.200     1.800 peak   545 spectrum    1 weight  0.10000E+01 volume  0.31139E-03 ppm1      8.566 ppm2      1.977 CV     1
 ASSI {  547}
   (  segid "ATXH" and resid 48   and name HG2%)
   (( segid "ATXH" and resid 6    and name HE21))
      3.600     1.600     1.600 peak   547 spectrum    1 weight  0.10000E+01 volume  0.31139E-03 ppm1      7.327 ppm2      1.108 CV     1
 ASSI {  548}
   (( segid "ATXH" and resid 50   and name HB2 ))
   (( segid "ATXH" and resid 51   and name HN  ))
      4.600     2.700     1.400 peak   548 spectrum    1 weight  0.10000E+01 volume  0.31029E-03 ppm1      8.792 ppm2      2.947 CV     1
 ASSI {  549}
   (( segid "ATXH" and resid 23   and name HA  ))
   (( segid "ATXH" and resid 27   and name HN  ))
      4.000     2.000     2.000 peak   549 spectrum    1 weight  0.10000E+01 volume  0.30699E-03 ppm1      8.174 ppm2      3.398 CV     1
 ASSI {  550}
   (( segid "ATXH" and resid 54   and name HB  ))
   (( segid "ATXH" and resid 53   and name HN  ))
      4.600     2.600     1.400 peak   550 spectrum    1 weight  0.10000E+01 volume  0.30589E-03 ppm1      7.801 ppm2      2.393 CV     1
 ASSI {  551}
   (( segid "ATXH" and resid 69   and name HB2 ))
   (( segid "ATXH" and resid 12   and name HN  ))
      4.000     2.000     2.000 peak   551 spectrum    1 weight  0.10000E+01 volume  0.30259E-03 ppm1      9.296 ppm2      2.599 CV     1
 ASSI {  552}
   (  segid "ATXH" and resid 38   and name HG1%)
   (( segid "ATXH" and resid 40   and name HN  ))
      3.900     1.900     1.900 peak   552 spectrum    1 weight  0.10000E+01 volume  0.30259E-03 ppm1      8.606 ppm2      0.990 CV     1
 ASSI {  553}
   (( segid "ATXH" and resid 61   and name HA  ))
   (( segid "ATXH" and resid 65   and name HN  ))
      3.900     1.900     1.900 peak   553 spectrum    1 weight  0.10000E+01 volume  0.30149E-03 ppm1      8.426 ppm2      4.207 CV     1
 ASSI {  555}
   (( segid "ATXH" and resid 35   and name HN  ))
   (( segid "ATXH" and resid 36   and name HN  ))
      4.300     2.300     1.700 peak   555 spectrum    1 weight  0.10000E+01 volume  0.29048E-03 ppm1      8.666 ppm2      7.516 CV     1
 ASSI {  557}
   (( segid "ATXH" and resid 31   and name HN  ))
   (( segid "ATXH" and resid 30   and name HN  ))
      4.500     2.600     1.500 peak   557 spectrum    1 weight  0.10000E+01 volume  0.28498E-03 ppm1      7.447 ppm2      8.598 CV     1
 ASSI {  559}
   (( segid "ATXH" and resid 46   and name HA  ))
   (( segid "ATXH" and resid 9    and name HN  ))
      4.100     2.100     1.900 peak   559 spectrum    1 weight  0.10000E+01 volume  0.28279E-03 ppm1      9.294 ppm2      5.232 CV     1
 ASSI {  560}
   (  segid "ATXH" and resid 22   and name HB% )
   (( segid "ATXH" and resid 21   and name HN  ))
      4.500     2.500     1.500 peak   560 spectrum    1 weight  0.10000E+01 volume  0.28279E-03 ppm1      7.834 ppm2      1.598 CV     1
 ASSI {  561}
   (  segid "ATXH" and resid 41   and name HB% )
   (( segid "ATXH" and resid 44   and name HN  ))
      4.500     2.500     1.500 peak   561 spectrum    1 weight  0.10000E+01 volume  0.28168E-03 ppm1      7.601 ppm2      1.390 CV     1
 ASSI {  562}
   (( segid "ATXH" and resid 11   and name HN  ))
   (( segid "ATXH" and resid 10   and name HN  ))
      4.400     2.400     1.600 peak   562 spectrum    1 weight  0.10000E+01 volume  0.27948E-03 ppm1      9.030 ppm2      8.530 CV     1
 ASSI {  563}
   (( segid "ATXH" and resid 60   and name HA  ))
   (( segid "ATXH" and resid 64   and name HN  ))
      4.100     2.100     1.900 peak   563 spectrum    1 weight  0.10000E+01 volume  0.27728E-03 ppm1      9.006 ppm2      3.253 CV     1
 ASSI {  564}
   (( segid "ATXH" and resid 5    and name HG2 ))
   (( segid "ATXH" and resid 51   and name HN  ))
      4.000     2.000     2.000 peak   564 spectrum    1 weight  0.10000E+01 volume  0.27508E-03 ppm1      8.793 ppm2      2.195 CV     1
 ASSI {  566}
   (( segid "ATXH" and resid 41   and name HN  ))
   (( segid "ATXH" and resid 42   and name HN  ))
      3.900     1.900     1.900 peak   566 spectrum    1 weight  0.10000E+01 volume  0.27398E-03 ppm1      7.560 ppm2      8.688 CV     1
 ASSI {  567}
   (( segid "ATXH" and resid 52   and name HB3 ))
   (( segid "ATXH" and resid 53   and name HN  ))
      4.100     2.100     1.900 peak   567 spectrum    1 weight  0.10000E+01 volume  0.27178E-03 ppm1      7.802 ppm2      3.843 CV     1
 ASSI {  568}
   (  segid "ATXH" and resid 41   and name HB% )
   (( segid "ATXH" and resid 41   and name HN  ))
      4.000     2.000     2.000 peak   568 spectrum    1 weight  0.10000E+01 volume  0.27068E-03 ppm1      8.697 ppm2      1.375 CV     1
 ASSI {  569}
   (( segid "ATXH" and resid 46   and name HB3 ))
   (( segid "ATXH" and resid 46   and name HN  ))
      3.900     1.900     1.900 peak   569 spectrum    1 weight  0.10000E+01 volume  0.26958E-03 ppm1      9.022 ppm2      1.937 CV     1
 OR {  569}
   (( segid "ATXH" and resid 46   and name HB2 ))
   (( segid "ATXH" and resid 46   and name HN  ))
 ASSI {  572}
   (( segid "ATXH" and resid 7    and name HB2 ))
   (( segid "ATXH" and resid 8    and name HN  ))
      4.600     2.600     1.400 peak   572 spectrum    1 weight  0.10000E+01 volume  0.25748E-03 ppm1      8.804 ppm2      1.573 CV     1
 ASSI {  578}
   (( segid "ATXH" and resid 68   and name HN  ))
   (( segid "ATXH" and resid 69   and name HN  ))
      4.400     2.400     1.600 peak   578 spectrum    1 weight  0.10000E+01 volume  0.23987E-03 ppm1      7.900 ppm2      6.767 CV     1
 ASSI {  579}
   (( segid "ATXH" and resid 4    and name HG2 ))
   (( segid "ATXH" and resid 5    and name HN  ))
      4.700     2.700     1.300 peak   579 spectrum    1 weight  0.10000E+01 volume  0.23877E-03 ppm1      9.165 ppm2      2.639 CV     1
 ASSI {  580}
   (  segid "ATXH" and resid 3    and name HB% )
   (( segid "ATXH" and resid 3    and name HN  ))
      4.100     2.100     1.900 peak   580 spectrum    1 weight  0.10000E+01 volume  0.23767E-03 ppm1      8.441 ppm2      1.365 CV     1
 ASSI {  581}
   (( segid "ATXH" and resid 44   and name HB  ))
   (( segid "ATXH" and resid 9    and name HN  ))
      4.200     2.200     1.800 peak   581 spectrum    1 weight  0.10000E+01 volume  0.23657E-03 ppm1      9.292 ppm2      3.986 CV     1
 ASSI {  582}
   (( segid "ATXH" and resid 36   and name HA  ))
   (( segid "ATXH" and resid 37   and name HN  ))
      3.900     1.900     1.900 peak   582 spectrum    1 weight  0.10000E+01 volume  0.23437E-03 ppm1      9.027 ppm2      4.941 CV     1
 ASSI {  583}
   (( segid "ATXH" and resid 29   and name HG2 ))
   (( segid "ATXH" and resid 30   and name HN  ))
      3.800     1.800     1.800 peak   583 spectrum    1 weight  0.10000E+01 volume  0.23217E-03 ppm1      7.447 ppm2      2.478 CV     1
 ASSI {  584}
   (( segid "ATXH" and resid 50   and name HB2 ))
   (( segid "ATXH" and resid 52   and name HN  ))
      4.500     2.500     1.500 peak   584 spectrum    1 weight  0.10000E+01 volume  0.23217E-03 ppm1      8.772 ppm2      2.945 CV     1
 ASSI {  585}
   (( segid "ATXH" and resid 43   and name HA1 ))
   (( segid "ATXH" and resid 11   and name HN  ))
      4.100     2.100     1.900 peak   585 spectrum    1 weight  0.10000E+01 volume  0.23217E-03 ppm1      8.527 ppm2      3.617 CV     1
 ASSI {  586}
   (( segid "ATXH" and resid 62   and name HN  ))
   (( segid "ATXH" and resid 64   and name HN  ))
      4.300     2.300     1.700 peak   586 spectrum    1 weight  0.10000E+01 volume  0.23107E-03 ppm1      9.004 ppm2      7.192 CV     1
 ASSI {  587}
   (( segid "ATXH" and resid 6    and name HB3 ))
   (( segid "ATXH" and resid 6    and name HE22))
      4.500     2.500     1.500 peak   587 spectrum    1 weight  0.10000E+01 volume  0.22997E-03 ppm1      6.699 ppm2      1.927 CV     1
 ASSI {  590}
   (( segid "ATXH" and resid 23   and name HA  ))
   (( segid "ATXH" and resid 25   and name HN  ))
      4.300     2.300     1.700 peak   590 spectrum    1 weight  0.10000E+01 volume  0.22336E-03 ppm1      8.204 ppm2      3.394 CV     1
 ASSI {  591}
   (  segid "ATXH" and resid 61   and name HB% )
   (( segid "ATXH" and resid 63   and name HN  ))
      4.600     2.600     1.400 peak   591 spectrum    1 weight  0.10000E+01 volume  0.22116E-03 ppm1      7.635 ppm2      1.476 CV     1
 ASSI {  592}
   (( segid "ATXH" and resid 24   and name HN  ))
   (( segid "ATXH" and resid 26   and name HN  ))
      4.200     2.200     1.800 peak   592 spectrum    1 weight  0.10000E+01 volume  0.21897E-03 ppm1      7.527 ppm2      8.619 CV     1
 ASSI {  593}
   (( segid "ATXH" and resid 56   and name HN  ))
   (( segid "ATXH" and resid 58   and name HN  ))
      4.400     2.400     1.600 peak   593 spectrum    1 weight  0.10000E+01 volume  0.21787E-03 ppm1      7.578 ppm2      8.790 CV     1
 ASSI {  594}
   (( segid "ATXH" and resid 28   and name HG2 ))
   (( segid "ATXH" and resid 29   and name HN  ))
      4.400     2.400     1.600 peak   594 spectrum    1 weight  0.10000E+01 volume  0.21346E-03 ppm1      6.865 ppm2      1.486 CV     1
 ASSI {  595}
   (( segid "ATXH" and resid 28   and name HE2 ))
   (( segid "ATXH" and resid 36   and name HN  ))
      4.100     2.100     1.900 peak   595 spectrum    1 weight  0.10000E+01 volume  0.21236E-03 ppm1      8.670 ppm2      2.936 CV     1
 ASSI {  597}
   (( segid "ATXH" and resid 62   and name HN  ))
   (( segid "ATXH" and resid 65   and name HN  ))
      4.300     2.300     1.700 peak   597 spectrum    1 weight  0.10000E+01 volume  0.20576E-03 ppm1      8.436 ppm2      7.173 CV     1
 ASSI {  598}
   (  segid "ATXH" and resid 7    and name HD2%)
   (( segid "ATXH" and resid 8    and name HN  ))
      4.400     2.400     1.600 peak   598 spectrum    1 weight  0.10000E+01 volume  0.20576E-03 ppm1      8.805 ppm2      0.861 CV     1
 ASSI {  599}
   (( segid "ATXH" and resid 62   and name HA  ))
   (( segid "ATXH" and resid 63   and name HN  ))
      4.200     2.200     1.800 peak   599 spectrum    1 weight  0.10000E+01 volume  0.20466E-03 ppm1      7.634 ppm2      3.868 CV     1
 ASSI {  600}
   (( segid "ATXH" and resid 29   and name HN  ))
   (( segid "ATXH" and resid 27   and name HN  ))
      4.300     2.300     1.700 peak   600 spectrum    1 weight  0.10000E+01 volume  0.20356E-03 ppm1      8.179 ppm2      6.869 CV     1
 ASSI {  602}
   (  segid "ATXH" and resid 45   and name HG2%)
   (( segid "ATXH" and resid 39   and name HN  ))
      4.200     2.300     1.800 peak   602 spectrum    1 weight  0.10000E+01 volume  0.20136E-03 ppm1      8.890 ppm2      0.593 CV     1
 ASSI {  604}
   (  segid "ATXH" and resid 20   and name HG2%)
   (( segid "ATXH" and resid 22   and name HN  ))
      4.500     2.500     1.500 peak   604 spectrum    1 weight  0.10000E+01 volume  0.20026E-03 ppm1      8.537 ppm2      0.897 CV     1
 ASSI {  605}
   (( segid "ATXH" and resid 6    and name HN  ))
   (( segid "ATXH" and resid 5    and name HN  ))
      4.500     2.600     1.500 peak   605 spectrum    1 weight  0.10000E+01 volume  0.19256E-03 ppm1      9.163 ppm2      8.631 CV     1
 ASSI {  606}
   (( segid "ATXH" and resid 64   and name HB3 ))
   (( segid "ATXH" and resid 68   and name HN  ))
      4.500     2.600     1.500 peak   606 spectrum    1 weight  0.10000E+01 volume  0.19036E-03 ppm1      6.772 ppm2      2.017 CV     1
 ASSI {  607}
   (( segid "ATXH" and resid 39   and name HB3 ))
   (( segid "ATXH" and resid 40   and name HN  ))
      4.500     2.600     1.500 peak   607 spectrum    1 weight  0.10000E+01 volume  0.18926E-03 ppm1      8.608 ppm2      2.058 CV     1
 OR {  607}
   (( segid "ATXH" and resid 39   and name HG3 ))
   (( segid "ATXH" and resid 40   and name HN  ))
 ASSI {  608}
   (( segid "ATXH" and resid 52   and name HB2 ))
   (( segid "ATXH" and resid 53   and name HN  ))
      4.600     2.600     1.400 peak   608 spectrum    1 weight  0.10000E+01 volume  0.18155E-03 ppm1      7.806 ppm2      3.997 CV     1
 ASSI {  609}
   (( segid "ATXH" and resid 66   and name HA  ))
   (( segid "ATXH" and resid 68   and name HN  ))
      5.100     3.200     0.900 peak   609 spectrum    1 weight  0.10000E+01 volume  0.18155E-03 ppm1      6.770 ppm2      4.264 CV     1
 ASSI {  610}
   (( segid "ATXH" and resid 20   and name HN  ))
   (( segid "ATXH" and resid 22   and name HN  ))
      4.300     2.400     1.700 peak   610 spectrum    1 weight  0.10000E+01 volume  0.18155E-03 ppm1      8.535 ppm2      7.011 CV     1
 ASSI {  611}
   (  segid "ATXH" and resid 40   and name HD1%)
   (( segid "ATXH" and resid 40   and name HN  ))
      4.700     2.800     1.300 peak   611 spectrum    1 weight  0.10000E+01 volume  0.18045E-03 ppm1      8.609 ppm2      0.787 CV     1
 OR {  611}
   (  segid "ATXH" and resid 40   and name HD2%)
   (( segid "ATXH" and resid 40   and name HN  ))
 ASSI {  612}
   (  segid "ATXH" and resid 40   and name HD1%)
   (( segid "ATXH" and resid 17   and name HN  ))
      3.900     1.900     1.900 peak   612 spectrum    1 weight  0.10000E+01 volume  0.17935E-03 ppm1      8.524 ppm2      0.850 CV     1
 ASSI {  613}
   (( segid "ATXH" and resid 49   and name HB  ))
   (( segid "ATXH" and resid 54   and name HN  ))
      4.800     2.900     1.200 peak   613 spectrum    1 weight  0.10000E+01 volume  0.17495E-03 ppm1      8.020 ppm2      1.558 CV     1
 ASSI {  615}
   (  segid "ATXH" and resid 48   and name HG2%)
   (( segid "ATXH" and resid 7    and name HN  ))
      4.900     2.900     1.100 peak   615 spectrum    1 weight  0.10000E+01 volume  0.16945E-03 ppm1      9.254 ppm2      1.094 CV     1
 ASSI {  616}
   (( segid "ATXH" and resid 42   and name HA  ))
   (( segid "ATXH" and resid 44   and name HN  ))
      4.700     2.800     1.300 peak   616 spectrum    1 weight  0.10000E+01 volume  0.15844E-03 ppm1      7.593 ppm2      4.212 CV     1
 ASSI {  617}
   (( segid "ATXH" and resid 65   and name HB2 ))
   (( segid "ATXH" and resid 62   and name HN  ))
      4.100     2.100     1.900 peak   617 spectrum    1 weight  0.10000E+01 volume  0.15844E-03 ppm1      7.191 ppm2      2.914 CV     1
 ASSI {  618}
   (( segid "ATXH" and resid 21   and name HA  ))
   (( segid "ATXH" and resid 24   and name HN  ))
      4.500     2.500     1.500 peak   618 spectrum    1 weight  0.10000E+01 volume  0.15625E-03 ppm1      8.600 ppm2      4.442 CV     1
 ASSI {  619}
   (( segid "ATXH" and resid 23   and name HA  ))
   (( segid "ATXH" and resid 22   and name HN  ))
      4.800     2.900     1.200 peak   619 spectrum    1 weight  0.10000E+01 volume  0.15515E-03 ppm1      8.522 ppm2      3.346 CV     1
 ASSI {  621}
   (( segid "ATXH" and resid 47   and name HA  ))
   (( segid "ATXH" and resid 35   and name HN  ))
      4.800     2.900     1.200 peak   621 spectrum    1 weight  0.10000E+01 volume  0.15405E-03 ppm1      7.510 ppm2      5.058 CV     1
 ASSI {  622}
   (( segid "ATXH" and resid 61   and name HA  ))
   (( segid "ATXH" and resid 63   and name HN  ))
      4.500     2.500     1.500 peak   622 spectrum    1 weight  0.10000E+01 volume  0.15295E-03 ppm1      7.636 ppm2      4.190 CV     1
 ASSI {  623}
   (  segid "ATXH" and resid 70   and name HG1%)
   (( segid "ATXH" and resid 69   and name HN  ))
      4.100     2.100     1.900 peak   623 spectrum    1 weight  0.10000E+01 volume  0.15295E-03 ppm1      7.902 ppm2      0.987 CV     1
 ASSI {  624}
   (( segid "ATXH" and resid 58   and name HB3 ))
   (( segid "ATXH" and resid 61   and name HN  ))
      4.600     2.600     1.400 peak   624 spectrum    1 weight  0.10000E+01 volume  0.14854E-03 ppm1      7.705 ppm2      2.608 CV     1
 ASSI {  625}
   (( segid "ATXH" and resid 68   and name HB2 ))
   (( segid "ATXH" and resid 67   and name HN  ))
      5.000     3.100     1.000 peak   625 spectrum    1 weight  0.10000E+01 volume  0.14854E-03 ppm1      7.882 ppm2      2.946 CV     1
 ASSI {  626}
   (( segid "ATXH" and resid 65   and name HN  ))
   (( segid "ATXH" and resid 67   and name HN  ))
      4.700     2.800     1.300 peak   626 spectrum    1 weight  0.10000E+01 volume  0.14854E-03 ppm1      7.881 ppm2      8.430 CV     1
 ASSI {  627}
   (  segid "ATXH" and resid 54   and name HG1%)
   (( segid "ATXH" and resid 53   and name HN  ))
      5.100     3.200     0.900 peak   627 spectrum    1 weight  0.10000E+01 volume  0.14634E-03 ppm1      7.800 ppm2      1.177 CV     1
 ASSI {  628}
   (( segid "ATXH" and resid 28   and name HA  ))
   (( segid "ATXH" and resid 33   and name HN  ))
      5.200     3.300     0.800 peak   628 spectrum    1 weight  0.10000E+01 volume  0.14084E-03 ppm1      7.524 ppm2      3.798 CV     1
 ASSI {  629}
   (  segid "ATXH" and resid 9    and name HD2%)
   (( segid "ATXH" and resid 9    and name HN  ))
      4.400     2.400     1.600 peak   629 spectrum    1 weight  0.10000E+01 volume  0.13974E-03 ppm1      9.295 ppm2      0.746 CV     1
 ASSI {  630}
   (( segid "ATXH" and resid 50   and name HB3 ))
   (( segid "ATXH" and resid 52   and name HN  ))
      4.400     2.400     1.600 peak   630 spectrum    1 weight  0.10000E+01 volume  0.13864E-03 ppm1      8.770 ppm2      2.471 CV     1
 ASSI {  631}
   (( segid "ATXH" and resid 12   and name HN  ))
   (( segid "ATXH" and resid 11   and name HN  ))
      4.900     3.000     1.100 peak   631 spectrum    1 weight  0.10000E+01 volume  0.13754E-03 ppm1      8.530 ppm2      9.296 CV     1
 ASSI {  632}
   (( segid "ATXH" and resid 8    and name HB  ))
   (( segid "ATXH" and resid 9    and name HN  ))
      4.900     3.000     1.100 peak   632 spectrum    1 weight  0.10000E+01 volume  0.13644E-03 ppm1      9.295 ppm2      3.882 CV     1
 ASSI {  635}
   (( segid "ATXH" and resid 16   and name HB3 ))
   (( segid "ATXH" and resid 17   and name HN  ))
      4.500     2.600     1.500 peak   635 spectrum    1 weight  0.10000E+01 volume  0.13424E-03 ppm1      8.528 ppm2      1.893 CV     1
 ASSI {  636}
   (( segid "ATXH" and resid 10   and name HB2 ))
   (( segid "ATXH" and resid 11   and name HN  ))
      4.600     2.600     1.400 peak   636 spectrum    1 weight  0.10000E+01 volume  0.13314E-03 ppm1      8.526 ppm2      2.082 CV     1
 ASSI {  637}
   (( segid "ATXH" and resid 37   and name HN  ))
   (( segid "ATXH" and resid 38   and name HN  ))
      4.600     2.600     1.400 peak   637 spectrum    1 weight  0.10000E+01 volume  0.13314E-03 ppm1      9.835 ppm2      8.996 CV     1
 ASSI {  639}
   (  segid "ATXH" and resid 48   and name HG2%)
   (( segid "ATXH" and resid 6    and name HE22))
      4.200     2.200     1.800 peak   639 spectrum    1 weight  0.10000E+01 volume  0.13094E-03 ppm1      6.697 ppm2      1.111 CV     1
 ASSI {  640}
   (( segid "ATXH" and resid 11   and name HN  ))
   (( segid "ATXH" and resid 44   and name HN  ))
      4.800     2.900     1.200 peak   640 spectrum    1 weight  0.10000E+01 volume  0.12874E-03 ppm1      7.586 ppm2      8.525 CV     1
 ASSI {  641}
   (  segid "ATXH" and resid 8    and name HG2%)
   (( segid "ATXH" and resid 47   and name HN  ))
      5.000     3.100     1.000 peak   641 spectrum    1 weight  0.10000E+01 volume  0.12654E-03 ppm1      9.157 ppm2      1.074 CV     1
 ASSI {  642}
   (( segid "ATXH" and resid 66   and name HB2 ))
   (( segid "ATXH" and resid 67   and name HN  ))
      4.300     2.400     1.700 peak   642 spectrum    1 weight  0.10000E+01 volume  0.12213E-03 ppm1      7.873 ppm2      2.529 CV     1
 ASSI {  643}
   (  segid "ATXH" and resid 70   and name HG1%)
   (( segid "ATXH" and resid 12   and name HN  ))
      4.600     2.700     1.400 peak   643 spectrum    1 weight  0.10000E+01 volume  0.12213E-03 ppm1      9.281 ppm2      0.967 CV     1
 ASSI {  644}
   (( segid "ATXH" and resid 20   and name HB  ))
   (( segid "ATXH" and resid 22   and name HN  ))
      5.100     3.200     0.900 peak   644 spectrum    1 weight  0.10000E+01 volume  0.11773E-03 ppm1      8.527 ppm2      2.248 CV     1
 ASSI {  645}
   (( segid "ATXH" and resid 56   and name HN  ))
   (( segid "ATXH" and resid 55   and name HN  ))
      5.000     3.100     1.000 peak   645 spectrum    1 weight  0.10000E+01 volume  0.11663E-03 ppm1      8.077 ppm2      8.795 CV     1
 ASSI {  646}
   (( segid "ATXH" and resid 18   and name HA  ))
   (( segid "ATXH" and resid 20   and name HN  ))
      4.600     2.700     1.400 peak   646 spectrum    1 weight  0.10000E+01 volume  0.11554E-03 ppm1      7.025 ppm2      4.518 CV     1
 ASSI {  648}
   (( segid "ATXH" and resid 3    and name HA  ))
   (( segid "ATXH" and resid 3    and name HN  ))
      4.600     2.600     1.400 peak   648 spectrum    1 weight  0.10000E+01 volume  0.11003E-03 ppm1      8.431 ppm2      4.406 CV     1
 ASSI {  650}
   (( segid "ATXH" and resid 39   and name HN  ))
   (( segid "ATXH" and resid 43   and name HN  ))
      4.900     3.000     1.100 peak   650 spectrum    1 weight  0.10000E+01 volume  0.10871E-03 ppm1      7.938 ppm2      8.899 CV     1
 ASSI {  651}
   (( segid "ATXH" and resid 45   and name HB  ))
   (( segid "ATXH" and resid 9    and name HN  ))
      4.600     2.600     1.400 peak   651 spectrum    1 weight  0.10000E+01 volume  0.10849E-03 ppm1      9.294 ppm2      1.728 CV     1
 ASSI {  653}
   (( segid "ATXH" and resid 18   and name HA  ))
   (( segid "ATXH" and resid 19   and name HN  ))
      4.800     2.800     1.200 peak   653 spectrum    1 weight  0.10000E+01 volume  0.10200E-03 ppm1      7.836 ppm2      4.509 CV     1
 ASSI {  657}
   (( segid "ATXH" and resid 44   and name HA  ))
   (( segid "ATXH" and resid 9    and name HN  ))
      5.200     3.400     0.800 peak   657 spectrum    1 weight  0.10000E+01 volume  0.92315E-04 ppm1      9.303 ppm2      5.481 CV     1
 ASSI {  659}
   (( segid "ATXH" and resid 5    and name HA  ))
   (( segid "ATXH" and resid 49   and name HN  ))
      5.000     3.100     1.000 peak   659 spectrum    1 weight  0.10000E+01 volume  0.90775E-04 ppm1      9.258 ppm2      4.641 CV     1
 ASSI {  661}
   (  segid "ATXH" and resid 48   and name HG2%)
   (( segid "ATXH" and resid 4    and name HN  ))
      5.400     3.700     0.600 peak   661 spectrum    1 weight  0.10000E+01 volume  0.83401E-04 ppm1      8.156 ppm2      1.133 CV     1
 ASSI {  662}
   (( segid "ATXH" and resid 64   and name HN  ))
   (( segid "ATXH" and resid 68   and name HN  ))
      5.600     3.900     0.400 peak   662 spectrum    1 weight  0.10000E+01 volume  0.81646E-04 ppm1      6.782 ppm2      9.024 CV     1
 ASSI {  664}
   (( segid "ATXH" and resid 29   and name HG3 ))
   (( segid "ATXH" and resid 26   and name HN  ))
      4.600     2.700     1.400 peak   664 spectrum    1 weight  0.10000E+01 volume  0.68330E-04 ppm1      7.515 ppm2      2.334 CV     1
 ASSI {  665}
   (( segid "ATXH" and resid 44   and name HA  ))
   (( segid "ATXH" and resid 43   and name HN  ))
      5.700     4.000     0.300 peak   665 spectrum    1 weight  0.10000E+01 volume  0.60187E-04 ppm1      7.946 ppm2      5.507 CV     1
 ASSI {  666}
   (( segid "ATXH" and resid 12   and name HN  ))
   (( segid "ATXH" and resid 13   and name HN  ))
      5.600     4.000     0.400 peak   666 spectrum    1 weight  0.10000E+01 volume  0.52045E-04 ppm1      8.565 ppm2      9.242 CV     1
 ASSI {  667}
   (( segid "ATXH" and resid 49   and name HA  ))
   (( segid "ATXH" and resid 35   and name HN  ))
      5.700     4.000     0.300 peak   667 spectrum    1 weight  0.10000E+01 volume  0.51825E-04 ppm1      7.508 ppm2      5.274 CV     1
 ASSI {  668}
   (( segid "ATXH" and resid 50   and name HB2 ))
   (( segid "ATXH" and resid 32   and name HN  ))
      6.000     4.400     0.000 peak   668 spectrum    1 weight  0.10000E+01 volume  0.50945E-04 ppm1      8.556 ppm2      2.947 CV     1
 ASSI {  669}
   (( segid "ATXH" and resid 10   and name HB3 ))
   (( segid "ATXH" and resid 11   and name HN  ))
      5.900     4.400     0.100 peak   669 spectrum    1 weight  0.10000E+01 volume  0.50064E-04 ppm1      8.527 ppm2      1.991 CV     1
 ASSI {  672}
   (( segid "ATXH" and resid 64   and name HN  ))
   (( segid "ATXH" and resid 61   and name HN  ))
      5.500     3.800     0.500 peak   672 spectrum    1 weight  0.10000E+01 volume  0.39171E-04 ppm1      7.711 ppm2      9.020 CV     1
 ASSI {  673}
   (( segid "ATXH" and resid 24   and name HA  ))
   (( segid "ATXH" and resid 24   and name HN  ))
      5.600     3.900     0.400 peak   673 spectrum    1 weight  0.10000E+01 volume  0.32240E-04 ppm1      8.600 ppm2      3.629 CV     1
 ASSI {  674}
   (  segid "ATXH" and resid 23   and name HG2%)
   (( segid "ATXH" and resid 26   and name HN  ))
      6.000     4.500     0.000 peak   674 spectrum    1 weight  0.10000E+01 volume  0.30479E-04 ppm1      7.534 ppm2      0.529 CV     1
 ASSI {  675}
   (( segid "ATXH" and resid 71   and name HN  ))
   (( segid "ATXH" and resid 12   and name HN  ))
      5.400     3.600     0.600 peak   675 spectrum    1 weight  0.10000E+01 volume  0.28828E-04 ppm1      9.290 ppm2      8.818 CV     1
 ASSI {  677}
   (( segid "ATXH" and resid 60   and name HA  ))
   (( segid "ATXH" and resid 62   and name HN  ))
      6.000     6.000     0.000 peak   677 spectrum    1 weight  0.10000E+01 volume  0.10123E-04 ppm1      7.191 ppm2      3.259 CV     1
 ASSI {  678}
   (( segid "ATXH" and resid 20   and name HA  ))
   (( segid "ATXH" and resid 24   and name HN  ))
      6.000     6.000     0.000 peak   678 spectrum    1 weight  0.10000E+01 volume  0.88689E-05 ppm1      8.599 ppm2      3.234 CV     1
 ASSI {  679}
   (( segid "ATXH" and resid 8    and name HN  ))
   (( segid "ATXH" and resid 9    and name HN  ))
      6.000     6.000     0.000 peak   679 spectrum    1 weight  0.10000E+01 volume  0.11444E-05 ppm1      9.308 ppm2      8.804 CV     1
 ASSI {    3}
   (( segid "ATXH" and resid 10   and name HB2 ))
   (( segid "ATXH" and resid 10   and name HG3 ))
      1.600     0.300     0.600 peak     3 spectrum    1 weight  0.10000E+01 volume  0.72638E-01 ppm1      2.259 ppm2      2.080 CV     1
 OR {    3}
   (( segid "ATXH" and resid 10   and name HB2 ))
   (( segid "ATXH" and resid 10   and name HG2 ))
 ASSI {    4}
   (  segid "ATXH" and resid 11   and name HG2%)
   (( segid "ATXH" and resid 44   and name HA  ))
      1.700     0.400     0.500 peak     4 spectrum    1 weight  0.10000E+01 volume  0.72280E-01 ppm1      5.488 ppm2      0.738 CV     1
 ASSI {    6}
   (( segid "ATXH" and resid 57   and name HA  ))
   (( segid "ATXH" and resid 57   and name HG3 ))
      1.700     0.400     0.500 peak     6 spectrum    1 weight  0.10000E+01 volume  0.48426E-01 ppm1      1.426 ppm2      3.853 CV     1
 OR {    6}
   (( segid "ATXH" and resid 57   and name HA  ))
   (( segid "ATXH" and resid 57   and name HG2 ))
 ASSI {   10}
   (( segid "ATXH" and resid 49   and name HG13))
   (( segid "ATXH" and resid 49   and name HG12))
      1.500     0.300     0.700 peak    10 spectrum    1 weight  0.10000E+01 volume  0.33589E-01 ppm1      0.873 ppm2      1.428 CV     1
 ASSI {   15}
   (  segid "ATXH" and resid 49   and name HG2%)
   (( segid "ATXH" and resid 49   and name HB  ))
      1.800     0.400     0.400 peak    15 spectrum    1 weight  0.10000E+01 volume  0.25518E-01 ppm1      1.564 ppm2      0.720 CV     1
 ASSI {   16}
   (( segid "ATXH" and resid 29   and name HB3 ))
   (( segid "ATXH" and resid 29   and name HG2 ))
      2.000     0.500     0.500 peak    16 spectrum    1 weight  0.10000E+01 volume  0.24806E-01 ppm1      2.438 ppm2      2.035 CV     1
 OR {   16}
   (( segid "ATXH" and resid 29   and name HB2 ))
   (( segid "ATXH" and resid 29   and name HG2 ))
 ASSI {   17}
   (( segid "ATXH" and resid 31   and name HB2 ))
   (( segid "ATXH" and resid 31   and name HB3 ))
      1.700     0.400     0.500 peak    17 spectrum    1 weight  0.10000E+01 volume  0.23500E-01 ppm1      2.646 ppm2      2.747 CV     1
 ASSI {   20}
   (( segid "ATXH" and resid 43   and name HA1 ))
   (( segid "ATXH" and resid 43   and name HA2 ))
      1.800     0.400     0.400 peak    20 spectrum    1 weight  0.10000E+01 volume  0.21483E-01 ppm1      4.053 ppm2      3.647 CV     1
 ASSI {   21}
   (( segid "ATXH" and resid 29   and name HG2 ))
   (( segid "ATXH" and resid 29   and name HA  ))
      2.000     0.500     0.500 peak    21 spectrum    1 weight  0.10000E+01 volume  0.20770E-01 ppm1      4.050 ppm2      2.450 CV     1
 ASSI {   23}
   (( segid "ATXH" and resid 6    and name HG3 ))
   (( segid "ATXH" and resid 6    and name HG2 ))
      1.800     0.400     0.400 peak    23 spectrum    1 weight  0.10000E+01 volume  0.20533E-01 ppm1      2.196 ppm2      1.994 CV     1
 ASSI {   24}
   (  segid "ATXH" and resid 47   and name HG1%)
   (( segid "ATXH" and resid 47   and name HB  ))
      2.000     0.500     0.500 peak    24 spectrum    1 weight  0.10000E+01 volume  0.19346E-01 ppm1      1.888 ppm2      0.853 CV     1
 OR {   24}
   (  segid "ATXH" and resid 47   and name HG2%)
   (( segid "ATXH" and resid 47   and name HB  ))
 ASSI {   25}
   (( segid "ATXH" and resid 52   and name HB3 ))
   (( segid "ATXH" and resid 52   and name HB2 ))
      1.800     0.400     0.400 peak    25 spectrum    1 weight  0.10000E+01 volume  0.18634E-01 ppm1      3.988 ppm2      3.841 CV     1
 ASSI {   26}
   (( segid "ATXH" and resid 65   and name HB3 ))
   (( segid "ATXH" and resid 65   and name HB2 ))
      1.800     0.400     0.400 peak    26 spectrum    1 weight  0.10000E+01 volume  0.18634E-01 ppm1      2.897 ppm2      2.663 CV     1
 ASSI {   27}
   (  segid "ATXH" and resid 7    and name HD2%)
   (( segid "ATXH" and resid 7    and name HB3 ))
      2.100     0.500     0.500 peak    27 spectrum    1 weight  0.10000E+01 volume  0.18634E-01 ppm1      1.401 ppm2      0.858 CV     1
 ASSI {   30}
   (  segid "ATXH" and resid 33   and name HG1%)
   (( segid "ATXH" and resid 33   and name HA  ))
      2.000     0.500     0.500 peak    30 spectrum    1 weight  0.10000E+01 volume  0.18278E-01 ppm1      4.084 ppm2      0.828 CV     1
 ASSI {   31}
   (( segid "ATXH" and resid 37   and name HD3 ))
   (( segid "ATXH" and resid 37   and name HE3 ))
      2.100     0.500     0.500 peak    31 spectrum    1 weight  0.10000E+01 volume  0.17922E-01 ppm1      2.870 ppm2      1.630 CV     1
 OR {   31}
   (( segid "ATXH" and resid 37   and name HD2 ))
   (( segid "ATXH" and resid 37   and name HE2 ))
 OR {   31}
   (( segid "ATXH" and resid 37   and name HD3 ))
   (( segid "ATXH" and resid 37   and name HE2 ))
 OR {   31}
   (( segid "ATXH" and resid 37   and name HD2 ))
   (( segid "ATXH" and resid 37   and name HE3 ))
 ASSI {   34}
   (( segid "ATXH" and resid 6    and name HB3 ))
   (( segid "ATXH" and resid 6    and name HG2 ))
      2.000     0.500     0.500 peak    34 spectrum    1 weight  0.10000E+01 volume  0.17210E-01 ppm1      2.211 ppm2      1.877 CV     1
 ASSI {   35}
   (( segid "ATXH" and resid 67   and name HA2 ))
   (( segid "ATXH" and resid 67   and name HA1 ))
      1.900     0.400     0.400 peak    35 spectrum    1 weight  0.10000E+01 volume  0.16379E-01 ppm1      3.557 ppm2      3.953 CV     1
 ASSI {   36}
   (  segid "ATXH" and resid 47   and name HG2%)
   (( segid "ATXH" and resid 47   and name HB  ))
      2.000     0.500     0.500 peak    36 spectrum    1 weight  0.10000E+01 volume  0.15786E-01 ppm1      1.885 ppm2      0.800 CV     1
 ASSI {   37}
   (( segid "ATXH" and resid 69   and name HB3 ))
   (( segid "ATXH" and resid 69   and name HB2 ))
      1.900     0.400     0.400 peak    37 spectrum    1 weight  0.10000E+01 volume  0.15786E-01 ppm1      2.598 ppm2      2.457 CV     1
 ASSI {   38}
   (( segid "ATXH" and resid 51   and name HB3 ))
   (( segid "ATXH" and resid 51   and name HB2 ))
      1.800     0.400     0.400 peak    38 spectrum    1 weight  0.10000E+01 volume  0.15786E-01 ppm1      4.197 ppm2      3.803 CV     1
 ASSI {   41}
   (( segid "ATXH" and resid 5    and name HB2 ))
   (( segid "ATXH" and resid 5    and name HB3 ))
      1.800     0.400     0.400 peak    41 spectrum    1 weight  0.10000E+01 volume  0.15549E-01 ppm1      1.827 ppm2      1.987 CV     1
 OR {   41}
   (( segid "ATXH" and resid 5    and name HG3 ))
   (( segid "ATXH" and resid 5    and name HB3 ))
 ASSI {   42}
   (  segid "ATXH" and resid 27   and name HG2%)
   (( segid "ATXH" and resid 27   and name HA  ))
      2.100     0.500     0.500 peak    42 spectrum    1 weight  0.10000E+01 volume  0.15549E-01 ppm1      3.704 ppm2      0.884 CV     1
 OR {   42}
   (  segid "ATXH" and resid 27   and name HG1%)
   (( segid "ATXH" and resid 27   and name HA  ))
 ASSI {   43}
   (( segid "ATXH" and resid 50   and name HB2 ))
   (( segid "ATXH" and resid 50   and name HB3 ))
      1.800     0.400     0.400 peak    43 spectrum    1 weight  0.10000E+01 volume  0.15311E-01 ppm1      2.464 ppm2      2.944 CV     1
 ASSI {   44}
   (( segid "ATXH" and resid 58   and name HB2 ))
   (( segid "ATXH" and resid 58   and name HB3 ))
      1.800     0.400     0.400 peak    44 spectrum    1 weight  0.10000E+01 volume  0.14955E-01 ppm1      2.594 ppm2      3.015 CV     1
 ASSI {   45}
   (  segid "ATXH" and resid 33   and name HG1%)
   (( segid "ATXH" and resid 33   and name HB  ))
      2.000     0.500     0.500 peak    45 spectrum    1 weight  0.10000E+01 volume  0.14955E-01 ppm1      2.266 ppm2      0.843 CV     1
 ASSI {   46}
   (( segid "ATXH" and resid 5    and name HB3 ))
   (( segid "ATXH" and resid 5    and name HB2 ))
      1.800     0.400     0.400 peak    46 spectrum    1 weight  0.10000E+01 volume  0.14836E-01 ppm1      1.987 ppm2      1.828 CV     1
 ASSI {   51}
   (( segid "ATXH" and resid 42   and name HB2 ))
   (( segid "ATXH" and resid 42   and name HA  ))
      2.200     0.600     0.600 peak    51 spectrum    1 weight  0.10000E+01 volume  0.14243E-01 ppm1      4.237 ppm2      2.107 CV     1
 OR {   51}
   (( segid "ATXH" and resid 42   and name HG2 ))
   (( segid "ATXH" and resid 42   and name HA  ))
 ASSI {   52}
   (( segid "ATXH" and resid 32   and name HA2 ))
   (( segid "ATXH" and resid 32   and name HA1 ))
      1.800     0.400     0.400 peak    52 spectrum    1 weight  0.10000E+01 volume  0.13887E-01 ppm1      3.672 ppm2      4.224 CV     1
 ASSI {   55}
   (( segid "ATXH" and resid 56   and name HB2 ))
   (( segid "ATXH" and resid 56   and name HB3 ))
      1.800     0.400     0.400 peak    55 spectrum    1 weight  0.10000E+01 volume  0.13531E-01 ppm1      1.606 ppm2      1.752 CV     1
 ASSI {   56}
   (( segid "ATXH" and resid 26   and name HB3 ))
   (( segid "ATXH" and resid 26   and name HB2 ))
      1.800     0.400     0.400 peak    56 spectrum    1 weight  0.10000E+01 volume  0.13531E-01 ppm1      3.900 ppm2      3.694 CV     1
 ASSI {   57}
   (  segid "ATXH" and resid 38   and name HG1%)
   (( segid "ATXH" and resid 38   and name HB  ))
      2.100     0.600     0.600 peak    57 spectrum    1 weight  0.10000E+01 volume  0.13412E-01 ppm1      2.059 ppm2      0.931 CV     1
 ASSI {   58}
   (  segid "ATXH" and resid 40   and name HD1%)
   (( segid "ATXH" and resid 40   and name HG  ))
      2.100     0.600     0.600 peak    58 spectrum    1 weight  0.10000E+01 volume  0.13174E-01 ppm1      1.564 ppm2      0.863 CV     1
 ASSI {   60}
   (( segid "ATXH" and resid 57   and name HE2 ))
   (( segid "ATXH" and resid 57   and name HD3 ))
      2.200     0.600     0.600 peak    60 spectrum    1 weight  0.10000E+01 volume  0.13056E-01 ppm1      1.635 ppm2      2.927 CV     1
 OR {   60}
   (( segid "ATXH" and resid 57   and name HE2 ))
   (( segid "ATXH" and resid 57   and name HD2 ))
 OR {   60}
   (( segid "ATXH" and resid 57   and name HE3 ))
   (( segid "ATXH" and resid 57   and name HD3 ))
 OR {   60}
   (( segid "ATXH" and resid 57   and name HE3 ))
   (( segid "ATXH" and resid 57   and name HD2 ))
 ASSI {   61}
   (( segid "ATXH" and resid 64   and name HG2 ))
   (( segid "ATXH" and resid 64   and name HG3 ))
      1.900     0.400     0.400 peak    61 spectrum    1 weight  0.10000E+01 volume  0.13056E-01 ppm1      2.454 ppm2      2.675 CV     1
 ASSI {   62}
   (  segid "ATXH" and resid 41   and name HB% )
   (( segid "ATXH" and resid 41   and name HA  ))
      2.200     0.600     0.600 peak    62 spectrum    1 weight  0.10000E+01 volume  0.12937E-01 ppm1      4.044 ppm2      1.385 CV     1
 ASSI {   63}
   (( segid "ATXH" and resid 63   and name HB  ))
   (  segid "ATXH" and resid 63   and name HD1%)
      2.100     0.500     0.500 peak    63 spectrum    1 weight  0.10000E+01 volume  0.12937E-01 ppm1      0.562 ppm2      1.817 CV     1
 ASSI {   65}
   (( segid "ATXH" and resid 5    and name HG2 ))
   (( segid "ATXH" and resid 5    and name HB2 ))
      2.200     0.600     0.600 peak    65 spectrum    1 weight  0.10000E+01 volume  0.12700E-01 ppm1      1.987 ppm2      2.189 CV     1
 ASSI {   66}
   (  segid "ATXH" and resid 62   and name HG1%)
   (  segid "ATXH" and resid 62   and name HG2%)
      2.200     0.600     0.600 peak    66 spectrum    1 weight  0.10000E+01 volume  0.12700E-01 ppm1      0.894 ppm2      1.151 CV     1
 ASSI {   67}
   (  segid "ATXH" and resid 55   and name HG2%)
   (( segid "ATXH" and resid 55   and name HB  ))
      2.100     0.600     0.600 peak    67 spectrum    1 weight  0.10000E+01 volume  0.12463E-01 ppm1      4.426 ppm2      1.182 CV     1
 ASSI {   69}
   (( segid "ATXH" and resid 7    and name HB2 ))
   (( segid "ATXH" and resid 7    and name HB3 ))
      1.900     0.400     0.400 peak    69 spectrum    1 weight  0.10000E+01 volume  0.12344E-01 ppm1      1.401 ppm2      1.580 CV     1
 ASSI {   71}
   (( segid "ATXH" and resid 56   and name HB3 ))
   (( segid "ATXH" and resid 56   and name HA  ))
      2.200     0.600     0.600 peak    71 spectrum    1 weight  0.10000E+01 volume  0.12225E-01 ppm1      3.864 ppm2      1.597 CV     1
 ASSI {   72}
   (  segid "ATXH" and resid 53   and name HG1%)
   (( segid "ATXH" and resid 53   and name HB  ))
      2.100     0.500     0.500 peak    72 spectrum    1 weight  0.10000E+01 volume  0.12225E-01 ppm1      1.995 ppm2      0.811 CV     1
 OR {   72}
   (  segid "ATXH" and resid 53   and name HG2%)
   (( segid "ATXH" and resid 53   and name HB  ))
 ASSI {   73}
   (  segid "ATXH" and resid 61   and name HB% )
   (( segid "ATXH" and resid 61   and name HA  ))
      2.200     0.600     0.600 peak    73 spectrum    1 weight  0.10000E+01 volume  0.12225E-01 ppm1      4.195 ppm2      1.489 CV     1
 ASSI {   74}
   (( segid "ATXH" and resid 4    and name HG2 ))
   (( segid "ATXH" and resid 4    and name HG3 ))
      1.900     0.400     0.400 peak    74 spectrum    1 weight  0.10000E+01 volume  0.12106E-01 ppm1      2.451 ppm2      2.638 CV     1
 ASSI {   76}
   (( segid "ATXH" and resid 49   and name HG13))
   (  segid "ATXH" and resid 49   and name HD1%)
      2.100     0.600     0.600 peak    76 spectrum    1 weight  0.10000E+01 volume  0.11988E-01 ppm1      0.643 ppm2      1.438 CV     1
 ASSI {   80}
   (( segid "ATXH" and resid 9    and name HB2 ))
   (( segid "ATXH" and resid 9    and name HB3 ))
      1.900     0.400     0.400 peak    80 spectrum    1 weight  0.10000E+01 volume  0.11869E-01 ppm1      1.271 ppm2      1.565 CV     1
 ASSI {   82}
   (  segid "ATXH" and resid 49   and name HG2%)
   (( segid "ATXH" and resid 33   and name HA  ))
      2.200     0.600     0.600 peak    82 spectrum    1 weight  0.10000E+01 volume  0.11465E-01 ppm1      4.075 ppm2      0.714 CV     1
 ASSI {   83}
   (  segid "ATXH" and resid 30   and name HD1%)
   (( segid "ATXH" and resid 30   and name HG  ))
      2.100     0.600     0.600 peak    83 spectrum    1 weight  0.10000E+01 volume  0.11311E-01 ppm1      1.862 ppm2      0.853 CV     1
 OR {   83}
   (  segid "ATXH" and resid 30   and name HD2%)
   (( segid "ATXH" and resid 30   and name HG  ))
 ASSI {   84}
   (  segid "ATXH" and resid 30   and name HD2%)
   (( segid "ATXH" and resid 30   and name HA  ))
      2.100     0.600     0.600 peak    84 spectrum    1 weight  0.10000E+01 volume  0.11216E-01 ppm1      4.180 ppm2      0.839 CV     1
 OR {   84}
   (  segid "ATXH" and resid 30   and name HD1%)
   (( segid "ATXH" and resid 30   and name HA  ))
 ASSI {   85}
   (( segid "ATXH" and resid 40   and name HB3 ))
   (( segid "ATXH" and resid 40   and name HB2 ))
      1.900     0.400     0.400 peak    85 spectrum    1 weight  0.10000E+01 volume  0.11192E-01 ppm1      1.578 ppm2      1.415 CV     1
 ASSI {   87}
   (( segid "ATXH" and resid 57   and name HB3 ))
   (( segid "ATXH" and resid 57   and name HG2 ))
      2.200     0.600     0.600 peak    87 spectrum    1 weight  0.10000E+01 volume  0.10920E-01 ppm1      1.386 ppm2      1.727 CV     1
 OR {   87}
   (( segid "ATXH" and resid 57   and name HB3 ))
   (( segid "ATXH" and resid 57   and name HG3 ))
 ASSI {   89}
   (( segid "ATXH" and resid 39   and name HB2 ))
   (( segid "ATXH" and resid 39   and name HB3 ))
      1.800     0.400     0.400 peak    89 spectrum    1 weight  0.10000E+01 volume  0.10754E-01 ppm1      2.027 ppm2      2.330 CV     1
 ASSI {   91}
   (( segid "ATXH" and resid 39   and name HG2 ))
   (( segid "ATXH" and resid 39   and name HB2 ))
      2.300     0.600     0.600 peak    91 spectrum    1 weight  0.10000E+01 volume  0.10729E-01 ppm1      2.331 ppm2      2.175 CV     1
 ASSI {   94}
   (( segid "ATXH" and resid 53   and name HA  ))
   (  segid "ATXH" and resid 53   and name HG1%)
      2.300     0.700     0.700 peak    94 spectrum    1 weight  0.10000E+01 volume  0.10623E-01 ppm1      0.815 ppm2      4.153 CV     1
 OR {   94}
   (( segid "ATXH" and resid 53   and name HA  ))
   (  segid "ATXH" and resid 53   and name HG2%)
 ASSI {   95}
   (  segid "ATXH" and resid 30   and name HD2%)
   (( segid "ATXH" and resid 30   and name HB2 ))
      2.400     0.700     0.700 peak    95 spectrum    1 weight  0.10000E+01 volume  0.10504E-01 ppm1      1.992 ppm2      0.851 CV     1
 OR {   95}
   (  segid "ATXH" and resid 30   and name HD1%)
   (( segid "ATXH" and resid 30   and name HB2 ))
 ASSI {   96}
   (( segid "ATXH" and resid 34   and name HB2 ))
   (( segid "ATXH" and resid 34   and name HB3 ))
      1.900     0.400     0.400 peak    96 spectrum    1 weight  0.10000E+01 volume  0.10480E-01 ppm1      1.646 ppm2      1.893 CV     1
 ASSI {   98}
   (( segid "ATXH" and resid 39   and name HB3 ))
   (( segid "ATXH" and resid 39   and name HB2 ))
      1.900     0.500     0.500 peak    98 spectrum    1 weight  0.10000E+01 volume  0.10409E-01 ppm1      2.331 ppm2      2.044 CV     1
 OR {   98}
   (( segid "ATXH" and resid 39   and name HG3 ))
   (( segid "ATXH" and resid 39   and name HB2 ))
 ASSI {   99}
   (( segid "ATXH" and resid 37   and name HG2 ))
   (( segid "ATXH" and resid 37   and name HD2 ))
      2.200     0.600     0.600 peak    99 spectrum    1 weight  0.10000E+01 volume  0.10386E-01 ppm1      1.635 ppm2      1.229 CV     1
 OR {   99}
   (( segid "ATXH" and resid 37   and name HG3 ))
   (( segid "ATXH" and resid 37   and name HD3 ))
 OR {   99}
   (( segid "ATXH" and resid 37   and name HG2 ))
   (( segid "ATXH" and resid 37   and name HD3 ))
 OR {   99}
   (( segid "ATXH" and resid 37   and name HG3 ))
   (( segid "ATXH" and resid 37   and name HD2 ))
 ASSI {  104}
   (  segid "ATXH" and resid 62   and name HG1%)
   (  segid "ATXH" and resid 30   and name HD2%)
      2.300     0.600     0.600 peak   104 spectrum    1 weight  0.10000E+01 volume  0.10290E-01 ppm1      0.833 ppm2      1.153 CV     1
 ASSI {  105}
   (( segid "ATXH" and resid 29   and name HB2 ))
   (( segid "ATXH" and resid 29   and name HA  ))
      2.500     0.800     0.800 peak   105 spectrum    1 weight  0.10000E+01 volume  0.10231E-01 ppm1      4.051 ppm2      2.042 CV     1
 ASSI {  106}
   (  segid "ATXH" and resid 30   and name HD1%)
   (( segid "ATXH" and resid 30   and name HB3 ))
      2.200     0.600     0.600 peak   106 spectrum    1 weight  0.10000E+01 volume  0.10077E-01 ppm1      1.316 ppm2      0.847 CV     1
 OR {  106}
   (  segid "ATXH" and resid 30   and name HD2%)
   (( segid "ATXH" and resid 30   and name HB3 ))
 ASSI {  107}
   (  segid "ATXH" and resid 40   and name HD1%)
   (  segid "ATXH" and resid 14   and name HE% )
      2.400     0.700     0.700 peak   107 spectrum    1 weight  0.10000E+01 volume  0.10017E-01 ppm1      1.764 ppm2      0.781 CV     1
 OR {  107}
   (  segid "ATXH" and resid 40   and name HD2%)
   (  segid "ATXH" and resid 14   and name HE% )
 ASSI {  108}
   (( segid "ATXH" and resid 30   and name HB3 ))
   (( segid "ATXH" and resid 30   and name HB2 ))
      1.900     0.400     0.400 peak   108 spectrum    1 weight  0.10000E+01 volume  0.98872E-02 ppm1      1.990 ppm2      1.321 CV     1
 ASSI {  110}
   (( segid "ATXH" and resid 33   and name HB  ))
   (  segid "ATXH" and resid 33   and name HG2%)
      2.200     0.600     0.600 peak   110 spectrum    1 weight  0.10000E+01 volume  0.98628E-02 ppm1      0.646 ppm2      2.267 CV     1
 ASSI {  115}
   (( segid "ATXH" and resid 44   and name HB  ))
   (  segid "ATXH" and resid 44   and name HG2%)
      2.200     0.600     0.600 peak   115 spectrum    1 weight  0.10000E+01 volume  0.94476E-02 ppm1      0.930 ppm2      3.965 CV     1
 ASSI {  116}
   (  segid "ATXH" and resid 3    and name HB% )
   (( segid "ATXH" and resid 3    and name HA  ))
      2.300     0.700     0.700 peak   116 spectrum    1 weight  0.10000E+01 volume  0.93767E-02 ppm1      4.405 ppm2      1.360 CV     1
 ASSI {  117}
   (  segid "ATXH" and resid 59   and name HG2%)
   (( segid "ATXH" and resid 59   and name HB  ))
      2.200     0.600     0.600 peak   117 spectrum    1 weight  0.10000E+01 volume  0.92342E-02 ppm1      2.010 ppm2      0.742 CV     1
 OR {  117}
   (  segid "ATXH" and resid 59   and name HD1%)
   (( segid "ATXH" and resid 59   and name HB  ))
 ASSI {  118}
   (  segid "ATXH" and resid 53   and name HG1%)
   (( segid "ATXH" and resid 54   and name HB  ))
      2.400     0.700     0.700 peak   118 spectrum    1 weight  0.10000E+01 volume  0.91275E-02 ppm1      2.372 ppm2      0.799 CV     1
 OR {  118}
   (  segid "ATXH" and resid 53   and name HG2%)
   (( segid "ATXH" and resid 54   and name HB  ))
 ASSI {  119}
   (  segid "ATXH" and resid 62   and name HG2%)
   (( segid "ATXH" and resid 62   and name HB  ))
      2.300     0.600     0.600 peak   119 spectrum    1 weight  0.10000E+01 volume  0.89850E-02 ppm1      2.199 ppm2      0.893 CV     1
 ASSI {  121}
   (( segid "ATXH" and resid 21   and name HA  ))
   (( segid "ATXH" and resid 21   and name HB2 ))
      2.300     0.700     0.700 peak   121 spectrum    1 weight  0.10000E+01 volume  0.89729E-02 ppm1      2.795 ppm2      4.480 CV     1
 OR {  121}
   (( segid "ATXH" and resid 21   and name HA  ))
   (( segid "ATXH" and resid 21   and name HB3 ))
 ASSI {  122}
   (( segid "ATXH" and resid 9    and name HB2 ))
   (  segid "ATXH" and resid 9    and name HD1%)
      2.200     0.600     0.600 peak   122 spectrum    1 weight  0.10000E+01 volume  0.89614E-02 ppm1      0.636 ppm2      1.567 CV     1
 ASSI {  123}
   (( segid "ATXH" and resid 64   and name HB3 ))
   (( segid "ATXH" and resid 64   and name HG3 ))
      2.600     0.900     0.900 peak   123 spectrum    1 weight  0.10000E+01 volume  0.89371E-02 ppm1      2.406 ppm2      1.966 CV     1
 ASSI {  124}
   (  segid "ATXH" and resid 60   and name HG1%)
   (( segid "ATXH" and resid 60   and name HA  ))
      2.300     0.700     0.700 peak   124 spectrum    1 weight  0.10000E+01 volume  0.89134E-02 ppm1      3.252 ppm2      0.968 CV     1
 ASSI {  125}
   (( segid "ATXH" and resid 17   and name HA1 ))
   (( segid "ATXH" and resid 17   and name HA2 ))
      2.100     0.500     0.500 peak   125 spectrum    1 weight  0.10000E+01 volume  0.88776E-02 ppm1      4.343 ppm2      3.864 CV     1
 ASSI {  127}
   (  segid "ATXH" and resid 11   and name HG2%)
   (( segid "ATXH" and resid 11   and name HA  ))
      2.300     0.700     0.700 peak   127 spectrum    1 weight  0.10000E+01 volume  0.88540E-02 ppm1      4.764 ppm2      0.672 CV     1
 OR {  127}
   (  segid "ATXH" and resid 11   and name HG1%)
   (( segid "ATXH" and resid 11   and name HA  ))
 ASSI {  129}
   (( segid "ATXH" and resid 4    and name HG3 ))
   (( segid "ATXH" and resid 4    and name HB2 ))
      2.200     0.600     0.600 peak   129 spectrum    1 weight  0.10000E+01 volume  0.86764E-02 ppm1      1.967 ppm2      2.448 CV     1
 ASSI {  130}
   (( segid "ATXH" and resid 5    and name HG2 ))
   (( segid "ATXH" and resid 5    and name HB3 ))
      2.500     0.800     0.800 peak   130 spectrum    1 weight  0.10000E+01 volume  0.85691E-02 ppm1      1.827 ppm2      2.190 CV     1
 ASSI {  131}
   (( segid "ATXH" and resid 56   and name HB3 ))
   (  segid "ATXH" and resid 56   and name HD2%)
      2.300     0.700     0.700 peak   131 spectrum    1 weight  0.10000E+01 volume  0.84860E-02 ppm1      0.870 ppm2      1.574 CV     1
 ASSI {  133}
   (( segid "ATXH" and resid 26   and name HA  ))
   (( segid "ATXH" and resid 26   and name HB2 ))
      2.300     0.600     0.600 peak   133 spectrum    1 weight  0.10000E+01 volume  0.84272E-02 ppm1      3.902 ppm2      4.151 CV     1
 ASSI {  135}
   (( segid "ATXH" and resid 55   and name HA  ))
   (( segid "ATXH" and resid 55   and name HB  ))
      2.300     0.700     0.700 peak   135 spectrum    1 weight  0.10000E+01 volume  0.82132E-02 ppm1      4.427 ppm2      4.814 CV     1
 ASSI {  136}
   (  segid "ATXH" and resid 62   and name HG1%)
   (( segid "ATXH" and resid 62   and name HB  ))
      2.300     0.600     0.600 peak   136 spectrum    1 weight  0.10000E+01 volume  0.81538E-02 ppm1      2.197 ppm2      1.151 CV     1
 ASSI {  137}
   (  segid "ATXH" and resid 55   and name HG2%)
   (( segid "ATXH" and resid 55   and name HA  ))
      2.400     0.700     0.700 peak   137 spectrum    1 weight  0.10000E+01 volume  0.81423E-02 ppm1      4.818 ppm2      1.182 CV     1
 ASSI {  139}
   (  segid "ATXH" and resid 56   and name HD1%)
   (( segid "ATXH" and resid 56   and name HB3 ))
      2.400     0.700     0.700 peak   139 spectrum    1 weight  0.10000E+01 volume  0.80113E-02 ppm1      1.604 ppm2      0.869 CV     1
 OR {  139}
   (( segid "ATXH" and resid 56   and name HG  ))
   (( segid "ATXH" and resid 56   and name HB3 ))
 OR {  139}
   (  segid "ATXH" and resid 56   and name HD2%)
   (( segid "ATXH" and resid 56   and name HB3 ))
 ASSI {  140}
   (  segid "ATXH" and resid 47   and name HG1%)
   (( segid "ATXH" and resid 47   and name HA  ))
      2.400     0.700     0.700 peak   140 spectrum    1 weight  0.10000E+01 volume  0.79877E-02 ppm1      5.067 ppm2      0.872 CV     1
 ASSI {  142}
   (( segid "ATXH" and resid 57   and name HD2 ))
   (( segid "ATXH" and resid 57   and name HG2 ))
      2.300     0.700     0.700 peak   142 spectrum    1 weight  0.10000E+01 volume  0.79167E-02 ppm1      1.437 ppm2      1.623 CV     1
 OR {  142}
   (( segid "ATXH" and resid 57   and name HD3 ))
   (( segid "ATXH" and resid 57   and name HG2 ))
 ASSI {  145}
   (( segid "ATXH" and resid 46   and name HA  ))
   (( segid "ATXH" and resid 8    and name HA  ))
      2.300     0.600     0.600 peak   145 spectrum    1 weight  0.10000E+01 volume  0.76912E-02 ppm1      4.862 ppm2      5.252 CV     1
 ASSI {  147}
   (( segid "ATXH" and resid 68   and name HB3 ))
   (( segid "ATXH" and resid 68   and name HB2 ))
      2.000     0.500     0.500 peak   147 spectrum    1 weight  0.10000E+01 volume  0.75960E-02 ppm1      2.990 ppm2      2.300 CV     1
 ASSI {  148}
   (  segid "ATXH" and resid 53   and name HG1%)
   (( segid "ATXH" and resid 32   and name HA2 ))
      2.500     0.800     0.800 peak   148 spectrum    1 weight  0.10000E+01 volume  0.75602E-02 ppm1      4.225 ppm2      0.805 CV     1
 OR {  148}
   (  segid "ATXH" and resid 53   and name HG2%)
   (( segid "ATXH" and resid 32   and name HA2 ))
 ASSI {  149}
   (( segid "ATXH" and resid 59   and name HG12))
   (  segid "ATXH" and resid 59   and name HD1%)
      2.300     0.600     0.600 peak   149 spectrum    1 weight  0.10000E+01 volume  0.75487E-02 ppm1      0.692 ppm2      1.562 CV     1
 ASSI {  151}
   (  segid "ATXH" and resid 8    and name HG2%)
   (( segid "ATXH" and resid 8    and name HA  ))
      2.400     0.700     0.700 peak   151 spectrum    1 weight  0.10000E+01 volume  0.74657E-02 ppm1      4.862 ppm2      1.076 CV     1
 ASSI {  152}
   (( segid "ATXH" and resid 4    and name HG2 ))
   (( segid "ATXH" and resid 4    and name HB2 ))
      2.400     0.700     0.700 peak   152 spectrum    1 weight  0.10000E+01 volume  0.74420E-02 ppm1      1.966 ppm2      2.634 CV     1
 ASSI {  155}
   (  segid "ATXH" and resid 54   and name HG1%)
   (( segid "ATXH" and resid 54   and name HB  ))
      2.300     0.600     0.600 peak   155 spectrum    1 weight  0.10000E+01 volume  0.73705E-02 ppm1      2.373 ppm2      1.162 CV     1
 ASSI {  156}
   (( segid "ATXH" and resid 60   and name HB  ))
   (  segid "ATXH" and resid 60   and name HG1%)
      2.300     0.700     0.700 peak   156 spectrum    1 weight  0.10000E+01 volume  0.73468E-02 ppm1      0.972 ppm2      2.011 CV     1
 ASSI {  157}
   (  segid "ATXH" and resid 30   and name HD2%)
   (( segid "ATXH" and resid 29   and name HB3 ))
      2.500     0.800     0.800 peak   157 spectrum    1 weight  0.10000E+01 volume  0.73347E-02 ppm1      1.971 ppm2      0.829 CV     1
 ASSI {  159}
   (( segid "ATXH" and resid 37   and name HB3 ))
   (( segid "ATXH" and resid 37   and name HB2 ))
      2.100     0.500     0.500 peak   159 spectrum    1 weight  0.10000E+01 volume  0.71449E-02 ppm1      1.743 ppm2      1.607 CV     1
 ASSI {  161}
   (( segid "ATXH" and resid 39   and name HB3 ))
   (( segid "ATXH" and resid 39   and name HA  ))
      2.300     0.700     0.700 peak   161 spectrum    1 weight  0.10000E+01 volume  0.70977E-02 ppm1      4.760 ppm2      2.045 CV     1
 OR {  161}
   (( segid "ATXH" and resid 39   and name HG3 ))
   (( segid "ATXH" and resid 39   and name HA  ))
 ASSI {  166}
   (  segid "ATXH" and resid 7    and name HD2%)
   (( segid "ATXH" and resid 7    and name HA  ))
      2.400     0.700     0.700 peak   166 spectrum    1 weight  0.10000E+01 volume  0.69673E-02 ppm1      4.846 ppm2      0.859 CV     1
 ASSI {  168}
   (( segid "ATXH" and resid 32   and name HA2 ))
   (( segid "ATXH" and resid 53   and name HB  ))
      2.300     0.600     0.600 peak   168 spectrum    1 weight  0.10000E+01 volume  0.69079E-02 ppm1      1.995 ppm2      4.205 CV     1
 ASSI {  169}
   (( segid "ATXH" and resid 30   and name HA  ))
   (  segid "ATXH" and resid 30   and name HD2%)
      2.300     0.700     0.700 peak   169 spectrum    1 weight  0.10000E+01 volume  0.68843E-02 ppm1      0.833 ppm2      4.175 CV     1
 ASSI {  170}
   (( segid "ATXH" and resid 37   and name HB3 ))
   (( segid "ATXH" and resid 37   and name HG2 ))
      2.400     0.700     0.700 peak   170 spectrum    1 weight  0.10000E+01 volume  0.68721E-02 ppm1      1.225 ppm2      1.620 CV     1
 OR {  170}
   (( segid "ATXH" and resid 37   and name HD2 ))
   (( segid "ATXH" and resid 37   and name HG2 ))
 OR {  170}
   (( segid "ATXH" and resid 37   and name HD3 ))
   (( segid "ATXH" and resid 37   and name HG2 ))
 OR {  170}
   (( segid "ATXH" and resid 37   and name HD2 ))
   (( segid "ATXH" and resid 37   and name HG3 ))
 OR {  170}
   (( segid "ATXH" and resid 37   and name HB3 ))
   (( segid "ATXH" and resid 37   and name HG3 ))
 ASSI {  172}
   (( segid "ATXH" and resid 58   and name HB3 ))
   (( segid "ATXH" and resid 58   and name HA  ))
      2.400     0.700     0.700 peak   172 spectrum    1 weight  0.10000E+01 volume  0.68012E-02 ppm1      4.361 ppm2      2.594 CV     1
 ASSI {  174}
   (( segid "ATXH" and resid 34   and name HG3 ))
   (( segid "ATXH" and resid 34   and name HB3 ))
      2.300     0.700     0.700 peak   174 spectrum    1 weight  0.10000E+01 volume  0.67769E-02 ppm1      1.645 ppm2      2.084 CV     1
 ASSI {  175}
   (( segid "ATXH" and resid 62   and name HA  ))
   (  segid "ATXH" and resid 62   and name HG2%)
      2.400     0.700     0.700 peak   175 spectrum    1 weight  0.10000E+01 volume  0.67769E-02 ppm1      0.894 ppm2      3.874 CV     1
 ASSI {  176}
   (( segid "ATXH" and resid 57   and name HD3 ))
   (( segid "ATXH" and resid 57   and name HG3 ))
      2.400     0.700     0.700 peak   176 spectrum    1 weight  0.10000E+01 volume  0.67297E-02 ppm1      1.387 ppm2      1.623 CV     1
 OR {  176}
   (( segid "ATXH" and resid 57   and name HD2 ))
   (( segid "ATXH" and resid 57   and name HG2 ))
 OR {  176}
   (( segid "ATXH" and resid 57   and name HD2 ))
   (( segid "ATXH" and resid 57   and name HG3 ))
 OR {  176}
   (( segid "ATXH" and resid 57   and name HD3 ))
   (( segid "ATXH" and resid 57   and name HG2 ))
 ASSI {  177}
   (( segid "ATXH" and resid 56   and name HB2 ))
   (  segid "ATXH" and resid 56   and name HD1%)
      2.400     0.700     0.700 peak   177 spectrum    1 weight  0.10000E+01 volume  0.67178E-02 ppm1      0.876 ppm2      1.758 CV     1
 ASSI {  178}
   (( segid "ATXH" and resid 42   and name HB3 ))
   (( segid "ATXH" and resid 42   and name HA  ))
      2.400     0.700     0.700 peak   178 spectrum    1 weight  0.10000E+01 volume  0.67059E-02 ppm1      4.236 ppm2      1.904 CV     1
 ASSI {  179}
   (( segid "ATXH" and resid 49   and name HB  ))
   (  segid "ATXH" and resid 49   and name HD1%)
      2.300     0.700     0.700 peak   179 spectrum    1 weight  0.10000E+01 volume  0.66585E-02 ppm1      0.655 ppm2      1.558 CV     1
 ASSI {  181}
   (( segid "ATXH" and resid 63   and name HB  ))
   (  segid "ATXH" and resid 63   and name HG2%)
      2.300     0.600     0.600 peak   181 spectrum    1 weight  0.10000E+01 volume  0.66466E-02 ppm1      0.774 ppm2      1.800 CV     1
 ASSI {  183}
   (( segid "ATXH" and resid 10   and name HA  ))
   (( segid "ATXH" and resid 44   and name HA  ))
      2.200     0.600     0.600 peak   183 spectrum    1 weight  0.10000E+01 volume  0.65398E-02 ppm1      5.493 ppm2      4.680 CV     1
 ASSI {  185}
   (( segid "ATXH" and resid 65   and name HB3 ))
   (( segid "ATXH" and resid 65   and name HA  ))
      2.700     0.900     0.900 peak   185 spectrum    1 weight  0.10000E+01 volume  0.65161E-02 ppm1      4.493 ppm2      2.661 CV     1
 ASSI {  187}
   (( segid "ATXH" and resid 63   and name HB  ))
   (( segid "ATXH" and resid 63   and name HG13))
      2.200     0.600     0.600 peak   187 spectrum    1 weight  0.10000E+01 volume  0.64686E-02 ppm1      0.578 ppm2      1.829 CV     1
 ASSI {  188}
   (( segid "ATXH" and resid 57   and name HB2 ))
   (( segid "ATXH" and resid 57   and name HA  ))
      2.400     0.700     0.700 peak   188 spectrum    1 weight  0.10000E+01 volume  0.64567E-02 ppm1      3.849 ppm2      1.770 CV     1
 OR {  188}
   (( segid "ATXH" and resid 57   and name HB3 ))
   (( segid "ATXH" and resid 57   and name HA  ))
 ASSI {  189}
   (( segid "ATXH" and resid 54   and name HB  ))
   (( segid "ATXH" and resid 54   and name HA  ))
      2.300     0.700     0.700 peak   189 spectrum    1 weight  0.10000E+01 volume  0.64448E-02 ppm1      4.643 ppm2      2.374 CV     1
 ASSI {  190}
   (  segid "ATXH" and resid 33   and name HG2%)
   (( segid "ATXH" and resid 28   and name HA  ))
      2.700     0.900     0.900 peak   190 spectrum    1 weight  0.10000E+01 volume  0.64448E-02 ppm1      3.767 ppm2      0.643 CV     1
 ASSI {  191}
   (( segid "ATXH" and resid 4    and name HA  ))
   (( segid "ATXH" and resid 50   and name HA  ))
      2.300     0.700     0.700 peak   191 spectrum    1 weight  0.10000E+01 volume  0.64330E-02 ppm1      5.024 ppm2      5.175 CV     1
 ASSI {  192}
   (( segid "ATXH" and resid 30   and name HB3 ))
   (( segid "ATXH" and resid 30   and name HA  ))
      2.300     0.700     0.700 peak   192 spectrum    1 weight  0.10000E+01 volume  0.64330E-02 ppm1      4.177 ppm2      1.320 CV     1
 ASSI {  193}
   (  segid "ATXH" and resid 45   and name HG1%)
   (( segid "ATXH" and resid 45   and name HA  ))
      2.400     0.700     0.700 peak   193 spectrum    1 weight  0.10000E+01 volume  0.63973E-02 ppm1      4.463 ppm2      0.770 CV     1
 ASSI {  194}
   (  segid "ATXH" and resid 62   and name HG1%)
   (( segid "ATXH" and resid 62   and name HA  ))
      2.500     0.800     0.800 peak   194 spectrum    1 weight  0.10000E+01 volume  0.63143E-02 ppm1      3.868 ppm2      1.151 CV     1
 ASSI {  197}
   (  segid "ATXH" and resid 48   and name HG2%)
   (( segid "ATXH" and resid 48   and name HA  ))
      2.400     0.700     0.700 peak   197 spectrum    1 weight  0.10000E+01 volume  0.61837E-02 ppm1      5.232 ppm2      1.104 CV     1
 ASSI {  199}
   (( segid "ATXH" and resid 6    and name HA  ))
   (( segid "ATXH" and resid 6    and name HG2 ))
      2.500     0.800     0.800 peak   199 spectrum    1 weight  0.10000E+01 volume  0.61719E-02 ppm1      2.196 ppm2      5.201 CV     1
 ASSI {  200}
   (( segid "ATXH" and resid 7    and name HB3 ))
   (  segid "ATXH" and resid 7    and name HD1%)
      2.500     0.800     0.800 peak   200 spectrum    1 weight  0.10000E+01 volume  0.61125E-02 ppm1      0.786 ppm2      1.405 CV     1
 ASSI {  201}
   (( segid "ATXH" and resid 28   and name HB2 ))
   (( segid "ATXH" and resid 28   and name HA  ))
      2.400     0.700     0.700 peak   201 spectrum    1 weight  0.10000E+01 volume  0.60888E-02 ppm1      3.781 ppm2      1.845 CV     1
 OR {  201}
   (( segid "ATXH" and resid 28   and name HB3 ))
   (( segid "ATXH" and resid 28   and name HA  ))
 ASSI {  202}
   (( segid "ATXH" and resid 7    and name HB2 ))
   (  segid "ATXH" and resid 7    and name HD1%)
      2.500     0.800     0.800 peak   202 spectrum    1 weight  0.10000E+01 volume  0.60888E-02 ppm1      0.786 ppm2      1.577 CV     1
 ASSI {  203}
   (( segid "ATXH" and resid 65   and name HB2 ))
   (( segid "ATXH" and resid 65   and name HA  ))
      2.400     0.700     0.700 peak   203 spectrum    1 weight  0.10000E+01 volume  0.60294E-02 ppm1      4.493 ppm2      2.896 CV     1
 ASSI {  204}
   (  segid "ATXH" and resid 53   and name HG1%)
   (( segid "ATXH" and resid 54   and name HA  ))
      2.600     0.800     0.800 peak   204 spectrum    1 weight  0.10000E+01 volume  0.59819E-02 ppm1      4.647 ppm2      0.804 CV     1
 OR {  204}
   (  segid "ATXH" and resid 53   and name HG2%)
   (( segid "ATXH" and resid 54   and name HA  ))
 ASSI {  205}
   (( segid "ATXH" and resid 52   and name HA  ))
   (( segid "ATXH" and resid 52   and name HB2 ))
      2.500     0.800     0.800 peak   205 spectrum    1 weight  0.10000E+01 volume  0.59226E-02 ppm1      3.988 ppm2      4.468 CV     1
 ASSI {  215}
   (( segid "ATXH" and resid 44   and name HA  ))
   (  segid "ATXH" and resid 44   and name HG2%)
      2.500     0.800     0.800 peak   215 spectrum    1 weight  0.10000E+01 volume  0.56615E-02 ppm1      0.932 ppm2      5.492 CV     1
 ASSI {  216}
   (( segid "ATXH" and resid 31   and name HA  ))
   (( segid "ATXH" and resid 31   and name HB2 ))
      2.400     0.700     0.700 peak   216 spectrum    1 weight  0.10000E+01 volume  0.56615E-02 ppm1      2.747 ppm2      4.440 CV     1
 ASSI {  217}
   (( segid "ATXH" and resid 51   and name HA  ))
   (( segid "ATXH" and resid 51   and name HB2 ))
      2.400     0.700     0.700 peak   217 spectrum    1 weight  0.10000E+01 volume  0.56615E-02 ppm1      4.198 ppm2      4.911 CV     1
 ASSI {  218}
   (  segid "ATXH" and resid 59   and name HD1%)
   (( segid "ATXH" and resid 59   and name HG12))
      2.400     0.700     0.700 peak   218 spectrum    1 weight  0.10000E+01 volume  0.56377E-02 ppm1      1.513 ppm2      0.702 CV     1
 OR {  218}
   (  segid "ATXH" and resid 59   and name HG2%)
   (( segid "ATXH" and resid 59   and name HG12))
 ASSI {  219}
   (( segid "ATXH" and resid 4    and name HB2 ))
   (( segid "ATXH" and resid 4    and name HG3 ))
      2.400     0.700     0.700 peak   219 spectrum    1 weight  0.10000E+01 volume  0.56259E-02 ppm1      2.451 ppm2      1.961 CV     1
 OR {  219}
   (  segid "ATXH" and resid 4    and name HE% )
   (( segid "ATXH" and resid 4    and name HG3 ))
 ASSI {  220}
   (( segid "ATXH" and resid 4    and name HB2 ))
   (( segid "ATXH" and resid 4    and name HG2 ))
      2.500     0.800     0.800 peak   220 spectrum    1 weight  0.10000E+01 volume  0.56022E-02 ppm1      2.639 ppm2      1.961 CV     1
 OR {  220}
   (  segid "ATXH" and resid 4    and name HE% )
   (( segid "ATXH" and resid 4    and name HG2 ))
 ASSI {  223}
   (( segid "ATXH" and resid 59   and name HB  ))
   (  segid "ATXH" and resid 59   and name HG2%)
      2.400     0.700     0.700 peak   223 spectrum    1 weight  0.10000E+01 volume  0.55072E-02 ppm1      0.754 ppm2      2.012 CV     1
 ASSI {  224}
   (( segid "ATXH" and resid 34   and name HB3 ))
   (( segid "ATXH" and resid 34   and name HG2 ))
      2.500     0.800     0.800 peak   224 spectrum    1 weight  0.10000E+01 volume  0.54953E-02 ppm1      2.194 ppm2      1.647 CV     1
 ASSI {  225}
   (( segid "ATXH" and resid 27   and name HB  ))
   (  segid "ATXH" and resid 27   and name HG2%)
      2.400     0.700     0.700 peak   225 spectrum    1 weight  0.10000E+01 volume  0.54834E-02 ppm1      0.863 ppm2      2.032 CV     1
 ASSI {  226}
   (( segid "ATXH" and resid 44   and name HA  ))
   (( segid "ATXH" and resid 44   and name HB  ))
      2.400     0.700     0.700 peak   226 spectrum    1 weight  0.10000E+01 volume  0.54597E-02 ppm1      3.967 ppm2      5.492 CV     1
 ASSI {  227}
   (  segid "ATXH" and resid 53   and name HG1%)
   (( segid "ATXH" and resid 32   and name HA1 ))
      2.600     0.800     0.800 peak   227 spectrum    1 weight  0.10000E+01 volume  0.54597E-02 ppm1      3.672 ppm2      0.805 CV     1
 OR {  227}
   (  segid "ATXH" and resid 53   and name HG2%)
   (( segid "ATXH" and resid 32   and name HA1 ))
 ASSI {  231}
   (( segid "ATXH" and resid 66   and name HB3 ))
   (( segid "ATXH" and resid 66   and name HG2 ))
      2.500     0.800     0.800 peak   231 spectrum    1 weight  0.10000E+01 volume  0.53766E-02 ppm1      2.480 ppm2      2.247 CV     1
 OR {  231}
   (( segid "ATXH" and resid 66   and name HB3 ))
   (( segid "ATXH" and resid 66   and name HG3 ))
 ASSI {  232}
   (( segid "ATXH" and resid 37   and name HG3 ))
   (( segid "ATXH" and resid 37   and name HB2 ))
      2.500     0.800     0.800 peak   232 spectrum    1 weight  0.10000E+01 volume  0.53766E-02 ppm1      1.744 ppm2      1.228 CV     1
 OR {  232}
   (( segid "ATXH" and resid 37   and name HG2 ))
   (( segid "ATXH" and resid 37   and name HB2 ))
 ASSI {  233}
   (( segid "ATXH" and resid 28   and name HB2 ))
   (( segid "ATXH" and resid 28   and name HG2 ))
      2.400     0.700     0.700 peak   233 spectrum    1 weight  0.10000E+01 volume  0.53647E-02 ppm1      1.466 ppm2      1.845 CV     1
 OR {  233}
   (( segid "ATXH" and resid 28   and name HB3 ))
   (( segid "ATXH" and resid 28   and name HG2 ))
 ASSI {  234}
   (( segid "ATXH" and resid 26   and name HB3 ))
   (( segid "ATXH" and resid 26   and name HA  ))
      2.600     0.900     0.900 peak   234 spectrum    1 weight  0.10000E+01 volume  0.53410E-02 ppm1      4.153 ppm2      3.695 CV     1
 ASSI {  236}
   (  segid "ATXH" and resid 45   and name HG2%)
   (( segid "ATXH" and resid 45   and name HA  ))
      2.500     0.800     0.800 peak   236 spectrum    1 weight  0.10000E+01 volume  0.53173E-02 ppm1      4.462 ppm2      0.593 CV     1
 ASSI {  238}
   (( segid "ATXH" and resid 57   and name HA  ))
   (( segid "ATXH" and resid 57   and name HB2 ))
      2.500     0.800     0.800 peak   238 spectrum    1 weight  0.10000E+01 volume  0.52461E-02 ppm1      1.783 ppm2      3.852 CV     1
 ASSI {  239}
   (( segid "ATXH" and resid 52   and name HB3 ))
   (( segid "ATXH" and resid 52   and name HA  ))
      2.600     0.900     0.900 peak   239 spectrum    1 weight  0.10000E+01 volume  0.52223E-02 ppm1      4.468 ppm2      3.840 CV     1
 ASSI {  240}
   (( segid "ATXH" and resid 59   and name HG13))
   (( segid "ATXH" and resid 59   and name HG12))
      2.100     0.500     0.500 peak   240 spectrum    1 weight  0.10000E+01 volume  0.51986E-02 ppm1      1.509 ppm2      1.127 CV     1
 ASSI {  241}
   (  segid "ATXH" and resid 60   and name HG2%)
   (( segid "ATXH" and resid 60   and name HA  ))
      2.600     0.800     0.800 peak   241 spectrum    1 weight  0.10000E+01 volume  0.51867E-02 ppm1      3.252 ppm2      0.836 CV     1
 ASSI {  243}
   (( segid "ATXH" and resid 7    and name HB3 ))
   (( segid "ATXH" and resid 7    and name HA  ))
      2.500     0.800     0.800 peak   243 spectrum    1 weight  0.10000E+01 volume  0.51036E-02 ppm1      4.846 ppm2      1.401 CV     1
 ASSI {  246}
   (  segid "ATXH" and resid 49   and name HG2%)
   (( segid "ATXH" and resid 49   and name HA  ))
      2.400     0.800     0.800 peak   246 spectrum    1 weight  0.10000E+01 volume  0.50680E-02 ppm1      5.310 ppm2      0.722 CV     1
 ASSI {  247}
   (( segid "ATXH" and resid 30   and name HG  ))
   (  segid "ATXH" and resid 30   and name HD2%)
      2.400     0.700     0.700 peak   247 spectrum    1 weight  0.10000E+01 volume  0.50561E-02 ppm1      0.834 ppm2      1.866 CV     1
 ASSI {  251}
   (  segid "ATXH" and resid 59   and name HG2%)
   (( segid "ATXH" and resid 59   and name HA  ))
      2.500     0.800     0.800 peak   251 spectrum    1 weight  0.10000E+01 volume  0.50087E-02 ppm1      3.498 ppm2      0.751 CV     1
 ASSI {  254}
   (( segid "ATXH" and resid 31   and name HA  ))
   (( segid "ATXH" and resid 31   and name HB3 ))
      2.700     0.900     0.900 peak   254 spectrum    1 weight  0.10000E+01 volume  0.49850E-02 ppm1      2.647 ppm2      4.440 CV     1
 ASSI {  255}
   (( segid "ATXH" and resid 51   and name HA  ))
   (( segid "ATXH" and resid 51   and name HB3 ))
      2.700     0.900     0.900 peak   255 spectrum    1 weight  0.10000E+01 volume  0.49375E-02 ppm1      3.804 ppm2      4.911 CV     1
 ASSI {  256}
   (( segid "ATXH" and resid 64   and name HG3 ))
   (( segid "ATXH" and resid 64   and name HB2 ))
      2.400     0.700     0.700 peak   256 spectrum    1 weight  0.10000E+01 volume  0.48781E-02 ppm1      2.103 ppm2      2.458 CV     1
 ASSI {  260}
   (( segid "ATXH" and resid 34   and name HG3 ))
   (( segid "ATXH" and resid 48   and name HB  ))
      2.600     0.900     0.900 peak   260 spectrum    1 weight  0.10000E+01 volume  0.47713E-02 ppm1      3.878 ppm2      2.065 CV     1
 ASSI {  262}
   (( segid "ATXH" and resid 56   and name HG  ))
   (( segid "ATXH" and resid 56   and name HA  ))
      2.700     0.900     0.900 peak   262 spectrum    1 weight  0.10000E+01 volume  0.47713E-02 ppm1      3.873 ppm2      0.867 CV     1
 OR {  262}
   (  segid "ATXH" and resid 56   and name HD1%)
   (( segid "ATXH" and resid 56   and name HA  ))
 OR {  262}
   (  segid "ATXH" and resid 56   and name HD2%)
   (( segid "ATXH" and resid 56   and name HA  ))
 ASSI {  263}
   (( segid "ATXH" and resid 14   and name HG2 ))
   (  segid "ATXH" and resid 14   and name HE% )
      2.600     0.800     0.800 peak   263 spectrum    1 weight  0.10000E+01 volume  0.47594E-02 ppm1      1.776 ppm2      2.059 CV     1
 OR {  263}
   (( segid "ATXH" and resid 14   and name HG3 ))
   (  segid "ATXH" and resid 14   and name HE% )
 ASSI {  267}
   (( segid "ATXH" and resid 37   and name HG2 ))
   (( segid "ATXH" and resid 37   and name HB3 ))
      2.600     0.800     0.800 peak   267 spectrum    1 weight  0.10000E+01 volume  0.47238E-02 ppm1      1.603 ppm2      1.228 CV     1
 OR {  267}
   (( segid "ATXH" and resid 37   and name HG3 ))
   (( segid "ATXH" and resid 37   and name HB3 ))
 ASSI {  268}
   (( segid "ATXH" and resid 57   and name HG2 ))
   (( segid "ATXH" and resid 57   and name HB2 ))
      2.500     0.800     0.800 peak   268 spectrum    1 weight  0.10000E+01 volume  0.47120E-02 ppm1      1.797 ppm2      1.438 CV     1
 OR {  268}
   (( segid "ATXH" and resid 57   and name HG3 ))
   (( segid "ATXH" and resid 57   and name HB2 ))
 ASSI {  269}
   (( segid "ATXH" and resid 34   and name HB3 ))
   (( segid "ATXH" and resid 34   and name HA  ))
      2.700     0.900     0.900 peak   269 spectrum    1 weight  0.10000E+01 volume  0.46645E-02 ppm1      4.403 ppm2      1.649 CV     1
 ASSI {  271}
   (( segid "ATXH" and resid 45   and name HB  ))
   (  segid "ATXH" and resid 9    and name HD2%)
      2.700     0.900     0.900 peak   271 spectrum    1 weight  0.10000E+01 volume  0.46526E-02 ppm1      0.703 ppm2      1.731 CV     1
 ASSI {  273}
   (( segid "ATXH" and resid 56   and name HA  ))
   (  segid "ATXH" and resid 56   and name HD2%)
      2.800     1.000     1.000 peak   273 spectrum    1 weight  0.10000E+01 volume  0.46526E-02 ppm1      0.871 ppm2      3.870 CV     1
 ASSI {  274}
   (( segid "ATXH" and resid 27   and name HA  ))
   (  segid "ATXH" and resid 27   and name HG2%)
      2.500     0.800     0.800 peak   274 spectrum    1 weight  0.10000E+01 volume  0.46407E-02 ppm1      0.893 ppm2      3.716 CV     1
 ASSI {  275}
   (( segid "ATXH" and resid 50   and name HB3 ))
   (( segid "ATXH" and resid 50   and name HA  ))
      2.700     0.900     0.900 peak   275 spectrum    1 weight  0.10000E+01 volume  0.46289E-02 ppm1      5.023 ppm2      2.462 CV     1
 ASSI {  278}
   (( segid "ATXH" and resid 56   and name HB2 ))
   (  segid "ATXH" and resid 56   and name HD2%)
      2.800     1.000     1.000 peak   278 spectrum    1 weight  0.10000E+01 volume  0.46051E-02 ppm1      0.870 ppm2      1.753 CV     1
 ASSI {  280}
   (( segid "ATXH" and resid 4    and name HG2 ))
   (( segid "ATXH" and resid 4    and name HB3 ))
      2.700     0.900     0.900 peak   280 spectrum    1 weight  0.10000E+01 volume  0.45933E-02 ppm1      1.793 ppm2      2.637 CV     1
 ASSI {  283}
   (( segid "ATXH" and resid 58   and name HB2 ))
   (( segid "ATXH" and resid 58   and name HA  ))
      2.800     1.000     1.000 peak   283 spectrum    1 weight  0.10000E+01 volume  0.45340E-02 ppm1      4.360 ppm2      3.010 CV     1
 ASSI {  284}
   (( segid "ATXH" and resid 39   and name HB2 ))
   (( segid "ATXH" and resid 39   and name HA  ))
      2.700     0.900     0.900 peak   284 spectrum    1 weight  0.10000E+01 volume  0.45221E-02 ppm1      4.759 ppm2      2.331 CV     1
 ASSI {  286}
   (  segid "ATXH" and resid 48   and name HG2%)
   (  segid "ATXH" and resid 4    and name HE% )
      2.600     0.800     0.800 peak   286 spectrum    1 weight  0.10000E+01 volume  0.44983E-02 ppm1      1.915 ppm2      1.105 CV     1
 ASSI {  287}
   (( segid "ATXH" and resid 28   and name HA  ))
   (( segid "ATXH" and resid 28   and name HG2 ))
      2.700     0.900     0.900 peak   287 spectrum    1 weight  0.10000E+01 volume  0.44864E-02 ppm1      1.465 ppm2      3.775 CV     1
 ASSI {  288}
   (( segid "ATXH" and resid 46   and name HG2 ))
   (( segid "ATXH" and resid 46   and name HA  ))
      2.600     0.800     0.800 peak   288 spectrum    1 weight  0.10000E+01 volume  0.44746E-02 ppm1      5.252 ppm2      2.183 CV     1
 ASSI {  290}
   (( segid "ATXH" and resid 54   and name HA  ))
   (  segid "ATXH" and resid 54   and name HG1%)
      2.900     1.100     1.100 peak   290 spectrum    1 weight  0.10000E+01 volume  0.44390E-02 ppm1      1.161 ppm2      4.641 CV     1
 ASSI {  291}
   (( segid "ATXH" and resid 45   and name HB  ))
   (  segid "ATXH" and resid 45   and name HG2%)
      2.500     0.800     0.800 peak   291 spectrum    1 weight  0.10000E+01 volume  0.44390E-02 ppm1      0.593 ppm2      1.728 CV     1
 ASSI {  293}
   (( segid "ATXH" and resid 4    and name HB3 ))
   (( segid "ATXH" and resid 4    and name HG3 ))
      2.600     0.800     0.800 peak   293 spectrum    1 weight  0.10000E+01 volume  0.44390E-02 ppm1      2.451 ppm2      1.794 CV     1
 ASSI {  295}
   (  segid "ATXH" and resid 9    and name HD2%)
   (( segid "ATXH" and resid 9    and name HB2 ))
      3.000     1.100     1.100 peak   295 spectrum    1 weight  0.10000E+01 volume  0.44153E-02 ppm1      1.571 ppm2      0.707 CV     1
 ASSI {  297}
   (  segid "ATXH" and resid 44   and name HG2%)
   (( segid "ATXH" and resid 42   and name HB2 ))
      2.900     1.000     1.000 peak   297 spectrum    1 weight  0.10000E+01 volume  0.43559E-02 ppm1      2.094 ppm2      0.932 CV     1
 ASSI {  298}
   (( segid "ATXH" and resid 64   and name HB2 ))
   (( segid "ATXH" and resid 64   and name HG2 ))
      3.000     1.100     1.100 peak   298 spectrum    1 weight  0.10000E+01 volume  0.42965E-02 ppm1      2.684 ppm2      2.087 CV     1
 ASSI {  299}
   (( segid "ATXH" and resid 63   and name HG13))
   (( segid "ATXH" and resid 63   and name HB  ))
      2.400     0.700     0.700 peak   299 spectrum    1 weight  0.10000E+01 volume  0.42728E-02 ppm1      1.795 ppm2      0.568 CV     1
 OR {  299}
   (  segid "ATXH" and resid 63   and name HD1%)
   (( segid "ATXH" and resid 63   and name HB  ))
 ASSI {  301}
   (  segid "ATXH" and resid 20   and name HG1%)
   (( segid "ATXH" and resid 20   and name HB  ))
      2.600     0.800     0.800 peak   301 spectrum    1 weight  0.10000E+01 volume  0.42728E-02 ppm1      2.102 ppm2      1.075 CV     1
 ASSI {  302}
   (  segid "ATXH" and resid 23   and name HG2%)
   (( segid "ATXH" and resid 23   and name HA  ))
      2.900     1.100     1.100 peak   302 spectrum    1 weight  0.10000E+01 volume  0.42610E-02 ppm1      3.444 ppm2      0.566 CV     1
 ASSI {  303}
   (( segid "ATXH" and resid 57   and name HA  ))
   (( segid "ATXH" and resid 60   and name HB  ))
      2.500     0.800     0.800 peak   303 spectrum    1 weight  0.10000E+01 volume  0.42610E-02 ppm1      2.004 ppm2      3.856 CV     1
 ASSI {  305}
   (  segid "ATXH" and resid 61   and name HB% )
   (( segid "ATXH" and resid 58   and name HA  ))
      2.600     0.900     0.900 peak   305 spectrum    1 weight  0.10000E+01 volume  0.42254E-02 ppm1      4.362 ppm2      1.489 CV     1
 ASSI {  312}
   (( segid "ATXH" and resid 70   and name HB  ))
   (  segid "ATXH" and resid 70   and name HG2%)
      2.600     0.800     0.800 peak   312 spectrum    1 weight  0.10000E+01 volume  0.41067E-02 ppm1      0.933 ppm2      2.063 CV     1
 ASSI {  313}
   (( segid "ATXH" and resid 39   and name HG2 ))
   (( segid "ATXH" and resid 39   and name HA  ))
      2.600     0.800     0.800 peak   313 spectrum    1 weight  0.10000E+01 volume  0.40829E-02 ppm1      4.756 ppm2      2.171 CV     1
 ASSI {  315}
   (( segid "ATXH" and resid 49   and name HB  ))
   (( segid "ATXH" and resid 49   and name HA  ))
      2.500     0.800     0.800 peak   315 spectrum    1 weight  0.10000E+01 volume  0.40711E-02 ppm1      5.311 ppm2      1.559 CV     1
 ASSI {  316}
   (( segid "ATXH" and resid 37   and name HB3 ))
   (( segid "ATXH" and resid 37   and name HA  ))
      2.600     0.800     0.800 peak   316 spectrum    1 weight  0.10000E+01 volume  0.40592E-02 ppm1      4.701 ppm2      1.618 CV     1
 OR {  316}
   (( segid "ATXH" and resid 37   and name HD2 ))
   (( segid "ATXH" and resid 37   and name HA  ))
 ASSI {  320}
   (( segid "ATXH" and resid 30   and name HB3 ))
   (  segid "ATXH" and resid 30   and name HD1%)
      2.500     0.800     0.800 peak   320 spectrum    1 weight  0.10000E+01 volume  0.40354E-02 ppm1      0.878 ppm2      1.323 CV     1
 ASSI {  321}
   (( segid "ATXH" and resid 70   and name HA  ))
   (  segid "ATXH" and resid 70   and name HG1%)
      2.700     0.900     0.900 peak   321 spectrum    1 weight  0.10000E+01 volume  0.40236E-02 ppm1      0.984 ppm2      4.537 CV     1
 ASSI {  322}
   (( segid "ATXH" and resid 33   and name HA  ))
   (( segid "ATXH" and resid 49   and name HA  ))
      2.500     0.800     0.800 peak   322 spectrum    1 weight  0.10000E+01 volume  0.39998E-02 ppm1      5.310 ppm2      4.072 CV     1
 ASSI {  324}
   (  segid "ATXH" and resid 54   and name HG2%)
   (( segid "ATXH" and resid 54   and name HB  ))
      2.500     0.800     0.800 peak   324 spectrum    1 weight  0.10000E+01 volume  0.39880E-02 ppm1      2.379 ppm2      0.723 CV     1
 ASSI {  326}
   (( segid "ATXH" and resid 30   and name HG  ))
   (  segid "ATXH" and resid 30   and name HD1%)
      2.600     0.800     0.800 peak   326 spectrum    1 weight  0.10000E+01 volume  0.39405E-02 ppm1      0.878 ppm2      1.860 CV     1
 ASSI {  328}
   (  segid "ATXH" and resid 48   and name HG2%)
   (( segid "ATXH" and resid 4    and name HB2 ))
      3.000     1.100     1.100 peak   328 spectrum    1 weight  0.10000E+01 volume  0.39168E-02 ppm1      1.961 ppm2      1.101 CV     1
 ASSI {  329}
   (( segid "ATXH" and resid 18   and name HB3 ))
   (( segid "ATXH" and resid 18   and name HB2 ))
      2.300     0.700     0.700 peak   329 spectrum    1 weight  0.10000E+01 volume  0.39168E-02 ppm1      3.298 ppm2      3.115 CV     1
 ASSI {  332}
   (( segid "ATXH" and resid 34   and name HB2 ))
   (( segid "ATXH" and resid 34   and name HA  ))
      2.600     0.900     0.900 peak   332 spectrum    1 weight  0.10000E+01 volume  0.38574E-02 ppm1      4.402 ppm2      1.895 CV     1
 ASSI {  338}
   (  segid "ATXH" and resid 8    and name HG2%)
   (( segid "ATXH" and resid 44   and name HB  ))
      2.600     0.800     0.800 peak   338 spectrum    1 weight  0.10000E+01 volume  0.37625E-02 ppm1      3.968 ppm2      1.076 CV     1
 ASSI {  339}
   (( segid "ATXH" and resid 27   and name HB  ))
   (  segid "ATXH" and resid 27   and name HG1%)
      2.500     0.800     0.800 peak   339 spectrum    1 weight  0.10000E+01 volume  0.37506E-02 ppm1      0.922 ppm2      2.072 CV     1
 ASSI {  340}
   (( segid "ATXH" and resid 35   and name HA  ))
   (( segid "ATXH" and resid 35   and name HG2 ))
      2.700     0.900     0.900 peak   340 spectrum    1 weight  0.10000E+01 volume  0.37031E-02 ppm1      2.266 ppm2      4.641 CV     1
 ASSI {  341}
   (  segid "ATXH" and resid 14   and name HE% )
   (( segid "ATXH" and resid 43   and name HA2 ))
      3.400     1.400     1.400 peak   341 spectrum    1 weight  0.10000E+01 volume  0.37031E-02 ppm1      4.053 ppm2      1.769 CV     1
 ASSI {  343}
   (( segid "ATXH" and resid 13   and name HA1 ))
   (( segid "ATXH" and resid 13   and name HA2 ))
      2.400     0.700     0.700 peak   343 spectrum    1 weight  0.10000E+01 volume  0.36557E-02 ppm1      4.641 ppm2      3.724 CV     1
 ASSI {  344}
   (( segid "ATXH" and resid 11   and name HA  ))
   (  segid "ATXH" and resid 70   and name HG2%)
      2.800     1.000     1.000 peak   344 spectrum    1 weight  0.10000E+01 volume  0.36557E-02 ppm1      0.940 ppm2      4.749 CV     1
 ASSI {  345}
   (( segid "ATXH" and resid 50   and name HB2 ))
   (( segid "ATXH" and resid 50   and name HA  ))
      2.600     0.800     0.800 peak   345 spectrum    1 weight  0.10000E+01 volume  0.36438E-02 ppm1      5.023 ppm2      2.945 CV     1
 ASSI {  346}
   (( segid "ATXH" and resid 11   and name HA  ))
   (  segid "ATXH" and resid 11   and name HG1%)
      2.700     0.900     0.900 peak   346 spectrum    1 weight  0.10000E+01 volume  0.36438E-02 ppm1      0.650 ppm2      4.763 CV     1
 ASSI {  349}
   (( segid "ATXH" and resid 46   and name HB2 ))
   (( segid "ATXH" and resid 46   and name HA  ))
      2.700     0.900     0.900 peak   349 spectrum    1 weight  0.10000E+01 volume  0.36082E-02 ppm1      5.257 ppm2      1.924 CV     1
 OR {  349}
   (( segid "ATXH" and resid 46   and name HB3 ))
   (( segid "ATXH" and resid 46   and name HA  ))
 ASSI {  352}
   (( segid "ATXH" and resid 62   and name HA  ))
   (( segid "ATXH" and resid 65   and name HB2 ))
      2.900     1.000     1.000 peak   352 spectrum    1 weight  0.10000E+01 volume  0.35607E-02 ppm1      2.899 ppm2      3.868 CV     1
 ASSI {  353}
   (( segid "ATXH" and resid 1    and name HB2 ))
   (( segid "ATXH" and resid 1    and name HA  ))
      2.700     0.900     0.900 peak   353 spectrum    1 weight  0.10000E+01 volume  0.35488E-02 ppm1      4.534 ppm2      3.864 CV     1
 OR {  353}
   (( segid "ATXH" and resid 1    and name HB3 ))
   (( segid "ATXH" and resid 1    and name HA  ))
 ASSI {  355}
   (  segid "ATXH" and resid 7    and name HD2%)
   (( segid "ATXH" and resid 7    and name HB2 ))
      2.900     1.000     1.000 peak   355 spectrum    1 weight  0.10000E+01 volume  0.34895E-02 ppm1      1.589 ppm2      0.851 CV     1
 ASSI {  356}
   (  segid "ATXH" and resid 23   and name HG2%)
   (( segid "ATXH" and resid 23   and name HB  ))
      2.600     0.800     0.800 peak   356 spectrum    1 weight  0.10000E+01 volume  0.34776E-02 ppm1      1.733 ppm2      0.563 CV     1
 ASSI {  357}
   (( segid "ATXH" and resid 62   and name HB  ))
   (( segid "ATXH" and resid 62   and name HA  ))
      2.700     0.900     0.900 peak   357 spectrum    1 weight  0.10000E+01 volume  0.34539E-02 ppm1      3.867 ppm2      2.197 CV     1
 ASSI {  358}
   (( segid "ATXH" and resid 37   and name HA  ))
   (( segid "ATXH" and resid 37   and name HG2 ))
      2.700     0.900     0.900 peak   358 spectrum    1 weight  0.10000E+01 volume  0.34420E-02 ppm1      1.232 ppm2      4.706 CV     1
 OR {  358}
   (( segid "ATXH" and resid 37   and name HA  ))
   (( segid "ATXH" and resid 37   and name HG3 ))
 ASSI {  359}
   (( segid "ATXH" and resid 28   and name HA  ))
   (( segid "ATXH" and resid 33   and name HB  ))
      2.700     0.900     0.900 peak   359 spectrum    1 weight  0.10000E+01 volume  0.34420E-02 ppm1      2.269 ppm2      3.785 CV     1
 ASSI {  360}
   (  segid "ATXH" and resid 56   and name HD2%)
   (( segid "ATXH" and resid 56   and name HB2 ))
      2.800     0.900     0.900 peak   360 spectrum    1 weight  0.10000E+01 volume  0.34301E-02 ppm1      1.752 ppm2      0.865 CV     1
 OR {  360}
   (( segid "ATXH" and resid 56   and name HG  ))
   (( segid "ATXH" and resid 56   and name HB2 ))
 OR {  360}
   (  segid "ATXH" and resid 56   and name HD1%)
   (( segid "ATXH" and resid 56   and name HB2 ))
 ASSI {  361}
   (( segid "ATXH" and resid 5    and name HA  ))
   (( segid "ATXH" and resid 5    and name HG2 ))
      2.700     0.900     0.900 peak   361 spectrum    1 weight  0.10000E+01 volume  0.34301E-02 ppm1      2.188 ppm2      4.628 CV     1
 ASSI {  364}
   (( segid "ATXH" and resid 33   and name HA  ))
   (  segid "ATXH" and resid 33   and name HG2%)
      2.600     0.800     0.800 peak   364 spectrum    1 weight  0.10000E+01 volume  0.33945E-02 ppm1      0.647 ppm2      4.072 CV     1
 ASSI {  367}
   (( segid "ATXH" and resid 9    and name HB3 ))
   (  segid "ATXH" and resid 9    and name HD1%)
      3.000     1.200     1.200 peak   367 spectrum    1 weight  0.10000E+01 volume  0.33826E-02 ppm1      0.634 ppm2      1.265 CV     1
 ASSI {  368}
   (( segid "ATXH" and resid 68   and name HB2 ))
   (( segid "ATXH" and resid 68   and name HA  ))
      3.000     1.100     1.100 peak   368 spectrum    1 weight  0.10000E+01 volume  0.33826E-02 ppm1      4.657 ppm2      2.985 CV     1
 ASSI {  369}
   (( segid "ATXH" and resid 50   and name HB3 ))
   (  segid "ATXH" and resid 53   and name HG2%)
      2.800     1.000     1.000 peak   369 spectrum    1 weight  0.10000E+01 volume  0.33708E-02 ppm1      0.827 ppm2      2.456 CV     1
 OR {  369}
   (( segid "ATXH" and resid 50   and name HB3 ))
   (  segid "ATXH" and resid 53   and name HG1%)
 ASSI {  372}
   (( segid "ATXH" and resid 66   and name HB2 ))
   (( segid "ATXH" and resid 66   and name HA  ))
      2.900     1.000     1.000 peak   372 spectrum    1 weight  0.10000E+01 volume  0.33471E-02 ppm1      4.262 ppm2      2.486 CV     1
 OR {  372}
   (( segid "ATXH" and resid 66   and name HG3 ))
   (( segid "ATXH" and resid 66   and name HA  ))
 OR {  372}
   (( segid "ATXH" and resid 66   and name HG2 ))
   (( segid "ATXH" and resid 66   and name HA  ))
 ASSI {  373}
   (( segid "ATXH" and resid 10   and name HA  ))
   (  segid "ATXH" and resid 44   and name HG2%)
      2.600     0.900     0.900 peak   373 spectrum    1 weight  0.10000E+01 volume  0.33114E-02 ppm1      0.934 ppm2      4.679 CV     1
 ASSI {  375}
   (  segid "ATXH" and resid 11   and name HG1%)
   (  segid "ATXH" and resid 14   and name HE% )
      2.700     0.900     0.900 peak   375 spectrum    1 weight  0.10000E+01 volume  0.32877E-02 ppm1      1.773 ppm2      0.633 CV     1
 ASSI {  379}
   (  segid "ATXH" and resid 38   and name HG1%)
   (( segid "ATXH" and resid 38   and name HA  ))
      2.800     1.000     1.000 peak   379 spectrum    1 weight  0.10000E+01 volume  0.32758E-02 ppm1      4.302 ppm2      0.922 CV     1
 ASSI {  384}
   (( segid "ATXH" and resid 57   and name HD3 ))
   (( segid "ATXH" and resid 61   and name HA  ))
      3.000     1.100     1.100 peak   384 spectrum    1 weight  0.10000E+01 volume  0.31928E-02 ppm1      4.189 ppm2      1.588 CV     1
 OR {  384}
   (( segid "ATXH" and resid 57   and name HD2 ))
   (( segid "ATXH" and resid 61   and name HA  ))
 ASSI {  385}
   (  segid "ATXH" and resid 70   and name HG2%)
   (( segid "ATXH" and resid 11   and name HA  ))
      2.700     0.900     0.900 peak   385 spectrum    1 weight  0.10000E+01 volume  0.31809E-02 ppm1      4.764 ppm2      0.961 CV     1
 OR {  385}
   (  segid "ATXH" and resid 70   and name HG1%)
   (( segid "ATXH" and resid 11   and name HA  ))
 ASSI {  387}
   (( segid "ATXH" and resid 37   and name HG3 ))
   (( segid "ATXH" and resid 37   and name HE2 ))
      2.900     1.000     1.000 peak   387 spectrum    1 weight  0.10000E+01 volume  0.31690E-02 ppm1      2.862 ppm2      1.227 CV     1
 OR {  387}
   (( segid "ATXH" and resid 37   and name HG2 ))
   (( segid "ATXH" and resid 37   and name HE2 ))
 OR {  387}
   (( segid "ATXH" and resid 37   and name HG3 ))
   (( segid "ATXH" and resid 37   and name HE3 ))
 OR {  387}
   (( segid "ATXH" and resid 37   and name HG2 ))
   (( segid "ATXH" and resid 37   and name HE3 ))
 ASSI {  390}
   (( segid "ATXH" and resid 39   and name HA  ))
   (( segid "ATXH" and resid 39   and name HB3 ))
      2.600     0.800     0.800 peak   390 spectrum    1 weight  0.10000E+01 volume  0.31453E-02 ppm1      2.025 ppm2      4.751 CV     1
 ASSI {  395}
   (( segid "ATXH" and resid 59   and name HG12))
   (( segid "ATXH" and resid 59   and name HB  ))
      2.700     0.900     0.900 peak   395 spectrum    1 weight  0.10000E+01 volume  0.30978E-02 ppm1      2.011 ppm2      1.551 CV     1
 ASSI {  397}
   (( segid "ATXH" and resid 57   and name HA  ))
   (  segid "ATXH" and resid 60   and name HG1%)
      3.300     1.300     1.300 peak   397 spectrum    1 weight  0.10000E+01 volume  0.30741E-02 ppm1      0.971 ppm2      3.853 CV     1
 ASSI {  400}
   (( segid "ATXH" and resid 59   and name HG13))
   (  segid "ATXH" and resid 59   and name HD1%)
      2.600     0.900     0.900 peak   400 spectrum    1 weight  0.10000E+01 volume  0.30622E-02 ppm1      0.678 ppm2      1.146 CV     1
 ASSI {  401}
   (( segid "ATXH" and resid 14   and name HB3 ))
   (( segid "ATXH" and resid 14   and name HB2 ))
      2.400     0.700     0.700 peak   401 spectrum    1 weight  0.10000E+01 volume  0.30504E-02 ppm1      2.320 ppm2      1.430 CV     1
 ASSI {  407}
   (( segid "ATXH" and resid 43   and name HA1 ))
   (  segid "ATXH" and resid 14   and name HE% )
      2.600     0.900     0.900 peak   407 spectrum    1 weight  0.10000E+01 volume  0.30147E-02 ppm1      1.773 ppm2      3.625 CV     1
 ASSI {  408}
   (  segid "ATXH" and resid 9    and name HD2%)
   (( segid "ATXH" and resid 9    and name HB3 ))
      2.600     0.900     0.900 peak   408 spectrum    1 weight  0.10000E+01 volume  0.30147E-02 ppm1      1.252 ppm2      0.699 CV     1
 ASSI {  409}
   (( segid "ATXH" and resid 9    and name HB3 ))
   (( segid "ATXH" and resid 9    and name HA  ))
      2.600     0.900     0.900 peak   409 spectrum    1 weight  0.10000E+01 volume  0.30028E-02 ppm1      4.855 ppm2      1.245 CV     1
 ASSI {  411}
   (( segid "ATXH" and resid 51   and name HA  ))
   (  segid "ATXH" and resid 49   and name HD1%)
      2.800     1.000     1.000 peak   411 spectrum    1 weight  0.10000E+01 volume  0.29672E-02 ppm1      0.649 ppm2      4.909 CV     1
 ASSI {  414}
   (  segid "ATXH" and resid 49   and name HD1%)
   (( segid "ATXH" and resid 51   and name HB2 ))
      2.900     1.100     1.100 peak   414 spectrum    1 weight  0.10000E+01 volume  0.29316E-02 ppm1      4.197 ppm2      0.651 CV     1
 ASSI {  416}
   (( segid "ATXH" and resid 71   and name HG3 ))
   (( segid "ATXH" and resid 71   and name HA  ))
      2.900     1.100     1.100 peak   416 spectrum    1 weight  0.10000E+01 volume  0.29079E-02 ppm1      4.513 ppm2      2.284 CV     1
 OR {  416}
   (( segid "ATXH" and resid 71   and name HG2 ))
   (( segid "ATXH" and resid 71   and name HA  ))
 ASSI {  418}
   (( segid "ATXH" and resid 30   and name HB3 ))
   (  segid "ATXH" and resid 59   and name HD1%)
      2.700     0.900     0.900 peak   418 spectrum    1 weight  0.10000E+01 volume  0.29079E-02 ppm1      0.690 ppm2      1.324 CV     1
 ASSI {  421}
   (( segid "ATXH" and resid 42   and name HA  ))
   (( segid "ATXH" and resid 42   and name HB2 ))
      2.900     1.100     1.100 peak   421 spectrum    1 weight  0.10000E+01 volume  0.28485E-02 ppm1      2.095 ppm2      4.232 CV     1
 ASSI {  422}
   (( segid "ATXH" and resid 5    and name HA  ))
   (( segid "ATXH" and resid 5    and name HB3 ))
      2.700     0.900     0.900 peak   422 spectrum    1 weight  0.10000E+01 volume  0.28485E-02 ppm1      1.825 ppm2      4.627 CV     1
 ASSI {  423}
   (( segid "ATXH" and resid 58   and name HB2 ))
   (  segid "ATXH" and resid 54   and name HG1%)
      3.200     1.300     1.300 peak   423 spectrum    1 weight  0.10000E+01 volume  0.28485E-02 ppm1      1.160 ppm2      3.017 CV     1
 ASSI {  424}
   (( segid "ATXH" and resid 59   and name HG12))
   (  segid "ATXH" and resid 59   and name HG2%)
      3.000     1.100     1.100 peak   424 spectrum    1 weight  0.10000E+01 volume  0.28485E-02 ppm1      0.755 ppm2      1.559 CV     1
 ASSI {  426}
   (( segid "ATXH" and resid 56   and name HA  ))
   (( segid "ATXH" and resid 56   and name HB2 ))
      2.900     1.000     1.000 peak   426 spectrum    1 weight  0.10000E+01 volume  0.28367E-02 ppm1      1.752 ppm2      3.870 CV     1
 ASSI {  427}
   (( segid "ATXH" and resid 36   and name HA  ))
   (( segid "ATXH" and resid 47   and name HB  ))
      3.500     1.500     1.500 peak   427 spectrum    1 weight  0.10000E+01 volume  0.28367E-02 ppm1      1.890 ppm2      4.953 CV     1
 ASSI {  429}
   (( segid "ATXH" and resid 17   and name HA1 ))
   (( segid "ATXH" and resid 40   and name HG  ))
      2.700     0.900     0.900 peak   429 spectrum    1 weight  0.10000E+01 volume  0.28248E-02 ppm1      1.565 ppm2      3.863 CV     1
 ASSI {  431}
   (  segid "ATXH" and resid 48   and name HG2%)
   (( segid "ATXH" and resid 34   and name HB3 ))
      2.800     1.000     1.000 peak   431 spectrum    1 weight  0.10000E+01 volume  0.28129E-02 ppm1      1.648 ppm2      1.104 CV     1
 ASSI {  434}
   (( segid "ATXH" and resid 53   and name HB  ))
   (( segid "ATXH" and resid 32   and name HA1 ))
      2.800     1.000     1.000 peak   434 spectrum    1 weight  0.10000E+01 volume  0.27655E-02 ppm1      3.673 ppm2      1.994 CV     1
 ASSI {  436}
   (( segid "ATXH" and resid 4    and name HG3 ))
   (( segid "ATXH" and resid 4    and name HA  ))
      3.200     1.300     1.300 peak   436 spectrum    1 weight  0.10000E+01 volume  0.27418E-02 ppm1      5.179 ppm2      2.453 CV     1
 ASSI {  437}
   (( segid "ATXH" and resid 37   and name HB2 ))
   (( segid "ATXH" and resid 37   and name HA  ))
      2.900     1.100     1.100 peak   437 spectrum    1 weight  0.10000E+01 volume  0.27418E-02 ppm1      4.701 ppm2      1.749 CV     1
 ASSI {  438}
   (( segid "ATXH" and resid 45   and name HB  ))
   (  segid "ATXH" and resid 9    and name HD1%)
      2.800     1.000     1.000 peak   438 spectrum    1 weight  0.10000E+01 volume  0.27418E-02 ppm1      0.634 ppm2      1.729 CV     1
 ASSI {  446}
   (( segid "ATXH" and resid 46   and name HG3 ))
   (( segid "ATXH" and resid 8    and name HA  ))
      3.000     1.200     1.200 peak   446 spectrum    1 weight  0.10000E+01 volume  0.26942E-02 ppm1      4.855 ppm2      2.107 CV     1
 ASSI {  447}
   (( segid "ATXH" and resid 45   and name HB  ))
   (( segid "ATXH" and resid 9    and name HB3 ))
      3.200     1.300     1.300 peak   447 spectrum    1 weight  0.10000E+01 volume  0.26942E-02 ppm1      1.257 ppm2      1.716 CV     1
 ASSI {  448}
   (( segid "ATXH" and resid 40   and name HA  ))
   (( segid "ATXH" and resid 40   and name HB2 ))
      2.700     0.900     0.900 peak   448 spectrum    1 weight  0.10000E+01 volume  0.26942E-02 ppm1      1.599 ppm2      3.810 CV     1
 ASSI {  449}
   (( segid "ATXH" and resid 53   and name HB  ))
   (( segid "ATXH" and resid 53   and name HA  ))
      2.800     1.000     1.000 peak   449 spectrum    1 weight  0.10000E+01 volume  0.26824E-02 ppm1      4.149 ppm2      1.997 CV     1
 ASSI {  450}
   (( segid "ATXH" and resid 28   and name HB3 ))
   (( segid "ATXH" and resid 25   and name HA  ))
      2.600     0.800     0.800 peak   450 spectrum    1 weight  0.10000E+01 volume  0.26824E-02 ppm1      4.047 ppm2      1.847 CV     1
 OR {  450}
   (( segid "ATXH" and resid 28   and name HB2 ))
   (( segid "ATXH" and resid 25   and name HA  ))
 ASSI {  452}
   (( segid "ATXH" and resid 59   and name HB  ))
   (( segid "ATXH" and resid 59   and name HA  ))
      2.900     1.000     1.000 peak   452 spectrum    1 weight  0.10000E+01 volume  0.26705E-02 ppm1      3.500 ppm2      2.011 CV     1
 ASSI {  456}
   (( segid "ATXH" and resid 68   and name HB3 ))
   (( segid "ATXH" and resid 68   and name HA  ))
      2.700     0.900     0.900 peak   456 spectrum    1 weight  0.10000E+01 volume  0.26349E-02 ppm1      4.657 ppm2      2.292 CV     1
 ASSI {  457}
   (( segid "ATXH" and resid 37   and name HA  ))
   (( segid "ATXH" and resid 37   and name HB3 ))
      2.700     0.900     0.900 peak   457 spectrum    1 weight  0.10000E+01 volume  0.26349E-02 ppm1      1.614 ppm2      4.704 CV     1
 ASSI {  460}
   (( segid "ATXH" and resid 11   and name HA  ))
   (  segid "ATXH" and resid 11   and name HG2%)
      2.900     1.000     1.000 peak   460 spectrum    1 weight  0.10000E+01 volume  0.26112E-02 ppm1      0.701 ppm2      4.758 CV     1
 ASSI {  462}
   (  segid "ATXH" and resid 63   and name HG2%)
   (( segid "ATXH" and resid 63   and name HA  ))
      2.800     1.000     1.000 peak   462 spectrum    1 weight  0.10000E+01 volume  0.25993E-02 ppm1      3.472 ppm2      0.764 CV     1
 ASSI {  463}
   (( segid "ATXH" and resid 63   and name HG13))
   (( segid "ATXH" and resid 63   and name HA  ))
      3.000     1.100     1.100 peak   463 spectrum    1 weight  0.10000E+01 volume  0.25993E-02 ppm1      3.471 ppm2      0.564 CV     1
 OR {  463}
   (  segid "ATXH" and resid 63   and name HD1%)
   (( segid "ATXH" and resid 63   and name HA  ))
 ASSI {  464}
   (( segid "ATXH" and resid 66   and name HA  ))
   (  segid "ATXH" and resid 22   and name HB% )
      3.100     3.100     2.900 peak   464 spectrum    1 weight  0.10000E+01 volume  0.25993E-02 ppm1      1.583 ppm2      4.264 CV     1
 ASSI {  467}
   (( segid "ATXH" and resid 2    and name HA  ))
   (( segid "ATXH" and resid 2    and name HB2 ))
      2.900     1.000     1.000 peak   467 spectrum    1 weight  0.10000E+01 volume  0.25637E-02 ppm1      2.834 ppm2      4.701 CV     1
 ASSI {  469}
   (  segid "ATXH" and resid 63   and name HD1%)
   (( segid "ATXH" and resid 60   and name HA  ))
      2.800     0.900     0.900 peak   469 spectrum    1 weight  0.10000E+01 volume  0.25518E-02 ppm1      3.252 ppm2      0.577 CV     1
 OR {  469}
   (( segid "ATXH" and resid 63   and name HG13))
   (( segid "ATXH" and resid 60   and name HA  ))
 ASSI {  471}
   (( segid "ATXH" and resid 2    and name HB3 ))
   (( segid "ATXH" and resid 2    and name HA  ))
      3.000     1.100     1.100 peak   471 spectrum    1 weight  0.10000E+01 volume  0.25518E-02 ppm1      4.700 ppm2      2.746 CV     1
 ASSI {  472}
   (( segid "ATXH" and resid 45   and name HB  ))
   (  segid "ATXH" and resid 45   and name HG1%)
      2.700     0.900     0.900 peak   472 spectrum    1 weight  0.10000E+01 volume  0.25518E-02 ppm1      0.778 ppm2      1.764 CV     1
 ASSI {  473}
   (  segid "ATXH" and resid 49   and name HD1%)
   (( segid "ATXH" and resid 51   and name HB3 ))
      2.900     1.100     1.100 peak   473 spectrum    1 weight  0.10000E+01 volume  0.25518E-02 ppm1      3.805 ppm2      0.653 CV     1
 ASSI {  474}
   (  segid "ATXH" and resid 38   and name HG2%)
   (( segid "ATXH" and resid 20   and name HA  ))
      2.800     1.000     1.000 peak   474 spectrum    1 weight  0.10000E+01 volume  0.25162E-02 ppm1      3.542 ppm2      0.784 CV     1
 ASSI {  477}
   (( segid "ATXH" and resid 63   and name HG12))
   (( segid "ATXH" and resid 63   and name HG13))
      2.300     0.700     0.700 peak   477 spectrum    1 weight  0.10000E+01 volume  0.25043E-02 ppm1      0.572 ppm2      0.912 CV     1
 ASSI {  482}
   (  segid "ATXH" and resid 23   and name HG2%)
   (( segid "ATXH" and resid 20   and name HA  ))
      2.700     0.900     0.900 peak   482 spectrum    1 weight  0.10000E+01 volume  0.24688E-02 ppm1      3.542 ppm2      0.578 CV     1
 ASSI {  483}
   (( segid "ATXH" and resid 60   and name HA  ))
   (( segid "ATXH" and resid 60   and name HB  ))
      2.900     1.100     1.100 peak   483 spectrum    1 weight  0.10000E+01 volume  0.24688E-02 ppm1      2.006 ppm2      3.255 CV     1
 ASSI {  484}
   (( segid "ATXH" and resid 28   and name HA  ))
   (  segid "ATXH" and resid 33   and name HG1%)
      2.700     0.900     0.900 peak   484 spectrum    1 weight  0.10000E+01 volume  0.24569E-02 ppm1      0.828 ppm2      3.813 CV     1
 ASSI {  485}
   (( segid "ATXH" and resid 30   and name HA  ))
   (( segid "ATXH" and resid 30   and name HB2 ))
      2.900     1.100     1.100 peak   485 spectrum    1 weight  0.10000E+01 volume  0.24569E-02 ppm1      1.991 ppm2      4.176 CV     1
 ASSI {  487}
   (( segid "ATXH" and resid 30   and name HA  ))
   (( segid "ATXH" and resid 31   and name HB2 ))
      3.500     1.500     1.500 peak   487 spectrum    1 weight  0.10000E+01 volume  0.24569E-02 ppm1      2.726 ppm2      4.170 CV     1
 ASSI {  488}
   (  segid "ATXH" and resid 38   and name HG2%)
   (( segid "ATXH" and resid 38   and name HA  ))
      2.800     0.900     0.900 peak   488 spectrum    1 weight  0.10000E+01 volume  0.24450E-02 ppm1      4.302 ppm2      0.814 CV     1
 ASSI {  493}
   (( segid "ATXH" and resid 60   and name HA  ))
   (( segid "ATXH" and resid 63   and name HB  ))
      2.700     0.900     0.900 peak   493 spectrum    1 weight  0.10000E+01 volume  0.23738E-02 ppm1      1.795 ppm2      3.251 CV     1
 ASSI {  494}
   (( segid "ATXH" and resid 68   and name HB3 ))
   (  segid "ATXH" and resid 63   and name HG2%)
      3.400     1.400     1.400 peak   494 spectrum    1 weight  0.10000E+01 volume  0.23619E-02 ppm1      0.771 ppm2      2.292 CV     1
 ASSI {  496}
   (( segid "ATXH" and resid 59   and name HG13))
   (( segid "ATXH" and resid 59   and name HB  ))
      2.700     0.900     0.900 peak   496 spectrum    1 weight  0.10000E+01 volume  0.23619E-02 ppm1      2.007 ppm2      1.125 CV     1
 ASSI {  499}
   (  segid "ATXH" and resid 60   and name HG1%)
   (( segid "ATXH" and resid 59   and name HB  ))
      3.600     1.600     1.600 peak   499 spectrum    1 weight  0.10000E+01 volume  0.23500E-02 ppm1      2.007 ppm2      0.979 CV     1
 ASSI {  501}
   (( segid "ATXH" and resid 56   and name HA  ))
   (( segid "ATXH" and resid 59   and name HB  ))
      2.900     1.000     1.000 peak   501 spectrum    1 weight  0.10000E+01 volume  0.23263E-02 ppm1      2.011 ppm2      3.873 CV     1
 ASSI {  503}
   (  segid "ATXH" and resid 68   and name HD% )
   (( segid "ATXH" and resid 68   and name HB2 ))
      2.700     0.900     0.900 peak   503 spectrum    1 weight  0.10000E+01 volume  0.23026E-02 ppm1      3.002 ppm2      6.884 CV     1
 ASSI {  506}
   (( segid "ATXH" and resid 48   and name HA  ))
   (( segid "ATXH" and resid 48   and name HB  ))
      2.900     1.100     1.100 peak   506 spectrum    1 weight  0.10000E+01 volume  0.22670E-02 ppm1      3.877 ppm2      5.226 CV     1
 ASSI {  507}
   (( segid "ATXH" and resid 29   and name HG3 ))
   (( segid "ATXH" and resid 29   and name HA  ))
      3.200     1.300     1.300 peak   507 spectrum    1 weight  0.10000E+01 volume  0.22670E-02 ppm1      4.051 ppm2      2.326 CV     1
 ASSI {  509}
   (  segid "ATXH" and resid 14   and name HE% )
   (  segid "ATXH" and resid 40   and name HD1%)
      3.300     1.300     1.300 peak   509 spectrum    1 weight  0.10000E+01 volume  0.22551E-02 ppm1      0.822 ppm2      1.755 CV     1
 ASSI {  510}
   (( segid "ATXH" and resid 7    and name HA  ))
   (( segid "ATXH" and resid 7    and name HB2 ))
      3.000     1.100     1.100 peak   510 spectrum    1 weight  0.10000E+01 volume  0.22551E-02 ppm1      1.588 ppm2      4.843 CV     1
 ASSI {  511}
   (  segid "ATXH" and resid 7    and name HD1%)
   (( segid "ATXH" and resid 7    and name HB2 ))
      2.900     1.000     1.000 peak   511 spectrum    1 weight  0.10000E+01 volume  0.22313E-02 ppm1      1.587 ppm2      0.787 CV     1
 OR {  511}
   (( segid "ATXH" and resid 7    and name HG  ))
   (( segid "ATXH" and resid 7    and name HB2 ))
 ASSI {  512}
   (( segid "ATXH" and resid 42   and name HG3 ))
   (( segid "ATXH" and resid 42   and name HA  ))
      3.100     1.200     1.200 peak   512 spectrum    1 weight  0.10000E+01 volume  0.22195E-02 ppm1      4.233 ppm2      2.260 CV     1
 ASSI {  513}
   (( segid "ATXH" and resid 61   and name HA  ))
   (( segid "ATXH" and resid 64   and name HB2 ))
      2.900     1.000     1.000 peak   513 spectrum    1 weight  0.10000E+01 volume  0.22195E-02 ppm1      2.099 ppm2      4.195 CV     1
 ASSI {  515}
   (( segid "ATXH" and resid 7    and name HB3 ))
   (  segid "ATXH" and resid 9    and name HD1%)
      2.900     1.100     1.100 peak   515 spectrum    1 weight  0.10000E+01 volume  0.22195E-02 ppm1      0.638 ppm2      1.410 CV     1
 ASSI {  516}
   (( segid "ATXH" and resid 54   and name HB  ))
   (( segid "ATXH" and resid 32   and name HA2 ))
      2.600     0.900     0.900 peak   516 spectrum    1 weight  0.10000E+01 volume  0.22195E-02 ppm1      4.226 ppm2      2.371 CV     1
 ASSI {  518}
   (( segid "ATXH" and resid 6    and name HA  ))
   (( segid "ATXH" and resid 6    and name HB3 ))
      2.800     1.000     1.000 peak   518 spectrum    1 weight  0.10000E+01 volume  0.21839E-02 ppm1      1.874 ppm2      5.199 CV     1
 ASSI {  521}
   (( segid "ATXH" and resid 34   and name HB3 ))
   (( segid "ATXH" and resid 48   and name HB  ))
      2.700     0.900     0.900 peak   521 spectrum    1 weight  0.10000E+01 volume  0.21720E-02 ppm1      3.879 ppm2      1.648 CV     1
 ASSI {  522}
   (( segid "ATXH" and resid 54   and name HA  ))
   (( segid "ATXH" and resid 31   and name HB2 ))
      2.600     2.600     3.400 peak   522 spectrum    1 weight  0.10000E+01 volume  0.21602E-02 ppm1      2.714 ppm2      4.673 CV     1
 ASSI {  524}
   (( segid "ATXH" and resid 8    and name HB  ))
   (( segid "ATXH" and resid 8    and name HA  ))
      3.000     1.100     1.100 peak   524 spectrum    1 weight  0.10000E+01 volume  0.21483E-02 ppm1      4.860 ppm2      3.855 CV     1
 ASSI {  525}
   (( segid "ATXH" and resid 47   and name HA  ))
   (( segid "ATXH" and resid 47   and name HB  ))
      2.900     1.100     1.100 peak   525 spectrum    1 weight  0.10000E+01 volume  0.21483E-02 ppm1      1.886 ppm2      5.063 CV     1
 ASSI {  527}
   (( segid "ATXH" and resid 42   and name HA  ))
   (( segid "ATXH" and resid 42   and name HG2 ))
      3.100     1.200     1.200 peak   527 spectrum    1 weight  0.10000E+01 volume  0.21246E-02 ppm1      2.169 ppm2      4.232 CV     1
 ASSI {  528}
   (( segid "ATXH" and resid 28   and name HA  ))
   (  segid "ATXH" and resid 36   and name HG1%)
      3.000     1.200     1.200 peak   528 spectrum    1 weight  0.10000E+01 volume  0.21246E-02 ppm1      0.785 ppm2      3.759 CV     1
 ASSI {  532}
   (( segid "ATXH" and resid 40   and name HA  ))
   (  segid "ATXH" and resid 40   and name HD1%)
      3.100     1.200     1.200 peak   532 spectrum    1 weight  0.10000E+01 volume  0.21008E-02 ppm1      0.824 ppm2      3.816 CV     1
 ASSI {  533}
   (( segid "ATXH" and resid 30   and name HB3 ))
   (( segid "ATXH" and resid 30   and name HG  ))
      3.000     1.100     1.100 peak   533 spectrum    1 weight  0.10000E+01 volume  0.20770E-02 ppm1      1.852 ppm2      1.313 CV     1
 ASSI {  534}
   (( segid "ATXH" and resid 69   and name HB3 ))
   (( segid "ATXH" and resid 69   and name HA  ))
      3.000     1.100     1.100 peak   534 spectrum    1 weight  0.10000E+01 volume  0.20770E-02 ppm1      4.944 ppm2      2.456 CV     1
 ASSI {  535}
   (( segid "ATXH" and resid 68   and name HA  ))
   (( segid "ATXH" and resid 64   and name HB3 ))
      3.400     3.400     2.600 peak   535 spectrum    1 weight  0.10000E+01 volume  0.20770E-02 ppm1      1.988 ppm2      4.657 CV     1
 ASSI {  536}
   (( segid "ATXH" and resid 58   and name HB3 ))
   (( segid "ATXH" and resid 54   and name HA  ))
      3.700     3.700     2.300 peak   536 spectrum    1 weight  0.10000E+01 volume  0.20652E-02 ppm1      4.650 ppm2      2.583 CV     1
 ASSI {  538}
   (( segid "ATXH" and resid 69   and name HA  ))
   (( segid "ATXH" and resid 69   and name HB2 ))
      3.100     1.200     1.200 peak   538 spectrum    1 weight  0.10000E+01 volume  0.20652E-02 ppm1      2.601 ppm2      4.938 CV     1
 ASSI {  539}
   (( segid "ATXH" and resid 33   and name HB  ))
   (( segid "ATXH" and resid 33   and name HA  ))
      3.000     1.100     1.100 peak   539 spectrum    1 weight  0.10000E+01 volume  0.20414E-02 ppm1      4.075 ppm2      2.268 CV     1
 ASSI {  540}
   (( segid "ATXH" and resid 62   and name HA  ))
   (( segid "ATXH" and resid 65   and name HB3 ))
      2.900     1.000     1.000 peak   540 spectrum    1 weight  0.10000E+01 volume  0.20177E-02 ppm1      2.664 ppm2      3.868 CV     1
 ASSI {  543}
   (  segid "ATXH" and resid 20   and name HG1%)
   (( segid "ATXH" and resid 20   and name HA  ))
      3.000     1.100     1.100 peak   543 spectrum    1 weight  0.10000E+01 volume  0.20177E-02 ppm1      3.530 ppm2      1.075 CV     1
 ASSI {  545}
   (( segid "ATXH" and resid 50   and name HB2 ))
   (( segid "ATXH" and resid 53   and name HB  ))
      3.700     1.700     1.700 peak   545 spectrum    1 weight  0.10000E+01 volume  0.19940E-02 ppm1      1.998 ppm2      2.946 CV     1
 ASSI {  547}
   (( segid "ATXH" and resid 64   and name HA  ))
   (( segid "ATXH" and resid 64   and name HB2 ))
      3.100     1.200     1.200 peak   547 spectrum    1 weight  0.10000E+01 volume  0.19821E-02 ppm1      2.105 ppm2      4.569 CV     1
 ASSI {  549}
   (( segid "ATXH" and resid 4    and name HB3 ))
   (( segid "ATXH" and resid 4    and name HA  ))
      2.800     1.000     1.000 peak   549 spectrum    1 weight  0.10000E+01 volume  0.19703E-02 ppm1      5.173 ppm2      1.790 CV     1
 ASSI {  550}
   (  segid "ATXH" and resid 23   and name HD1%)
   (  segid "ATXH" and resid 23   and name HG2%)
      2.800     1.000     1.000 peak   550 spectrum    1 weight  0.10000E+01 volume  0.19703E-02 ppm1      0.564 ppm2      0.148 CV     1
 ASSI {  552}
   (( segid "ATXH" and resid 23   and name HG12))
   (  segid "ATXH" and resid 63   and name HD1%)
      3.200     1.300     1.300 peak   552 spectrum    1 weight  0.10000E+01 volume  0.19584E-02 ppm1      0.565 ppm2      1.573 CV     1
 OR {  552}
   (( segid "ATXH" and resid 23   and name HG13))
   (  segid "ATXH" and resid 63   and name HD1%)
 ASSI {  553}
   (  segid "ATXH" and resid 68   and name HE% )
   (( segid "ATXH" and resid 68   and name HA  ))
      2.600     2.600     3.400 peak   553 spectrum    1 weight  0.10000E+01 volume  0.19465E-02 ppm1      4.634 ppm2      6.872 CV     1
 ASSI {  555}
   (( segid "ATXH" and resid 69   and name HB2 ))
   (( segid "ATXH" and resid 12   and name HB2 ))
      3.000     3.000     3.000 peak   555 spectrum    1 weight  0.10000E+01 volume  0.19465E-02 ppm1      2.138 ppm2      2.599 CV     1
 ASSI {  556}
   (( segid "ATXH" and resid 23   and name HG13))
   (  segid "ATXH" and resid 23   and name HD1%)
      2.800     1.000     1.000 peak   556 spectrum    1 weight  0.10000E+01 volume  0.19346E-02 ppm1      0.146 ppm2      1.589 CV     1
 OR {  556}
   (( segid "ATXH" and resid 23   and name HG12))
   (  segid "ATXH" and resid 23   and name HD1%)
 ASSI {  558}
   (( segid "ATXH" and resid 4    and name HG3 ))
   (  segid "ATXH" and resid 4    and name HE% )
      3.000     1.200     1.200 peak   558 spectrum    1 weight  0.10000E+01 volume  0.19227E-02 ppm1      1.915 ppm2      2.456 CV     1
 ASSI {  559}
   (( segid "ATXH" and resid 34   and name HG2 ))
   (  segid "ATXH" and resid 4    and name HE% )
      2.900     1.100     1.100 peak   559 spectrum    1 weight  0.10000E+01 volume  0.19109E-02 ppm1      1.915 ppm2      2.198 CV     1
 ASSI {  560}
   (  segid "ATXH" and resid 49   and name HD1%)
   (( segid "ATXH" and resid 5    and name HB2 ))
      3.000     1.100     1.100 peak   560 spectrum    1 weight  0.10000E+01 volume  0.19109E-02 ppm1      1.985 ppm2      0.656 CV     1
 ASSI {  564}
   (( segid "ATXH" and resid 39   and name HA  ))
   (( segid "ATXH" and resid 37   and name HB3 ))
      3.000     3.000     3.000 peak   564 spectrum    1 weight  0.10000E+01 volume  0.18871E-02 ppm1      1.589 ppm2      4.762 CV     1
 ASSI {  565}
   (( segid "ATXH" and resid 9    and name HA  ))
   (( segid "ATXH" and resid 9    and name HB2 ))
      3.100     1.200     1.200 peak   565 spectrum    1 weight  0.10000E+01 volume  0.18753E-02 ppm1      1.567 ppm2      4.818 CV     1
 ASSI {  567}
   (( segid "ATXH" and resid 35   and name HB2 ))
   (( segid "ATXH" and resid 48   and name HB  ))
      3.000     1.200     1.200 peak   567 spectrum    1 weight  0.10000E+01 volume  0.18634E-02 ppm1      3.885 ppm2      2.256 CV     1
 OR {  567}
   (( segid "ATXH" and resid 35   and name HG2 ))
   (( segid "ATXH" and resid 48   and name HB  ))
 ASSI {  568}
   (( segid "ATXH" and resid 40   and name HA  ))
   (  segid "ATXH" and resid 40   and name HD2%)
      3.000     1.100     1.100 peak   568 spectrum    1 weight  0.10000E+01 volume  0.18634E-02 ppm1      0.782 ppm2      3.813 CV     1
 ASSI {  569}
   (( segid "ATXH" and resid 4    and name HA  ))
   (( segid "ATXH" and resid 4    and name HG2 ))
      3.100     1.200     1.200 peak   569 spectrum    1 weight  0.10000E+01 volume  0.18634E-02 ppm1      2.637 ppm2      5.182 CV     1
 ASSI {  571}
   (( segid "ATXH" and resid 49   and name HG13))
   (( segid "ATXH" and resid 5    and name HB3 ))
      3.400     1.500     1.500 peak   571 spectrum    1 weight  0.10000E+01 volume  0.18397E-02 ppm1      1.829 ppm2      1.427 CV     1
 ASSI {  573}
   (( segid "ATXH" and resid 23   and name HG12))
   (( segid "ATXH" and resid 63   and name HG13))
      3.900     1.900     1.900 peak   573 spectrum    1 weight  0.10000E+01 volume  0.18278E-02 ppm1      0.572 ppm2      1.592 CV     1
 OR {  573}
   (( segid "ATXH" and resid 23   and name HG13))
   (( segid "ATXH" and resid 63   and name HG13))
 ASSI {  576}
   (  segid "ATXH" and resid 8    and name HG2%)
   (( segid "ATXH" and resid 44   and name HA  ))
      3.500     1.600     1.600 peak   576 spectrum    1 weight  0.10000E+01 volume  0.18160E-02 ppm1      5.495 ppm2      1.073 CV     1
 ASSI {  579}
   (  segid "ATXH" and resid 11   and name HG1%)
   (( segid "ATXH" and resid 68   and name HB3 ))
      3.000     1.100     1.100 peak   579 spectrum    1 weight  0.10000E+01 volume  0.18041E-02 ppm1      2.292 ppm2      0.655 CV     1
 OR {  579}
   (  segid "ATXH" and resid 11   and name HG2%)
   (( segid "ATXH" and resid 68   and name HB3 ))
 ASSI {  583}
   (( segid "ATXH" and resid 69   and name HB3 ))
   (( segid "ATXH" and resid 12   and name HB2 ))
      3.100     1.200     1.200 peak   583 spectrum    1 weight  0.10000E+01 volume  0.17803E-02 ppm1      2.132 ppm2      2.453 CV     1
 ASSI {  585}
   (( segid "ATXH" and resid 32   and name HA1 ))
   (( segid "ATXH" and resid 50   and name HB2 ))
      3.200     1.200     1.200 peak   585 spectrum    1 weight  0.10000E+01 volume  0.17803E-02 ppm1      2.946 ppm2      3.673 CV     1
 ASSI {  589}
   (( segid "ATXH" and resid 33   and name HB  ))
   (  segid "ATXH" and resid 49   and name HG2%)
      3.900     1.900     1.900 peak   589 spectrum    1 weight  0.10000E+01 volume  0.17685E-02 ppm1      0.728 ppm2      2.250 CV     1
 ASSI {  591}
   (( segid "ATXH" and resid 7    and name HB3 ))
   (  segid "ATXH" and resid 9    and name HD2%)
      2.900     2.900     3.100 peak   591 spectrum    1 weight  0.10000E+01 volume  0.17566E-02 ppm1      0.704 ppm2      1.389 CV     1
 ASSI {  592}
   (( segid "ATXH" and resid 49   and name HG13))
   (( segid "ATXH" and resid 5    and name HB2 ))
      2.700     0.900     0.900 peak   592 spectrum    1 weight  0.10000E+01 volume  0.17566E-02 ppm1      1.987 ppm2      1.432 CV     1
 ASSI {  594}
   (( segid "ATXH" and resid 34   and name HA  ))
   (( segid "ATXH" and resid 34   and name HG3 ))
      3.200     1.300     1.300 peak   594 spectrum    1 weight  0.10000E+01 volume  0.17447E-02 ppm1      2.090 ppm2      4.403 CV     1
 ASSI {  596}
   (  segid "ATXH" and resid 48   and name HG2%)
   (( segid "ATXH" and resid 6    and name HG2 ))
      3.200     1.200     1.200 peak   596 spectrum    1 weight  0.10000E+01 volume  0.17329E-02 ppm1      2.196 ppm2      1.100 CV     1
 ASSI {  597}
   (  segid "ATXH" and resid 49   and name HD1%)
   (( segid "ATXH" and resid 5    and name HB3 ))
      3.500     1.500     1.500 peak   597 spectrum    1 weight  0.10000E+01 volume  0.17329E-02 ppm1      1.824 ppm2      0.654 CV     1
 ASSI {  598}
   (( segid "ATXH" and resid 58   and name HA  ))
   (  segid "ATXH" and resid 62   and name HG2%)
      3.100     1.200     1.200 peak   598 spectrum    1 weight  0.10000E+01 volume  0.17210E-02 ppm1      0.923 ppm2      4.299 CV     1
 ASSI {  602}
   (( segid "ATXH" and resid 50   and name HB2 ))
   (  segid "ATXH" and resid 53   and name HG2%)
      3.700     1.700     1.700 peak   602 spectrum    1 weight  0.10000E+01 volume  0.16973E-02 ppm1      0.821 ppm2      2.945 CV     1
 OR {  602}
   (( segid "ATXH" and resid 50   and name HB2 ))
   (  segid "ATXH" and resid 53   and name HG1%)
 ASSI {  604}
   (  segid "ATXH" and resid 9    and name HD2%)
   (( segid "ATXH" and resid 9    and name HA  ))
      3.500     1.500     1.500 peak   604 spectrum    1 weight  0.10000E+01 volume  0.16854E-02 ppm1      4.858 ppm2      0.692 CV     1
 ASSI {  606}
   (( segid "ATXH" and resid 62   and name HB  ))
   (( segid "ATXH" and resid 59   and name HA  ))
      3.000     1.100     1.100 peak   606 spectrum    1 weight  0.10000E+01 volume  0.16735E-02 ppm1      3.501 ppm2      2.199 CV     1
 ASSI {  607}
   (( segid "ATXH" and resid 64   and name HA  ))
   (( segid "ATXH" and resid 64   and name HG2 ))
      3.000     1.100     1.100 peak   607 spectrum    1 weight  0.10000E+01 volume  0.16735E-02 ppm1      2.656 ppm2      4.564 CV     1
 ASSI {  608}
   (( segid "ATXH" and resid 27   and name HA  ))
   (  segid "ATXH" and resid 30   and name HD1%)
      3.400     1.400     1.400 peak   608 spectrum    1 weight  0.10000E+01 volume  0.16735E-02 ppm1      0.878 ppm2      3.703 CV     1
 ASSI {  609}
   (( segid "ATXH" and resid 45   and name HB  ))
   (( segid "ATXH" and resid 45   and name HA  ))
      3.100     1.200     1.200 peak   609 spectrum    1 weight  0.10000E+01 volume  0.16617E-02 ppm1      4.460 ppm2      1.733 CV     1
 ASSI {  612}
   (( segid "ATXH" and resid 40   and name HB2 ))
   (( segid "ATXH" and resid 40   and name HA  ))
      3.000     1.100     1.100 peak   612 spectrum    1 weight  0.10000E+01 volume  0.16617E-02 ppm1      3.811 ppm2      1.595 CV     1
 OR {  612}
   (( segid "ATXH" and resid 40   and name HG  ))
   (( segid "ATXH" and resid 40   and name HA  ))
 ASSI {  614}
   (( segid "ATXH" and resid 19   and name HA  ))
   (  segid "ATXH" and resid 22   and name HB% )
      3.000     1.100     1.100 peak   614 spectrum    1 weight  0.10000E+01 volume  0.16498E-02 ppm1      1.610 ppm2      4.086 CV     1
 ASSI {  619}
   (( segid "ATXH" and resid 59   and name HA  ))
   (  segid "ATXH" and resid 59   and name HD1%)
      3.100     1.200     1.200 peak   619 spectrum    1 weight  0.10000E+01 volume  0.16260E-02 ppm1      0.691 ppm2      3.499 CV     1
 ASSI {  622}
   (( segid "ATXH" and resid 59   and name HA  ))
   (  segid "ATXH" and resid 30   and name HD1%)
      3.100     1.200     1.200 peak   622 spectrum    1 weight  0.10000E+01 volume  0.16023E-02 ppm1      0.878 ppm2      3.499 CV     1
 ASSI {  623}
   (  segid "ATXH" and resid 11   and name HG1%)
   (( segid "ATXH" and resid 14   and name HB3 ))
      3.700     1.700     1.700 peak   623 spectrum    1 weight  0.10000E+01 volume  0.15904E-02 ppm1      1.436 ppm2      0.625 CV     1
 ASSI {  625}
   (  segid "ATXH" and resid 23   and name HD1%)
   (( segid "ATXH" and resid 23   and name HB  ))
      3.000     1.100     1.100 peak   625 spectrum    1 weight  0.10000E+01 volume  0.15904E-02 ppm1      1.734 ppm2      0.152 CV     1
 ASSI {  626}
   (( segid "ATXH" and resid 29   and name HB2 ))
   (( segid "ATXH" and resid 26   and name HA  ))
      3.200     1.200     1.200 peak   626 spectrum    1 weight  0.10000E+01 volume  0.15667E-02 ppm1      4.152 ppm2      2.023 CV     1
 OR {  626}
   (( segid "ATXH" and resid 29   and name HB3 ))
   (( segid "ATXH" and resid 26   and name HA  ))
 ASSI {  628}
   (( segid "ATXH" and resid 50   and name HB2 ))
   (( segid "ATXH" and resid 32   and name HA2 ))
      3.600     1.600     1.600 peak   628 spectrum    1 weight  0.10000E+01 volume  0.15667E-02 ppm1      4.225 ppm2      2.944 CV     1
 ASSI {  630}
   (( segid "ATXH" and resid 42   and name HA  ))
   (  segid "ATXH" and resid 41   and name HB% )
      3.300     1.400     1.400 peak   630 spectrum    1 weight  0.10000E+01 volume  0.15667E-02 ppm1      1.388 ppm2      4.224 CV     1
 ASSI {  633}
   (  segid "ATXH" and resid 45   and name HG2%)
   (( segid "ATXH" and resid 38   and name HA  ))
      3.000     1.100     1.100 peak   633 spectrum    1 weight  0.10000E+01 volume  0.15549E-02 ppm1      4.302 ppm2      0.590 CV     1
 ASSI {  638}
   (( segid "ATXH" and resid 64   and name HG2 ))
   (  segid "ATXH" and resid 70   and name HG1%)
      3.300     1.400     1.400 peak   638 spectrum    1 weight  0.10000E+01 volume  0.15311E-02 ppm1      0.969 ppm2      2.682 CV     1
 ASSI {  642}
   (  segid "ATXH" and resid 59   and name HD1%)
   (( segid "ATXH" and resid 59   and name HG13))
      3.000     1.100     1.100 peak   642 spectrum    1 weight  0.10000E+01 volume  0.15192E-02 ppm1      1.120 ppm2      0.695 CV     1
 OR {  642}
   (  segid "ATXH" and resid 59   and name HG2%)
   (( segid "ATXH" and resid 59   and name HG13))
 ASSI {  643}
   (( segid "ATXH" and resid 62   and name HB  ))
   (  segid "ATXH" and resid 30   and name HD1%)
      3.200     1.300     1.300 peak   643 spectrum    1 weight  0.10000E+01 volume  0.15192E-02 ppm1      0.879 ppm2      2.200 CV     1
 ASSI {  644}
   (( segid "ATXH" and resid 66   and name HA  ))
   (( segid "ATXH" and resid 66   and name HG3 ))
      3.300     1.300     1.300 peak   644 spectrum    1 weight  0.10000E+01 volume  0.15074E-02 ppm1      2.481 ppm2      4.261 CV     1
 OR {  644}
   (( segid "ATXH" and resid 66   and name HA  ))
   (( segid "ATXH" and resid 66   and name HG2 ))
 ASSI {  645}
   (( segid "ATXH" and resid 14   and name HB2 ))
   (  segid "ATXH" and resid 14   and name HE% )
      3.500     1.500     1.500 peak   645 spectrum    1 weight  0.10000E+01 volume  0.15074E-02 ppm1      1.779 ppm2      2.318 CV     1
 ASSI {  646}
   (( segid "ATXH" and resid 63   and name HA  ))
   (( segid "ATXH" and resid 63   and name HG13))
      3.200     1.300     1.300 peak   646 spectrum    1 weight  0.10000E+01 volume  0.14955E-02 ppm1      0.569 ppm2      3.455 CV     1
 ASSI {  650}
   (( segid "ATXH" and resid 50   and name HB3 ))
   (( segid "ATXH" and resid 32   and name HA1 ))
      3.000     1.100     1.100 peak   650 spectrum    1 weight  0.10000E+01 volume  0.14836E-02 ppm1      3.676 ppm2      2.445 CV     1
 ASSI {  651}
   (( segid "ATXH" and resid 15   and name HB2 ))
   (( segid "ATXH" and resid 15   and name HA  ))
      3.300     1.400     1.400 peak   651 spectrum    1 weight  0.10000E+01 volume  0.14717E-02 ppm1      4.718 ppm2      3.924 CV     1
 ASSI {  652}
   (( segid "ATXH" and resid 15   and name HB3 ))
   (( segid "ATXH" and resid 15   and name HA  ))
      3.100     1.200     1.200 peak   652 spectrum    1 weight  0.10000E+01 volume  0.14717E-02 ppm1      4.721 ppm2      3.788 CV     1
 ASSI {  658}
   (( segid "ATXH" and resid 63   and name HG12))
   (( segid "ATXH" and resid 63   and name HA  ))
      3.000     1.100     1.100 peak   658 spectrum    1 weight  0.10000E+01 volume  0.14361E-02 ppm1      3.475 ppm2      0.910 CV     1
 ASSI {  659}
   (( segid "ATXH" and resid 49   and name HG13))
   (  segid "ATXH" and resid 49   and name HG2%)
      3.600     1.600     1.600 peak   659 spectrum    1 weight  0.10000E+01 volume  0.14243E-02 ppm1      0.726 ppm2      1.430 CV     1
 ASSI {  660}
   (( segid "ATXH" and resid 27   and name HA  ))
   (( segid "ATXH" and resid 30   and name HG  ))
      3.100     1.200     1.200 peak   660 spectrum    1 weight  0.10000E+01 volume  0.14243E-02 ppm1      1.870 ppm2      3.704 CV     1
 ASSI {  663}
   (( segid "ATXH" and resid 27   and name HB  ))
   (( segid "ATXH" and resid 27   and name HA  ))
      3.200     1.300     1.300 peak   663 spectrum    1 weight  0.10000E+01 volume  0.14006E-02 ppm1      3.703 ppm2      2.045 CV     1
 ASSI {  665}
   (( segid "ATXH" and resid 10   and name HA  ))
   (( segid "ATXH" and resid 10   and name HB2 ))
      3.100     1.200     1.200 peak   665 spectrum    1 weight  0.10000E+01 volume  0.14006E-02 ppm1      2.091 ppm2      4.683 CV     1
 ASSI {  668}
   (( segid "ATXH" and resid 57   and name HA  ))
   (( segid "ATXH" and resid 57   and name HB3 ))
      3.300     1.400     1.400 peak   668 spectrum    1 weight  0.10000E+01 volume  0.13887E-02 ppm1      1.719 ppm2      3.839 CV     1
 ASSI {  669}
   (( segid "ATXH" and resid 59   and name HA  ))
   (  segid "ATXH" and resid 62   and name HG2%)
      3.200     1.300     1.300 peak   669 spectrum    1 weight  0.10000E+01 volume  0.13887E-02 ppm1      0.893 ppm2      3.504 CV     1
 ASSI {  670}
   (( segid "ATXH" and resid 64   and name HA  ))
   (( segid "ATXH" and resid 64   and name HG3 ))
      3.400     1.400     1.400 peak   670 spectrum    1 weight  0.10000E+01 volume  0.13768E-02 ppm1      2.450 ppm2      4.563 CV     1
 ASSI {  671}
   (( segid "ATXH" and resid 71   and name HB3 ))
   (( segid "ATXH" and resid 71   and name HA  ))
      3.200     1.300     1.300 peak   671 spectrum    1 weight  0.10000E+01 volume  0.13768E-02 ppm1      4.512 ppm2      1.983 CV     1
 ASSI {  672}
   (( segid "ATXH" and resid 40   and name HG  ))
   (  segid "ATXH" and resid 40   and name HD1%)
      3.200     1.300     1.300 peak   672 spectrum    1 weight  0.10000E+01 volume  0.13768E-02 ppm1      0.822 ppm2      1.594 CV     1
 OR {  672}
   (( segid "ATXH" and resid 40   and name HB2 ))
   (  segid "ATXH" and resid 40   and name HD1%)
 ASSI {  675}
   (( segid "ATXH" and resid 57   and name HA  ))
   (( segid "ATXH" and resid 57   and name HD3 ))
      3.200     1.300     1.300 peak   675 spectrum    1 weight  0.10000E+01 volume  0.13768E-02 ppm1      1.620 ppm2      3.836 CV     1
 OR {  675}
   (( segid "ATXH" and resid 57   and name HA  ))
   (( segid "ATXH" and resid 57   and name HD2 ))
 ASSI {  677}
   (  segid "ATXH" and resid 60   and name HG1%)
   (( segid "ATXH" and resid 56   and name HB3 ))
      3.500     1.500     1.500 peak   677 spectrum    1 weight  0.10000E+01 volume  0.13649E-02 ppm1      1.611 ppm2      0.968 CV     1
 ASSI {  678}
   (( segid "ATXH" and resid 48   and name HB  ))
   (( segid "ATXH" and resid 35   and name HG2 ))
      3.300     1.400     1.400 peak   678 spectrum    1 weight  0.10000E+01 volume  0.13649E-02 ppm1      2.264 ppm2      3.877 CV     1
 ASSI {  680}
   (( segid "ATXH" and resid 68   and name HA  ))
   (( segid "ATXH" and resid 64   and name HG3 ))
      3.800     1.800     1.800 peak   680 spectrum    1 weight  0.10000E+01 volume  0.13531E-02 ppm1      2.479 ppm2      4.678 CV     1
 ASSI {  681}
   (( segid "ATXH" and resid 46   and name HA  ))
   (( segid "ATXH" and resid 46   and name HB3 ))
      3.100     1.200     1.200 peak   681 spectrum    1 weight  0.10000E+01 volume  0.13412E-02 ppm1      1.898 ppm2      5.258 CV     1
 ASSI {  685}
   (( segid "ATXH" and resid 40   and name HG  ))
   (  segid "ATXH" and resid 40   and name HD2%)
      3.100     3.100     2.900 peak   685 spectrum    1 weight  0.10000E+01 volume  0.13293E-02 ppm1      0.783 ppm2      1.590 CV     1
 OR {  685}
   (( segid "ATXH" and resid 40   and name HG  ))
   (  segid "ATXH" and resid 40   and name HD1%)
 OR {  685}
   (( segid "ATXH" and resid 40   and name HB2 ))
   (  segid "ATXH" and resid 40   and name HD2%)
 ASSI {  687}
   (  segid "ATXH" and resid 11   and name HG1%)
   (( segid "ATXH" and resid 68   and name HB2 ))
      3.500     1.500     1.500 peak   687 spectrum    1 weight  0.10000E+01 volume  0.13174E-02 ppm1      2.994 ppm2      0.649 CV     1
 OR {  687}
   (  segid "ATXH" and resid 11   and name HG2%)
   (( segid "ATXH" and resid 68   and name HB2 ))
 ASSI {  689}
   (( segid "ATXH" and resid 6    and name HA  ))
   (( segid "ATXH" and resid 6    and name HB2 ))
      3.200     1.300     1.300 peak   689 spectrum    1 weight  0.10000E+01 volume  0.13174E-02 ppm1      1.996 ppm2      5.200 CV     1
 ASSI {  691}
   (  segid "ATXH" and resid 49   and name HG2%)
   (( segid "ATXH" and resid 48   and name HA  ))
      3.400     1.500     1.500 peak   691 spectrum    1 weight  0.10000E+01 volume  0.13056E-02 ppm1      5.232 ppm2      0.723 CV     1
 ASSI {  692}
   (  segid "ATXH" and resid 48   and name HG2%)
   (( segid "ATXH" and resid 4    and name HG2 ))
      2.800     1.000     1.000 peak   692 spectrum    1 weight  0.10000E+01 volume  0.13056E-02 ppm1      2.639 ppm2      1.103 CV     1
 ASSI {  693}
   (( segid "ATXH" and resid 56   and name HA  ))
   (  segid "ATXH" and resid 56   and name HD1%)
      3.400     1.400     1.400 peak   693 spectrum    1 weight  0.10000E+01 volume  0.12818E-02 ppm1      0.876 ppm2      3.863 CV     1
 ASSI {  698}
   (( segid "ATXH" and resid 53   and name HB  ))
   (( segid "ATXH" and resid 50   and name HB3 ))
      2.900     1.000     1.000 peak   698 spectrum    1 weight  0.10000E+01 volume  0.12344E-02 ppm1      2.464 ppm2      1.983 CV     1
 ASSI {  699}
   (( segid "ATXH" and resid 47   and name HA  ))
   (  segid "ATXH" and resid 47   and name HG2%)
      3.100     1.200     1.200 peak   699 spectrum    1 weight  0.10000E+01 volume  0.12344E-02 ppm1      0.802 ppm2      5.049 CV     1
 ASSI {  700}
   (  segid "ATXH" and resid 68   and name HE% )
   (( segid "ATXH" and resid 68   and name HB3 ))
      3.800     1.800     1.800 peak   700 spectrum    1 weight  0.10000E+01 volume  0.12344E-02 ppm1      2.265 ppm2      6.868 CV     1
 ASSI {  701}
   (( segid "ATXH" and resid 23   and name HG12))
   (( segid "ATXH" and resid 23   and name HA  ))
      3.100     1.200     1.200 peak   701 spectrum    1 weight  0.10000E+01 volume  0.12225E-02 ppm1      3.386 ppm2      1.631 CV     1
 OR {  701}
   (( segid "ATXH" and resid 23   and name HG13))
   (( segid "ATXH" and resid 23   and name HA  ))
 ASSI {  703}
   (  segid "ATXH" and resid 48   and name HG2%)
   (( segid "ATXH" and resid 4    and name HB3 ))
      3.000     1.100     1.100 peak   703 spectrum    1 weight  0.10000E+01 volume  0.12106E-02 ppm1      1.794 ppm2      1.105 CV     1
 ASSI {  705}
   (( segid "ATXH" and resid 25   and name HB2 ))
   (( segid "ATXH" and resid 25   and name HA  ))
      3.300     1.400     1.400 peak   705 spectrum    1 weight  0.10000E+01 volume  0.11988E-02 ppm1      4.047 ppm2      3.922 CV     1
 ASSI {  706}
   (  segid "ATXH" and resid 63   and name HG2%)
   (( segid "ATXH" and resid 68   and name HB2 ))
      3.000     1.100     1.100 peak   706 spectrum    1 weight  0.10000E+01 volume  0.11988E-02 ppm1      2.994 ppm2      0.762 CV     1
 ASSI {  707}
   (( segid "ATXH" and resid 28   and name HE2 ))
   (( segid "ATXH" and resid 28   and name HG2 ))
      3.300     1.400     1.400 peak   707 spectrum    1 weight  0.10000E+01 volume  0.11988E-02 ppm1      1.468 ppm2      2.928 CV     1
 ASSI {  711}
   (  segid "ATXH" and resid 60   and name HG1%)
   (( segid "ATXH" and resid 56   and name HB2 ))
      3.600     1.600     1.600 peak   711 spectrum    1 weight  0.10000E+01 volume  0.11596E-02 ppm1      1.749 ppm2      0.966 CV     1
 ASSI {  712}
   (( segid "ATXH" and resid 56   and name HA  ))
   (  segid "ATXH" and resid 59   and name HD1%)
      3.500     1.500     1.500 peak   712 spectrum    1 weight  0.10000E+01 volume  0.11465E-02 ppm1      0.692 ppm2      3.870 CV     1
 ASSI {  714}
   (( segid "ATXH" and resid 56   and name HA  ))
   (  segid "ATXH" and resid 7    and name HD1%)
      3.300     1.400     1.400 peak   714 spectrum    1 weight  0.10000E+01 volume  0.11346E-02 ppm1      0.786 ppm2      3.870 CV     1
 ASSI {  717}
   (( segid "ATXH" and resid 20   and name HA  ))
   (( segid "ATXH" and resid 20   and name HB  ))
      3.200     1.300     1.300 peak   717 spectrum    1 weight  0.10000E+01 volume  0.11275E-02 ppm1      2.103 ppm2      3.526 CV     1
 ASSI {  718}
   (  segid "ATXH" and resid 23   and name HD1%)
   (( segid "ATXH" and resid 63   and name HG13))
      4.300     2.300     1.700 peak   718 spectrum    1 weight  0.10000E+01 volume  0.11263E-02 ppm1      0.572 ppm2      0.148 CV     1
 ASSI {  721}
   (  segid "ATXH" and resid 49   and name HD1%)
   (( segid "ATXH" and resid 50   and name HA  ))
      3.700     1.700     1.700 peak   721 spectrum    1 weight  0.10000E+01 volume  0.11109E-02 ppm1      5.021 ppm2      0.710 CV     1
 OR {  721}
   (  segid "ATXH" and resid 49   and name HG2%)
   (( segid "ATXH" and resid 50   and name HA  ))
 ASSI {  722}
   (( segid "ATXH" and resid 50   and name HA  ))
   (  segid "ATXH" and resid 4    and name HE% )
      3.400     1.500     1.500 peak   722 spectrum    1 weight  0.10000E+01 volume  0.11014E-02 ppm1      1.915 ppm2      5.022 CV     1
 ASSI {  724}
   (( segid "ATXH" and resid 60   and name HA  ))
   (  segid "ATXH" and resid 63   and name HD1%)
      3.100     1.200     1.200 peak   724 spectrum    1 weight  0.10000E+01 volume  0.10943E-02 ppm1      0.563 ppm2      3.251 CV     1
 ASSI {  725}
   (  segid "ATXH" and resid 49   and name HD1%)
   (( segid "ATXH" and resid 55   and name HA  ))
      3.300     1.300     1.300 peak   725 spectrum    1 weight  0.10000E+01 volume  0.10931E-02 ppm1      4.812 ppm2      0.661 CV     1
 ASSI {  727}
   (( segid "ATXH" and resid 27   and name HA  ))
   (  segid "ATXH" and resid 27   and name HG1%)
      3.200     1.300     1.300 peak   727 spectrum    1 weight  0.10000E+01 volume  0.10860E-02 ppm1      0.924 ppm2      3.683 CV     1
 ASSI {  731}
   (( segid "ATXH" and resid 10   and name HA  ))
   (( segid "ATXH" and resid 44   and name HB  ))
      3.500     1.500     1.500 peak   731 spectrum    1 weight  0.10000E+01 volume  0.10718E-02 ppm1      3.958 ppm2      4.692 CV     1
 ASSI {  732}
   (( segid "ATXH" and resid 40   and name HA  ))
   (  segid "ATXH" and resid 14   and name HE% )
      3.200     1.300     1.300 peak   732 spectrum    1 weight  0.10000E+01 volume  0.10682E-02 ppm1      1.772 ppm2      3.747 CV     1
 ASSI {  733}
   (( segid "ATXH" and resid 28   and name HE2 ))
   (( segid "ATXH" and resid 28   and name HB2 ))
      3.500     1.500     1.500 peak   733 spectrum    1 weight  0.10000E+01 volume  0.10646E-02 ppm1      1.848 ppm2      2.925 CV     1
 OR {  733}
   (( segid "ATXH" and resid 28   and name HE2 ))
   (( segid "ATXH" and resid 28   and name HB3 ))
 ASSI {  734}
   (( segid "ATXH" and resid 5    and name HG2 ))
   (( segid "ATXH" and resid 51   and name HB3 ))
      3.400     1.400     1.400 peak   734 spectrum    1 weight  0.10000E+01 volume  0.10635E-02 ppm1      3.801 ppm2      2.187 CV     1
 ASSI {  737}
   (  segid "ATXH" and resid 11   and name HG1%)
   (( segid "ATXH" and resid 14   and name HB2 ))
      3.900     1.900     1.900 peak   737 spectrum    1 weight  0.10000E+01 volume  0.10469E-02 ppm1      2.317 ppm2      0.624 CV     1
 ASSI {  739}
   (( segid "ATXH" and resid 34   and name HA  ))
   (( segid "ATXH" and resid 34   and name HG2 ))
      3.700     1.700     1.700 peak   739 spectrum    1 weight  0.10000E+01 volume  0.10433E-02 ppm1      2.195 ppm2      4.394 CV     1
 ASSI {  740}
   (( segid "ATXH" and resid 48   and name HB  ))
   (( segid "ATXH" and resid 34   and name HG2 ))
      3.600     1.600     1.600 peak   740 spectrum    1 weight  0.10000E+01 volume  0.10373E-02 ppm1      2.197 ppm2      3.873 CV     1
 ASSI {  746}
   (( segid "ATXH" and resid 31   and name HB3 ))
   (  segid "ATXH" and resid 53   and name HG1%)
      3.400     1.500     1.500 peak   746 spectrum    1 weight  0.10000E+01 volume  0.10219E-02 ppm1      0.799 ppm2      2.645 CV     1
 OR {  746}
   (( segid "ATXH" and resid 31   and name HB3 ))
   (  segid "ATXH" and resid 53   and name HG2%)
 ASSI {  750}
   (( segid "ATXH" and resid 57   and name HE3 ))
   (( segid "ATXH" and resid 57   and name HG3 ))
      3.500     1.500     1.500 peak   750 spectrum    1 weight  0.10000E+01 volume  0.10088E-02 ppm1      1.388 ppm2      2.950 CV     1
 OR {  750}
   (( segid "ATXH" and resid 57   and name HE3 ))
   (( segid "ATXH" and resid 57   and name HG2 ))
 OR {  750}
   (( segid "ATXH" and resid 57   and name HE2 ))
   (( segid "ATXH" and resid 57   and name HG2 ))
 OR {  750}
   (( segid "ATXH" and resid 57   and name HE2 ))
   (( segid "ATXH" and resid 57   and name HG3 ))
 ASSI {  751}
   (  segid "ATXH" and resid 54   and name HG2%)
   (( segid "ATXH" and resid 54   and name HA  ))
      3.300     1.400     1.400 peak   751 spectrum    1 weight  0.10000E+01 volume  0.10077E-02 ppm1      4.644 ppm2      0.722 CV     1
 ASSI {  753}
   (( segid "ATXH" and resid 46   and name HB3 ))
   (( segid "ATXH" and resid 37   and name HE3 ))
      3.300     1.400     1.400 peak   753 spectrum    1 weight  0.10000E+01 volume  0.99581E-03 ppm1      2.897 ppm2      1.867 CV     1
 OR {  753}
   (( segid "ATXH" and resid 46   and name HB3 ))
   (( segid "ATXH" and resid 37   and name HE2 ))
 ASSI {  754}
   (( segid "ATXH" and resid 58   and name HB3 ))
   (  segid "ATXH" and resid 30   and name HD2%)
      3.500     1.500     1.500 peak   754 spectrum    1 weight  0.10000E+01 volume  0.98986E-03 ppm1      0.833 ppm2      2.599 CV     1
 ASSI {  755}
   (( segid "ATXH" and resid 10   and name HA  ))
   (( segid "ATXH" and resid 10   and name HB3 ))
      3.100     1.200     1.200 peak   755 spectrum    1 weight  0.10000E+01 volume  0.97683E-03 ppm1      1.954 ppm2      4.690 CV     1
 ASSI {  760}
   (( segid "ATXH" and resid 66   and name HB3 ))
   (( segid "ATXH" and resid 66   and name HA  ))
      3.200     1.300     1.300 peak   760 spectrum    1 weight  0.10000E+01 volume  0.95786E-03 ppm1      4.264 ppm2      2.255 CV     1
 ASSI {  762}
   (( segid "ATXH" and resid 46   and name HA  ))
   (( segid "ATXH" and resid 46   and name HG3 ))
      3.400     1.400     1.400 peak   762 spectrum    1 weight  0.10000E+01 volume  0.94118E-03 ppm1      2.108 ppm2      5.257 CV     1
 ASSI {  763}
   (( segid "ATXH" and resid 54   and name HA  ))
   (  segid "ATXH" and resid 55   and name HG2%)
      3.800     1.800     1.800 peak   763 spectrum    1 weight  0.10000E+01 volume  0.93645E-03 ppm1      1.180 ppm2      4.639 CV     1
 ASSI {  764}
   (( segid "ATXH" and resid 65   and name HA  ))
   (( segid "ATXH" and resid 64   and name HB2 ))
      3.600     1.600     1.600 peak   764 spectrum    1 weight  0.10000E+01 volume  0.93530E-03 ppm1      2.104 ppm2      4.448 CV     1
 ASSI {  769}
   (( segid "ATXH" and resid 59   and name HA  ))
   (( segid "ATXH" and resid 59   and name HG12))
      3.300     1.400     1.400 peak   769 spectrum    1 weight  0.10000E+01 volume  0.92105E-03 ppm1      1.514 ppm2      3.513 CV     1
 ASSI {  771}
   (( segid "ATXH" and resid 31   and name HB3 ))
   (  segid "ATXH" and resid 53   and name HG1%)
      3.500     1.500     1.500 peak   771 spectrum    1 weight  0.10000E+01 volume  0.91748E-03 ppm1      0.842 ppm2      2.681 CV     1
 ASSI {  772}
   (( segid "ATXH" and resid 24   and name HG2 ))
   (( segid "ATXH" and resid 24   and name HA  ))
      3.700     1.700     1.700 peak   772 spectrum    1 weight  0.10000E+01 volume  0.91153E-03 ppm1      3.559 ppm2      2.399 CV     1
 ASSI {  773}
   (( segid "ATXH" and resid 8    and name HA  ))
   (( segid "ATXH" and resid 46   and name HG2 ))
      3.600     1.600     1.600 peak   773 spectrum    1 weight  0.10000E+01 volume  0.91153E-03 ppm1      2.204 ppm2      4.862 CV     1
 ASSI {  777}
   (  segid "ATXH" and resid 30   and name HD1%)
   (( segid "ATXH" and resid 58   and name HB2 ))
      3.800     1.800     1.800 peak   777 spectrum    1 weight  0.10000E+01 volume  0.89614E-03 ppm1      3.009 ppm2      0.845 CV     1
 OR {  777}
   (  segid "ATXH" and resid 30   and name HD2%)
   (( segid "ATXH" and resid 58   and name HB2 ))
 ASSI {  779}
   (  segid "ATXH" and resid 53   and name HG2%)
   (( segid "ATXH" and resid 1    and name HA  ))
      3.000     3.000     3.000 peak   779 spectrum    1 weight  0.10000E+01 volume  0.89256E-03 ppm1      4.534 ppm2      0.857 CV     1
 ASSI {  781}
   (( segid "ATXH" and resid 68   and name HB3 ))
   (( segid "ATXH" and resid 63   and name HA  ))
      4.200     2.200     1.800 peak   781 spectrum    1 weight  0.10000E+01 volume  0.88304E-03 ppm1      3.462 ppm2      2.311 CV     1
 ASSI {  782}
   (  segid "ATXH" and resid 8    and name HG2%)
   (( segid "ATXH" and resid 9    and name HA  ))
      3.500     1.500     1.500 peak   782 spectrum    1 weight  0.10000E+01 volume  0.88304E-03 ppm1      4.849 ppm2      1.060 CV     1
 ASSI {  783}
   (( segid "ATXH" and resid 23   and name HG12))
   (( segid "ATXH" and resid 26   and name HB2 ))
      3.800     1.800     1.800 peak   783 spectrum    1 weight  0.10000E+01 volume  0.88189E-03 ppm1      3.907 ppm2      1.584 CV     1
 OR {  783}
   (( segid "ATXH" and resid 23   and name HG13))
   (( segid "ATXH" and resid 26   and name HB2 ))
 ASSI {  785}
   (( segid "ATXH" and resid 30   and name HA  ))
   (( segid "ATXH" and resid 30   and name HG  ))
      3.800     1.800     1.800 peak   785 spectrum    1 weight  0.10000E+01 volume  0.87831E-03 ppm1      1.881 ppm2      4.181 CV     1
 ASSI {  786}
   (  segid "ATXH" and resid 8    and name HG2%)
   (( segid "ATXH" and resid 46   and name HA  ))
      3.600     1.600     1.600 peak   786 spectrum    1 weight  0.10000E+01 volume  0.87710E-03 ppm1      5.256 ppm2      1.072 CV     1
 ASSI {  787}
   (  segid "ATXH" and resid 9    and name HD1%)
   (( segid "ATXH" and resid 9    and name HB2 ))
      3.300     1.300     1.300 peak   787 spectrum    1 weight  0.10000E+01 volume  0.87473E-03 ppm1      1.566 ppm2      0.628 CV     1
 OR {  787}
   (( segid "ATXH" and resid 9    and name HG  ))
   (( segid "ATXH" and resid 9    and name HB2 ))
 ASSI {  789}
   (( segid "ATXH" and resid 49   and name HA  ))
   (  segid "ATXH" and resid 49   and name HD1%)
      4.200     2.200     1.800 peak   789 spectrum    1 weight  0.10000E+01 volume  0.86048E-03 ppm1      0.649 ppm2      5.310 CV     1
 ASSI {  790}
   (( segid "ATXH" and resid 58   and name HB3 ))
   (  segid "ATXH" and resid 30   and name HD1%)
      3.300     1.400     1.400 peak   790 spectrum    1 weight  0.10000E+01 volume  0.85812E-03 ppm1      0.879 ppm2      2.598 CV     1
 ASSI {  793}
   (( segid "ATXH" and resid 64   and name HB3 ))
   (( segid "ATXH" and resid 64   and name HA  ))
      3.300     1.400     1.400 peak   793 spectrum    1 weight  0.10000E+01 volume  0.84981E-03 ppm1      4.568 ppm2      1.981 CV     1
 ASSI {  794}
   (( segid "ATXH" and resid 49   and name HG13))
   (( segid "ATXH" and resid 49   and name HA  ))
      3.600     1.600     1.600 peak   794 spectrum    1 weight  0.10000E+01 volume  0.84387E-03 ppm1      5.309 ppm2      1.429 CV     1
 ASSI {  795}
   (( segid "ATXH" and resid 26   and name HA  ))
   (( segid "ATXH" and resid 29   and name HG2 ))
      3.800     1.800     1.800 peak   795 spectrum    1 weight  0.10000E+01 volume  0.84387E-03 ppm1      2.456 ppm2      4.152 CV     1
 ASSI {  798}
   (( segid "ATXH" and resid 5    and name HB2 ))
   (  segid "ATXH" and resid 49   and name HD1%)
      3.500     1.500     1.500 peak   798 spectrum    1 weight  0.10000E+01 volume  0.83320E-03 ppm1      0.654 ppm2      1.995 CV     1
 OR {  798}
   (( segid "ATXH" and resid 5    and name HG3 ))
   (  segid "ATXH" and resid 49   and name HD1%)
 ASSI {  799}
   (( segid "ATXH" and resid 20   and name HB  ))
   (( segid "ATXH" and resid 21   and name HB2 ))
      3.900     1.900     1.900 peak   799 spectrum    1 weight  0.10000E+01 volume  0.82605E-03 ppm1      2.773 ppm2      2.092 CV     1
 OR {  799}
   (( segid "ATXH" and resid 20   and name HB  ))
   (( segid "ATXH" and resid 21   and name HB3 ))
 ASSI {  801}
   (( segid "ATXH" and resid 71   and name HB2 ))
   (( segid "ATXH" and resid 71   and name HA  ))
      3.500     1.600     1.600 peak   801 spectrum    1 weight  0.10000E+01 volume  0.81774E-03 ppm1      4.514 ppm2      2.125 CV     1
 ASSI {  802}
   (( segid "ATXH" and resid 12   and name HA  ))
   (( segid "ATXH" and resid 12   and name HB2 ))
      3.500     1.500     1.500 peak   802 spectrum    1 weight  0.10000E+01 volume  0.81423E-03 ppm1      2.145 ppm2      4.638 CV     1
 ASSI {  811}
   (( segid "ATXH" and resid 52   and name HB2 ))
   (( segid "ATXH" and resid 1    and name HA  ))
      3.100     3.100     2.900 peak   811 spectrum    1 weight  0.10000E+01 volume  0.79519E-03 ppm1      4.533 ppm2      4.010 CV     1
 ASSI {  815}
   (( segid "ATXH" and resid 32   and name HA1 ))
   (( segid "ATXH" and resid 54   and name HB  ))
      4.700     2.800     1.300 peak   815 spectrum    1 weight  0.10000E+01 volume  0.78215E-03 ppm1      2.377 ppm2      3.678 CV     1
 ASSI {  817}
   (( segid "ATXH" and resid 7    and name HA  ))
   (  segid "ATXH" and resid 7    and name HD1%)
      3.800     1.800     1.800 peak   817 spectrum    1 weight  0.10000E+01 volume  0.77506E-03 ppm1      0.788 ppm2      4.839 CV     1
 ASSI {  818}
   (  segid "ATXH" and resid 54   and name HG1%)
   (( segid "ATXH" and resid 32   and name HA2 ))
      3.200     1.300     1.300 peak   818 spectrum    1 weight  0.10000E+01 volume  0.77270E-03 ppm1      4.212 ppm2      1.165 CV     1
 ASSI {  819}
   (( segid "ATXH" and resid 59   and name HA  ))
   (  segid "ATXH" and resid 27   and name HG1%)
      4.000     2.000     2.000 peak   819 spectrum    1 weight  0.10000E+01 volume  0.77027E-03 ppm1      0.924 ppm2      3.476 CV     1
 ASSI {  820}
   (( segid "ATXH" and resid 4    and name HG2 ))
   (  segid "ATXH" and resid 4    and name HE% )
      3.600     1.700     1.700 peak   820 spectrum    1 weight  0.10000E+01 volume  0.76912E-03 ppm1      1.915 ppm2      2.639 CV     1
 ASSI {  823}
   (  segid "ATXH" and resid 53   and name HG2%)
   (( segid "ATXH" and resid 52   and name HA  ))
      3.100     1.200     1.200 peak   823 spectrum    1 weight  0.10000E+01 volume  0.76196E-03 ppm1      4.468 ppm2      0.811 CV     1
 ASSI {  825}
   (( segid "ATXH" and resid 51   and name HB3 ))
   (( segid "ATXH" and resid 5    and name HB3 ))
      4.000     2.000     2.000 peak   825 spectrum    1 weight  0.10000E+01 volume  0.75845E-03 ppm1      1.828 ppm2      3.809 CV     1
 ASSI {  826}
   (( segid "ATXH" and resid 59   and name HA  ))
   (( segid "ATXH" and resid 59   and name HG13))
      3.800     1.800     1.800 peak   826 spectrum    1 weight  0.10000E+01 volume  0.74893E-03 ppm1      1.121 ppm2      3.508 CV     1
 ASSI {  830}
   (  segid "ATXH" and resid 61   and name HB% )
   (( segid "ATXH" and resid 62   and name HA  ))
      3.800     1.800     1.800 peak   830 spectrum    1 weight  0.10000E+01 volume  0.74299E-03 ppm1      3.868 ppm2      1.492 CV     1
 ASSI {  831}
   (( segid "ATXH" and resid 32   and name HA2 ))
   (( segid "ATXH" and resid 50   and name HB3 ))
      3.600     1.600     1.600 peak   831 spectrum    1 weight  0.10000E+01 volume  0.74184E-03 ppm1      2.456 ppm2      4.222 CV     1
 ASSI {  833}
   (( segid "ATXH" and resid 63   and name HB  ))
   (( segid "ATXH" and resid 63   and name HA  ))
      3.500     1.500     1.500 peak   833 spectrum    1 weight  0.10000E+01 volume  0.73705E-03 ppm1      3.484 ppm2      1.792 CV     1
 ASSI {  834}
   (( segid "ATXH" and resid 4    and name HG3 ))
   (  segid "ATXH" and resid 48   and name HG2%)
      3.700     1.700     1.700 peak   834 spectrum    1 weight  0.10000E+01 volume  0.73468E-03 ppm1      1.103 ppm2      2.453 CV     1
 ASSI {  835}
   (( segid "ATXH" and resid 5    and name HG2 ))
   (  segid "ATXH" and resid 49   and name HD1%)
      4.100     2.100     1.900 peak   835 spectrum    1 weight  0.10000E+01 volume  0.72638E-03 ppm1      0.650 ppm2      2.187 CV     1
 ASSI {  836}
   (  segid "ATXH" and resid 11   and name HG1%)
   (( segid "ATXH" and resid 68   and name HA  ))
      4.000     2.000     2.000 peak   836 spectrum    1 weight  0.10000E+01 volume  0.71807E-03 ppm1      4.633 ppm2      0.666 CV     1
 OR {  836}
   (  segid "ATXH" and resid 11   and name HG2%)
   (( segid "ATXH" and resid 68   and name HA  ))
 ASSI {  841}
   (( segid "ATXH" and resid 33   and name HA  ))
   (( segid "ATXH" and resid 49   and name HB  ))
      3.700     1.700     1.700 peak   841 spectrum    1 weight  0.10000E+01 volume  0.70855E-03 ppm1      1.551 ppm2      4.074 CV     1
 ASSI {  842}
   (  segid "ATXH" and resid 20   and name HG2%)
   (( segid "ATXH" and resid 21   and name HB2 ))
      4.100     2.100     1.900 peak   842 spectrum    1 weight  0.10000E+01 volume  0.70619E-03 ppm1      2.800 ppm2      0.903 CV     1
 OR {  842}
   (  segid "ATXH" and resid 20   and name HG2%)
   (( segid "ATXH" and resid 21   and name HB3 ))
 ASSI {  843}
   (( segid "ATXH" and resid 11   and name HB  ))
   (( segid "ATXH" and resid 11   and name HA  ))
      3.500     1.500     1.500 peak   843 spectrum    1 weight  0.10000E+01 volume  0.70146E-03 ppm1      4.761 ppm2      1.794 CV     1
 ASSI {  847}
   (( segid "ATXH" and resid 9    and name HB3 ))
   (( segid "ATXH" and resid 10   and name HG2 ))
      4.200     2.200     1.800 peak   847 spectrum    1 weight  0.10000E+01 volume  0.69315E-03 ppm1      2.265 ppm2      1.228 CV     1
 OR {  847}
   (( segid "ATXH" and resid 9    and name HB3 ))
   (( segid "ATXH" and resid 10   and name HG3 ))
 ASSI {  848}
   (( segid "ATXH" and resid 56   and name HG  ))
   (( segid "ATXH" and resid 55   and name HB  ))
      3.900     1.900     1.900 peak   848 spectrum    1 weight  0.10000E+01 volume  0.69079E-03 ppm1      4.423 ppm2      0.883 CV     1
 OR {  848}
   (  segid "ATXH" and resid 56   and name HD1%)
   (( segid "ATXH" and resid 55   and name HB  ))
 ASSI {  851}
   (  segid "ATXH" and resid 49   and name HD1%)
   (( segid "ATXH" and resid 55   and name HB  ))
      3.800     1.800     1.800 peak   851 spectrum    1 weight  0.10000E+01 volume  0.68721E-03 ppm1      4.425 ppm2      0.646 CV     1
 ASSI {  853}
   (( segid "ATXH" and resid 23   and name HB  ))
   (( segid "ATXH" and resid 23   and name HA  ))
      3.400     1.400     1.400 peak   853 spectrum    1 weight  0.10000E+01 volume  0.68012E-03 ppm1      3.455 ppm2      1.718 CV     1
 ASSI {  855}
   (( segid "ATXH" and resid 30   and name HB3 ))
   (  segid "ATXH" and resid 30   and name HD2%)
      3.900     1.900     1.900 peak   855 spectrum    1 weight  0.10000E+01 volume  0.66229E-03 ppm1      0.833 ppm2      1.318 CV     1
 ASSI {  856}
   (( segid "ATXH" and resid 38   and name HB  ))
   (  segid "ATXH" and resid 38   and name HG2%)
      3.500     1.500     1.500 peak   856 spectrum    1 weight  0.10000E+01 volume  0.65873E-03 ppm1      0.828 ppm2      2.043 CV     1
 ASSI {  857}
   (( segid "ATXH" and resid 5    and name HB3 ))
   (( segid "ATXH" and resid 51   and name HB2 ))
      4.400     2.500     1.600 peak   857 spectrum    1 weight  0.10000E+01 volume  0.65754E-03 ppm1      4.196 ppm2      1.827 CV     1
 ASSI {  858}
   (( segid "ATXH" and resid 50   and name HB2 ))
   (  segid "ATXH" and resid 4    and name HE% )
      3.500     1.500     1.500 peak   858 spectrum    1 weight  0.10000E+01 volume  0.65635E-03 ppm1      1.915 ppm2      2.949 CV     1
 ASSI {  859}
   (( segid "ATXH" and resid 5    and name HG2 ))
   (( segid "ATXH" and resid 51   and name HB2 ))
      4.400     2.400     1.600 peak   859 spectrum    1 weight  0.10000E+01 volume  0.64805E-03 ppm1      4.199 ppm2      2.188 CV     1
 ASSI {  860}
   (( segid "ATXH" and resid 49   and name HB  ))
   (( segid "ATXH" and resid 51   and name HB3 ))
      3.900     1.900     1.900 peak   860 spectrum    1 weight  0.10000E+01 volume  0.64686E-03 ppm1      3.800 ppm2      1.556 CV     1
 ASSI {  865}
   (( segid "ATXH" and resid 37   and name HA  ))
   (( segid "ATXH" and resid 37   and name HD2 ))
      4.300     2.300     1.700 peak   865 spectrum    1 weight  0.10000E+01 volume  0.62787E-03 ppm1      1.632 ppm2      4.714 CV     1
 OR {  865}
   (( segid "ATXH" and resid 37   and name HA  ))
   (( segid "ATXH" and resid 37   and name HD3 ))
 ASSI {  867}
   (( segid "ATXH" and resid 46   and name HB2 ))
   (( segid "ATXH" and resid 8    and name HA  ))
      4.200     2.200     1.800 peak   867 spectrum    1 weight  0.10000E+01 volume  0.62668E-03 ppm1      4.870 ppm2      1.956 CV     1
 ASSI {  869}
   (( segid "ATXH" and resid 37   and name HA  ))
   (( segid "ATXH" and resid 37   and name HE3 ))
      4.400     2.400     1.600 peak   869 spectrum    1 weight  0.10000E+01 volume  0.62549E-03 ppm1      2.862 ppm2      4.718 CV     1
 OR {  869}
   (( segid "ATXH" and resid 37   and name HA  ))
   (( segid "ATXH" and resid 37   and name HE2 ))
 ASSI {  870}
   (  segid "ATXH" and resid 23   and name HD1%)
   (( segid "ATXH" and resid 23   and name HA  ))
      4.500     2.500     1.500 peak   870 spectrum    1 weight  0.10000E+01 volume  0.62312E-03 ppm1      3.454 ppm2      0.151 CV     1
 ASSI {  871}
   (( segid "ATXH" and resid 24   and name HA  ))
   (  segid "ATXH" and resid 36   and name HG2%)
      3.600     1.600     1.600 peak   871 spectrum    1 weight  0.10000E+01 volume  0.61956E-03 ppm1      0.839 ppm2      3.564 CV     1
 ASSI {  876}
   (( segid "ATXH" and resid 58   and name HB2 ))
   (  segid "ATXH" and resid 30   and name HD2%)
      4.400     2.400     1.600 peak   876 spectrum    1 weight  0.10000E+01 volume  0.60888E-03 ppm1      0.833 ppm2      3.015 CV     1
 ASSI {  877}
   (( segid "ATXH" and resid 25   and name HA  ))
   (( segid "ATXH" and resid 28   and name HE2 ))
      4.200     2.200     1.800 peak   877 spectrum    1 weight  0.10000E+01 volume  0.60651E-03 ppm1      2.912 ppm2      4.041 CV     1
 ASSI {  878}
   (( segid "ATXH" and resid 34   and name HA  ))
   (  segid "ATXH" and resid 4    and name HE% )
      4.400     2.400     1.600 peak   878 spectrum    1 weight  0.10000E+01 volume  0.60651E-03 ppm1      1.915 ppm2      4.402 CV     1
 ASSI {  880}
   (( segid "ATXH" and resid 3    and name HA  ))
   (( segid "ATXH" and resid 50   and name HA  ))
      4.000     2.000     2.000 peak   880 spectrum    1 weight  0.10000E+01 volume  0.60294E-03 ppm1      5.029 ppm2      4.398 CV     1
 ASSI {  884}
   (( segid "ATXH" and resid 45   and name HA  ))
   (( segid "ATXH" and resid 38   and name HA  ))
      3.400     1.500     1.500 peak   884 spectrum    1 weight  0.10000E+01 volume  0.58870E-03 ppm1      4.304 ppm2      4.454 CV     1
 ASSI {  886}
   (( segid "ATXH" and resid 51   and name HB2 ))
   (( segid "ATXH" and resid 50   and name HA  ))
      4.900     3.000     1.100 peak   886 spectrum    1 weight  0.10000E+01 volume  0.58158E-03 ppm1      5.020 ppm2      4.205 CV     1
 ASSI {  888}
   (( segid "ATXH" and resid 52   and name HB2 ))
   (  segid "ATXH" and resid 3    and name HB% )
      3.600     1.700     1.700 peak   888 spectrum    1 weight  0.10000E+01 volume  0.56140E-03 ppm1      1.358 ppm2      3.986 CV     1
 ASSI {  891}
   (  segid "ATXH" and resid 9    and name HD1%)
   (( segid "ATXH" and resid 7    and name HB3 ))
      3.600     1.600     1.600 peak   891 spectrum    1 weight  0.10000E+01 volume  0.55428E-03 ppm1      1.397 ppm2      0.651 CV     1
 OR {  891}
   (  segid "ATXH" and resid 9    and name HD2%)
   (( segid "ATXH" and resid 7    and name HB3 ))
 ASSI {  892}
   (( segid "ATXH" and resid 28   and name HE2 ))
   (( segid "ATXH" and resid 35   and name HA  ))
      3.600     1.600     1.600 peak   892 spectrum    1 weight  0.10000E+01 volume  0.55428E-03 ppm1      4.623 ppm2      2.944 CV     1
 ASSI {  893}
   (  segid "ATXH" and resid 53   and name HG2%)
   (( segid "ATXH" and resid 2    and name HB2 ))
      3.300     1.300     1.300 peak   893 spectrum    1 weight  0.10000E+01 volume  0.55428E-03 ppm1      2.824 ppm2      0.810 CV     1
 ASSI {  894}
   (  segid "ATXH" and resid 54   and name HG2%)
   (( segid "ATXH" and resid 32   and name HA2 ))
      4.300     2.400     1.700 peak   894 spectrum    1 weight  0.10000E+01 volume  0.55428E-03 ppm1      4.223 ppm2      0.726 CV     1
 ASSI {  896}
   (( segid "ATXH" and resid 20   and name HN  ))
   (( segid "ATXH" and resid 18   and name HB3 ))
      3.300     3.300     2.700 peak   896 spectrum    1 weight  0.10000E+01 volume  0.55072E-03 ppm1      3.119 ppm2      6.979 CV     1
 ASSI {  897}
   (( segid "ATXH" and resid 43   and name HA1 ))
   (( segid "ATXH" and resid 10   and name HB3 ))
      4.300     2.300     1.700 peak   897 spectrum    1 weight  0.10000E+01 volume  0.54953E-03 ppm1      1.904 ppm2      3.618 CV     1
 ASSI {  898}
   (  segid "ATXH" and resid 33   and name HG2%)
   (( segid "ATXH" and resid 28   and name HB2 ))
      4.200     2.200     1.800 peak   898 spectrum    1 weight  0.10000E+01 volume  0.54360E-03 ppm1      1.846 ppm2      0.649 CV     1
 OR {  898}
   (  segid "ATXH" and resid 33   and name HG2%)
   (( segid "ATXH" and resid 28   and name HB3 ))
 ASSI {  899}
   (  segid "ATXH" and resid 48   and name HG2%)
   (( segid "ATXH" and resid 6    and name HB2 ))
      3.300     1.400     1.400 peak   899 spectrum    1 weight  0.10000E+01 volume  0.54241E-03 ppm1      1.991 ppm2      1.102 CV     1
 ASSI {  900}
   (( segid "ATXH" and resid 49   and name HG13))
   (( segid "ATXH" and resid 51   and name HA  ))
      3.900     1.900     1.900 peak   900 spectrum    1 weight  0.10000E+01 volume  0.54004E-03 ppm1      4.944 ppm2      1.426 CV     1
 ASSI {  901}
   (( segid "ATXH" and resid 49   and name HG13))
   (( segid "ATXH" and resid 51   and name HB3 ))
      3.800     1.800     1.800 peak   901 spectrum    1 weight  0.10000E+01 volume  0.53292E-03 ppm1      3.803 ppm2      1.420 CV     1
 ASSI {  902}
   (( segid "ATXH" and resid 7    and name HG  ))
   (( segid "ATXH" and resid 7    and name HB3 ))
      3.800     1.800     1.800 peak   902 spectrum    1 weight  0.10000E+01 volume  0.53055E-03 ppm1      1.400 ppm2      0.791 CV     1
 OR {  902}
   (  segid "ATXH" and resid 7    and name HD1%)
   (( segid "ATXH" and resid 7    and name HB3 ))
 ASSI {  905}
   (( segid "ATXH" and resid 30   and name HB2 ))
   (  segid "ATXH" and resid 30   and name HD1%)
      4.200     2.200     1.800 peak   905 spectrum    1 weight  0.10000E+01 volume  0.52223E-03 ppm1      0.877 ppm2      1.994 CV     1
 ASSI {  907}
   (( segid "ATXH" and resid 9    and name HG  ))
   (( segid "ATXH" and resid 9    and name HB3 ))
      3.900     1.900     1.900 peak   907 spectrum    1 weight  0.10000E+01 volume  0.51986E-03 ppm1      1.281 ppm2      0.621 CV     1
 OR {  907}
   (  segid "ATXH" and resid 9    and name HD1%)
   (( segid "ATXH" and resid 9    and name HB3 ))
 ASSI {  910}
   (( segid "ATXH" and resid 16   and name HA  ))
   (( segid "ATXH" and resid 14   and name HB2 ))
      3.300     3.300     2.700 peak   910 spectrum    1 weight  0.10000E+01 volume  0.51393E-03 ppm1      2.307 ppm2      4.282 CV     1
 ASSI {  911}
   (( segid "ATXH" and resid 49   and name HA  ))
   (  segid "ATXH" and resid 33   and name HG1%)
      4.100     2.100     1.900 peak   911 spectrum    1 weight  0.10000E+01 volume  0.50561E-03 ppm1      0.834 ppm2      5.307 CV     1
 ASSI {  913}
   (( segid "ATXH" and resid 10   and name HB3 ))
   (( segid "ATXH" and resid 44   and name HA  ))
      4.700     2.700     1.300 peak   913 spectrum    1 weight  0.10000E+01 volume  0.50087E-03 ppm1      5.499 ppm2      1.976 CV     1
 ASSI {  915}
   (  segid "ATXH" and resid 20   and name HG2%)
   (( segid "ATXH" and resid 40   and name HG  ))
      3.800     1.800     1.800 peak   915 spectrum    1 weight  0.10000E+01 volume  0.49493E-03 ppm1      1.563 ppm2      0.969 CV     1
 ASSI {  916}
   (( segid "ATXH" and resid 60   and name HA  ))
   (  segid "ATXH" and resid 59   and name HG2%)
      3.900     1.900     1.900 peak   916 spectrum    1 weight  0.10000E+01 volume  0.49256E-03 ppm1      0.754 ppm2      3.251 CV     1
 ASSI {  918}
   (( segid "ATXH" and resid 57   and name HA  ))
   (( segid "ATXH" and resid 57   and name HE3 ))
      4.400     2.400     1.600 peak   918 spectrum    1 weight  0.10000E+01 volume  0.48781E-03 ppm1      2.942 ppm2      3.849 CV     1
 OR {  918}
   (( segid "ATXH" and resid 57   and name HA  ))
   (( segid "ATXH" and resid 57   and name HE2 ))
 ASSI {  922}
   (( segid "ATXH" and resid 14   and name HG3 ))
   (( segid "ATXH" and resid 14   and name HB3 ))
      3.800     1.800     1.800 peak   922 spectrum    1 weight  0.10000E+01 volume  0.47832E-03 ppm1      1.438 ppm2      2.051 CV     1
 OR {  922}
   (( segid "ATXH" and resid 14   and name HG2 ))
   (( segid "ATXH" and resid 14   and name HB3 ))
 ASSI {  923}
   (( segid "ATXH" and resid 57   and name HE3 ))
   (( segid "ATXH" and resid 57   and name HG2 ))
      3.900     1.900     1.900 peak   923 spectrum    1 weight  0.10000E+01 volume  0.47713E-03 ppm1      1.440 ppm2      2.949 CV     1
 OR {  923}
   (( segid "ATXH" and resid 57   and name HE2 ))
   (( segid "ATXH" and resid 57   and name HG2 ))
 ASSI {  926}
   (( segid "ATXH" and resid 21   and name HA  ))
   (( segid "ATXH" and resid 24   and name HB3 ))
      3.500     1.500     1.500 peak   926 spectrum    1 weight  0.10000E+01 volume  0.46645E-03 ppm1      1.911 ppm2      4.445 CV     1
 ASSI {  931}
   (  segid "ATXH" and resid 20   and name HG1%)
   (  segid "ATXH" and resid 14   and name HE% )
      4.000     2.000     2.000 peak   931 spectrum    1 weight  0.10000E+01 volume  0.45814E-03 ppm1      1.763 ppm2      1.067 CV     1
 ASSI {  933}
   (  segid "ATXH" and resid 38   and name HG1%)
   (  segid "ATXH" and resid 14   and name HE% )
      3.800     1.800     1.800 peak   933 spectrum    1 weight  0.10000E+01 volume  0.45340E-03 ppm1      1.775 ppm2      0.993 CV     1
 ASSI {  934}
   (  segid "ATXH" and resid 8    and name HG2%)
   (( segid "ATXH" and resid 10   and name HG2 ))
      3.800     1.800     1.800 peak   934 spectrum    1 weight  0.10000E+01 volume  0.44271E-03 ppm1      2.264 ppm2      1.094 CV     1
 OR {  934}
   (  segid "ATXH" and resid 8    and name HG2%)
   (( segid "ATXH" and resid 10   and name HG3 ))
 ASSI {  937}
   (( segid "ATXH" and resid 35   and name HA  ))
   (( segid "ATXH" and resid 48   and name HB  ))
      4.500     2.500     1.500 peak   937 spectrum    1 weight  0.10000E+01 volume  0.43440E-03 ppm1      3.883 ppm2      4.608 CV     1
 ASSI {  939}
   (( segid "ATXH" and resid 30   and name HA  ))
   (  segid "ATXH" and resid 30   and name HD1%)
      4.000     2.000     2.000 peak   939 spectrum    1 weight  0.10000E+01 volume  0.43203E-03 ppm1      0.879 ppm2      4.177 CV     1
 ASSI {  940}
   (  segid "ATXH" and resid 68   and name HE% )
   (  segid "ATXH" and resid 11   and name HG1%)
      3.400     1.400     1.400 peak   940 spectrum    1 weight  0.10000E+01 volume  0.43084E-03 ppm1      0.670 ppm2      6.871 CV     1
 ASSI {  941}
   (  segid "ATXH" and resid 68   and name HE% )
   (  segid "ATXH" and resid 22   and name HB% )
      3.800     1.800     1.800 peak   941 spectrum    1 weight  0.10000E+01 volume  0.42728E-03 ppm1      1.618 ppm2      6.885 CV     1
 ASSI {  942}
   (( segid "ATXH" and resid 54   and name HB  ))
   (( segid "ATXH" and resid 53   and name HB  ))
      4.400     2.400     1.600 peak   942 spectrum    1 weight  0.10000E+01 volume  0.42728E-03 ppm1      1.996 ppm2      2.366 CV     1
 ASSI {  944}
   (( segid "ATXH" and resid 64   and name HG2 ))
   (( segid "ATXH" and resid 64   and name HB3 ))
      3.700     1.700     1.700 peak   944 spectrum    1 weight  0.10000E+01 volume  0.41422E-03 ppm1      1.990 ppm2      2.679 CV     1
 ASSI {  945}
   (( segid "ATXH" and resid 65   and name HB3 ))
   (( segid "ATXH" and resid 66   and name HA  ))
      4.000     2.000     2.000 peak   945 spectrum    1 weight  0.10000E+01 volume  0.41304E-03 ppm1      4.285 ppm2      2.641 CV     1
 ASSI {  946}
   (( segid "ATXH" and resid 29   and name HG3 ))
   (( segid "ATXH" and resid 26   and name HA  ))
      3.900     1.900     1.900 peak   946 spectrum    1 weight  0.10000E+01 volume  0.41067E-03 ppm1      4.151 ppm2      2.338 CV     1
 ASSI {  948}
   (  segid "ATXH" and resid 36   and name HG2%)
   (( segid "ATXH" and resid 37   and name HA  ))
      3.900     1.900     1.900 peak   948 spectrum    1 weight  0.10000E+01 volume  0.40354E-03 ppm1      4.707 ppm2      0.829 CV     1
 OR {  948}
   (  segid "ATXH" and resid 36   and name HG1%)
   (( segid "ATXH" and resid 37   and name HA  ))
 ASSI {  949}
   (( segid "ATXH" and resid 48   and name HB  ))
   (  segid "ATXH" and resid 4    and name HE% )
      4.300     2.300     1.700 peak   949 spectrum    1 weight  0.10000E+01 volume  0.40236E-03 ppm1      1.915 ppm2      3.877 CV     1
 ASSI {  950}
   (( segid "ATXH" and resid 57   and name HA  ))
   (( segid "ATXH" and resid 57   and name HG3 ))
      4.500     2.500     1.500 peak   950 spectrum    1 weight  0.10000E+01 volume  0.39998E-03 ppm1      1.381 ppm2      3.843 CV     1
 ASSI {  953}
   (  segid "ATXH" and resid 54   and name HG1%)
   (  segid "ATXH" and resid 54   and name HG2%)
      3.800     1.800     1.800 peak   953 spectrum    1 weight  0.10000E+01 volume  0.39286E-03 ppm1      0.726 ppm2      1.161 CV     1
 ASSI {  955}
   (( segid "ATXH" and resid 38   and name HA  ))
   (( segid "ATXH" and resid 38   and name HB  ))
      3.700     1.800     1.800 peak   955 spectrum    1 weight  0.10000E+01 volume  0.38930E-03 ppm1      2.048 ppm2      4.294 CV     1
 ASSI {  956}
   (( segid "ATXH" and resid 46   and name HB3 ))
   (( segid "ATXH" and resid 45   and name HA  ))
      4.900     3.000     1.100 peak   956 spectrum    1 weight  0.10000E+01 volume  0.38218E-03 ppm1      4.459 ppm2      1.888 CV     1
 ASSI {  957}
   (  segid "ATXH" and resid 11   and name HG1%)
   (( segid "ATXH" and resid 68   and name HA  ))
      4.400     2.400     1.600 peak   957 spectrum    1 weight  0.10000E+01 volume  0.38218E-03 ppm1      4.663 ppm2      0.642 CV     1
 ASSI {  958}
   (( segid "ATXH" and resid 34   and name HG3 ))
   (( segid "ATXH" and resid 49   and name HA  ))
      4.600     2.700     1.400 peak   958 spectrum    1 weight  0.10000E+01 volume  0.37981E-03 ppm1      5.311 ppm2      2.080 CV     1
 ASSI {  959}
   (( segid "ATXH" and resid 51   and name HB3 ))
   (( segid "ATXH" and resid 5    and name HB2 ))
      3.700     1.700     1.700 peak   959 spectrum    1 weight  0.10000E+01 volume  0.37981E-03 ppm1      1.994 ppm2      3.817 CV     1
 ASSI {  962}
   (( segid "ATXH" and resid 28   and name HB3 ))
   (( segid "ATXH" and resid 25   and name HB2 ))
      4.900     3.000     1.100 peak   962 spectrum    1 weight  0.10000E+01 volume  0.36200E-03 ppm1      3.912 ppm2      1.846 CV     1
 OR {  962}
   (( segid "ATXH" and resid 28   and name HB2 ))
   (( segid "ATXH" and resid 25   and name HB2 ))
 ASSI {  967}
   (( segid "ATXH" and resid 47   and name HA  ))
   (  segid "ATXH" and resid 48   and name HG2%)
      4.300     2.400     1.700 peak   967 spectrum    1 weight  0.10000E+01 volume  0.34895E-03 ppm1      1.106 ppm2      5.033 CV     1
 ASSI {  968}
   (  segid "ATXH" and resid 68   and name HE% )
   (  segid "ATXH" and resid 63   and name HG2%)
      3.500     1.600     1.600 peak   968 spectrum    1 weight  0.10000E+01 volume  0.34301E-03 ppm1      0.762 ppm2      6.876 CV     1
 ASSI {  969}
   (  segid "ATXH" and resid 3    and name HB% )
   (( segid "ATXH" and resid 52   and name HB3 ))
      4.400     2.400     1.600 peak   969 spectrum    1 weight  0.10000E+01 volume  0.34064E-03 ppm1      3.840 ppm2      1.360 CV     1
 ASSI {  970}
   (  segid "ATXH" and resid 3    and name HB% )
   (( segid "ATXH" and resid 50   and name HA  ))
      4.300     2.300     1.700 peak   970 spectrum    1 weight  0.10000E+01 volume  0.34064E-03 ppm1      5.028 ppm2      1.362 CV     1
 ASSI {  971}
   (( segid "ATXH" and resid 48   and name HB  ))
   (( segid "ATXH" and resid 34   and name HB2 ))
      4.700     2.700     1.300 peak   971 spectrum    1 weight  0.10000E+01 volume  0.33471E-03 ppm1      1.888 ppm2      3.864 CV     1
 ASSI {  972}
   (( segid "ATXH" and resid 63   and name HA  ))
   (( segid "ATXH" and resid 66   and name HG2 ))
      4.000     2.000     2.000 peak   972 spectrum    1 weight  0.10000E+01 volume  0.33471E-03 ppm1      2.477 ppm2      3.547 CV     1
 OR {  972}
   (( segid "ATXH" and resid 63   and name HA  ))
   (( segid "ATXH" and resid 66   and name HG3 ))
 ASSI {  974}
   (( segid "ATXH" and resid 34   and name HA  ))
   (( segid "ATXH" and resid 35   and name HG2 ))
      4.300     2.300     1.700 peak   974 spectrum    1 weight  0.10000E+01 volume  0.33114E-03 ppm1      2.240 ppm2      4.417 CV     1
 ASSI {  976}
   (( segid "ATXH" and resid 58   and name HB2 ))
   (  segid "ATXH" and resid 30   and name HD1%)
      4.600     2.600     1.400 peak   976 spectrum    1 weight  0.10000E+01 volume  0.32521E-03 ppm1      0.877 ppm2      3.016 CV     1
 ASSI {  983}
   (  segid "ATXH" and resid 41   and name HB% )
   (( segid "ATXH" and resid 42   and name HG3 ))
      4.500     2.500     1.500 peak   983 spectrum    1 weight  0.10000E+01 volume  0.29435E-03 ppm1      2.258 ppm2      1.385 CV     1
 ASSI {  987}
   (( segid "ATXH" and resid 39   and name HG2 ))
   (( segid "ATXH" and resid 39   and name HB3 ))
      4.100     2.100     1.900 peak   987 spectrum    1 weight  0.10000E+01 volume  0.28723E-03 ppm1      2.028 ppm2      2.174 CV     1
 ASSI {  988}
   (( segid "ATXH" and resid 60   and name HA  ))
   (( segid "ATXH" and resid 57   and name HA  ))
      5.000     3.100     1.000 peak   988 spectrum    1 weight  0.10000E+01 volume  0.27655E-03 ppm1      3.853 ppm2      3.249 CV     1
 ASSI {  990}
   (( segid "ATXH" and resid 5    and name HG3 ))
   (( segid "ATXH" and resid 51   and name HB3 ))
      3.900     1.900     1.900 peak   990 spectrum    1 weight  0.10000E+01 volume  0.27418E-03 ppm1      3.806 ppm2      1.995 CV     1
 OR {  990}
   (( segid "ATXH" and resid 5    and name HB2 ))
   (( segid "ATXH" and resid 51   and name HB3 ))
 ASSI {  992}
   (( segid "ATXH" and resid 30   and name HG  ))
   (  segid "ATXH" and resid 54   and name HG2%)
      4.600     2.700     1.400 peak   992 spectrum    1 weight  0.10000E+01 volume  0.27299E-03 ppm1      0.730 ppm2      1.887 CV     1
 ASSI {  993}
   (( segid "ATXH" and resid 60   and name HA  ))
   (  segid "ATXH" and resid 9    and name HD2%)
      4.400     2.400     1.600 peak   993 spectrum    1 weight  0.10000E+01 volume  0.26467E-03 ppm1      0.710 ppm2      3.255 CV     1
 ASSI {  994}
   (( segid "ATXH" and resid 7    and name HB2 ))
   (( segid "ATXH" and resid 6    and name HA  ))
      5.100     3.300     0.900 peak   994 spectrum    1 weight  0.10000E+01 volume  0.26467E-03 ppm1      5.181 ppm2      1.564 CV     1
 ASSI {  996}
   (( segid "ATXH" and resid 30   and name HB3 ))
   (  segid "ATXH" and resid 33   and name HG1%)
      5.200     3.400     0.800 peak   996 spectrum    1 weight  0.10000E+01 volume  0.25399E-03 ppm1      0.833 ppm2      1.318 CV     1
 ASSI {  997}
   (( segid "ATXH" and resid 32   and name HA1 ))
   (( segid "ATXH" and resid 50   and name HA  ))
      5.000     3.100     1.000 peak   997 spectrum    1 weight  0.10000E+01 volume  0.24688E-03 ppm1      5.022 ppm2      3.671 CV     1
 ASSI { 1006}
   (( segid "ATXH" and resid 68   and name HA  ))
   (  segid "ATXH" and resid 63   and name HG2%)
      5.300     3.500     0.700 peak  1006 spectrum    1 weight  0.10000E+01 volume  0.21127E-03 ppm1      0.775 ppm2      4.656 CV     1
 ASSI { 1009}
   (( segid "ATXH" and resid 28   and name HA  ))
   (( segid "ATXH" and resid 28   and name HD2 ))
      4.600     2.700     1.400 peak  1009 spectrum    1 weight  0.10000E+01 volume  0.20296E-03 ppm1      1.663 ppm2      3.776 CV     1
 ASSI { 1011}
   (( segid "ATXH" and resid 28   and name HG2 ))
   (( segid "ATXH" and resid 25   and name HA  ))
      5.400     3.600     0.600 peak  1011 spectrum    1 weight  0.10000E+01 volume  0.19703E-03 ppm1      4.050 ppm2      1.471 CV     1
 ASSI { 1015}
   (( segid "ATXH" and resid 61   and name HA  ))
   (( segid "ATXH" and resid 64   and name HB3 ))
      5.100     3.300     0.900 peak  1015 spectrum    1 weight  0.10000E+01 volume  0.17685E-03 ppm1      1.991 ppm2      4.194 CV     1
 ASSI { 1018}
   (( segid "ATXH" and resid 23   and name HG13))
   (  segid "ATXH" and resid 45   and name HG2%)
      5.100     3.200     0.900 peak  1018 spectrum    1 weight  0.10000E+01 volume  0.15904E-03 ppm1      0.593 ppm2      1.575 CV     1
 OR { 1018}
   (( segid "ATXH" and resid 23   and name HG12))
   (  segid "ATXH" and resid 45   and name HG2%)
 ASSI { 1019}
   (  segid "ATXH" and resid 63   and name HG2%)
   (( segid "ATXH" and resid 23   and name HA  ))
      4.900     3.000     1.100 peak  1019 spectrum    1 weight  0.10000E+01 volume  0.15549E-03 ppm1      3.383 ppm2      0.789 CV     1
 ASSI { 1020}
   (( segid "ATXH" and resid 39   and name HB3 ))
   (( segid "ATXH" and resid 42   and name HA  ))
      5.500     3.800     0.500 peak  1020 spectrum    1 weight  0.10000E+01 volume  0.15192E-03 ppm1      4.219 ppm2      2.003 CV     1
 ASSI { 1021}
   (( segid "ATXH" and resid 49   and name HA  ))
   (  segid "ATXH" and resid 4    and name HE% )
      4.700     2.700     1.300 peak  1021 spectrum    1 weight  0.10000E+01 volume  0.14955E-03 ppm1      1.913 ppm2      5.301 CV     1
 ASSI { 1025}
   (( segid "ATXH" and resid 28   and name HG2 ))
   (( segid "ATXH" and resid 29   and name HA  ))
      4.700     2.800     1.300 peak  1025 spectrum    1 weight  0.10000E+01 volume  0.13887E-03 ppm1      4.052 ppm2      1.473 CV     1
 ASSI { 1028}
   (( segid "ATXH" and resid 20   and name HN  ))
   (( segid "ATXH" and resid 18   and name HB2 ))
      4.200     2.200     1.800 peak  1028 spectrum    1 weight  0.10000E+01 volume  0.12581E-03 ppm1      3.298 ppm2      6.978 CV     1
 ASSI { 1031}
   (  segid "ATXH" and resid 49   and name HG2%)
   (  segid "ATXH" and resid 4    and name HE% )
      5.200     3.300     0.800 peak  1031 spectrum    1 weight  0.10000E+01 volume  0.11537E-03 ppm1      1.917 ppm2      0.726 CV     1
 ASSI { 1032}
   (  segid "ATXH" and resid 49   and name HG2%)
   (( segid "ATXH" and resid 50   and name HB2 ))
      5.600     3.900     0.400 peak  1032 spectrum    1 weight  0.10000E+01 volume  0.11311E-03 ppm1      2.947 ppm2      0.742 CV     1
 ASSI { 1034}
   (( segid "ATXH" and resid 10   and name HA  ))
   (  segid "ATXH" and resid 8    and name HG2%)
      5.100     3.300     0.900 peak  1034 spectrum    1 weight  0.10000E+01 volume  0.10445E-03 ppm1      1.080 ppm2      4.708 CV     1
 ASSI { 1035}
   (  segid "ATXH" and resid 60   and name HG1%)
   (( segid "ATXH" and resid 56   and name HA  ))
      5.600     3.900     0.400 peak  1035 spectrum    1 weight  0.10000E+01 volume  0.10196E-03 ppm1      3.870 ppm2      0.967 CV     1
 ASSI { 1036}
   (( segid "ATXH" and resid 44   and name HA  ))
   (  segid "ATXH" and resid 14   and name HE% )
      4.300     2.400     1.700 peak  1036 spectrum    1 weight  0.10000E+01 volume  0.99702E-04 ppm1      1.756 ppm2      5.492 CV     1
 ASSI { 1038}
   (( segid "ATXH" and resid 4    and name HG3 ))
   (( segid "ATXH" and resid 3    and name HA  ))
      6.000     5.600     0.000 peak  1038 spectrum    1 weight  0.10000E+01 volume  0.94948E-04 ppm1      4.403 ppm2      2.455 CV     1
 ASSI { 1043}
   (  segid "ATXH" and resid 3    and name HB% )
   (( segid "ATXH" and resid 2    and name HA  ))
      5.800     4.300     0.200 peak  1043 spectrum    1 weight  0.10000E+01 volume  0.75251E-04 ppm1      4.704 ppm2      1.360 CV     1
 ASSI { 1049}
   (( segid "ATXH" and resid 51   and name HA  ))
   (  segid "ATXH" and resid 54   and name HG2%)
      6.000     4.500     0.000 peak  1049 spectrum    1 weight  0.10000E+01 volume  0.49731E-04 ppm1      0.727 ppm2      4.893 CV     1
 ASSI { 1050}
   (( segid "ATXH" and resid 28   and name HD2 ))
   (( segid "ATXH" and resid 25   and name HA  ))
      6.000     5.300     0.000 peak  1050 spectrum    1 weight  0.10000E+01 volume  0.44034E-04 ppm1      4.044 ppm2      1.649 CV     1
 ASSI { 1052}
   (( segid "ATXH" and resid 32   and name HA1 ))
   (  segid "ATXH" and resid 54   and name HG2%)
      6.000     6.000     0.000 peak  1052 spectrum    1 weight  0.10000E+01 volume  0.38574E-04 ppm1      0.726 ppm2      3.674 CV     1
 ASSI { 1054}
   (( segid "ATXH" and resid 33   and name HA  ))
   (  segid "ATXH" and resid 54   and name HG2%)
      6.000     5.800     0.000 peak  1054 spectrum    1 weight  0.10000E+01 volume  0.28842E-04 ppm1      0.727 ppm2      4.076 CV     1
 ASSI { 1057}
   (( segid "ATXH" and resid 49   and name HA  ))
   (  segid "ATXH" and resid 54   and name HG2%)
      6.000     6.000     0.000 peak  1057 spectrum    1 weight  0.10000E+01 volume  0.19346E-04 ppm1      0.727 ppm2      5.310 CV     1
 ASSI { 1060}
   (( segid "ATXH" and resid 58   and name HB2 ))
   (  segid "ATXH" and resid 54   and name HG2%)
      6.000     6.000     0.000 peak  1060 spectrum    1 weight  0.10000E+01 volume  0.26112E-05 ppm1      0.725 ppm2      2.960 CV     1
ASSI ( resid 13 and name HA1 )
     ( resid 68 and name HE# )
     6.0 4.0 0.0 peak 2000 volume 8.94e+05 hpm1 45.027 ppm1 3.736 ppm2 6.873
ASSI ( resid 13 and name HA2 )
     ( resid 68 and name HE# )
     6.0 4.0 0.0 peak 2001 volume 4.23e+05 hpm1 44.963 ppm1 4.636 ppm2 6.869
ASSI ( resid 14 and name HA )
     ( resid 68 and name HE# )
     6.0 4.0 0.0 peak 2002 volume 1.38e+06 hpm1 56.215 ppm1 5.083 ppm2 6.881
ASSI ( resid 14 and name HB2 )
     ( resid 68 and name HE# )
     6.0 4.0 0.0 peak 2003 volume 6.34e+05 hpm1 34.211 ppm1 2.319 ppm2 6.883
ASSI ( resid 14 and name HE# )
     ( resid 43 and name HA1 )
     6.0 4.0 0.0 peak 2004 volume 2.54e+06 hpm1 15.693 ppm1 1.773 ppm2 3.625
ASSI ( resid 22 and name HB )
     ( resid 68 and name HE# )
     6.0 4.0 0.0 peak 2005 volume 3.60e+05 hpm1 48.185 ppm1 1.618 ppm2 6.885
ASSI ( resid 23 and name HD1# )
     ( resid 14 and name HG2 )
     6.0 4.0 0.0 peak 2006 volume 2.04e+04 hpm1 13.215 ppm1 0.142 ppm2 2.049
ASSI ( resid 23 and name HG12 )
     ( resid 68 and name HE# )
     6.0 4.0 0.0 peak 2007 volume 1.69e+05 hpm1 30.453 ppm1 1.625 ppm2 6.876
ASSI ( resid 23 and name HG2# )
     ( resid 14 and name HG2 )
     6.0 4.0 0.0 peak 2008 volume 8.84e+05 hpm1 17.351 ppm1 0.549 ppm2 2.073
ASSI ( resid 63 and name HG2# )
     ( resid 68 and name HD# )
     6.0 4.0 0.0 peak 2009 volume 8.25e+05 hpm1 18.852 ppm1 0.781 ppm2 6.944
ASSI ( resid 50 and name H )
     ( resid 4 and name HE# )
     6.0 4.0 0.0 peak 2010 volume 3.86e+05 hpm1 119.634 ppm1 8.528 ppm2 1.920
ASSI ( resid 49 and name H )
     ( resid 4 and name HE# )
     6.0 4.0 0.0 peak 2011 volume 8.93e+04 hpm1 119.554 ppm1 9.252 ppm2 1.936

 ASSI {    7}
   (( segid "ATXH" and resid 11   and name HA  ))
   (( segid "ATXH" and resid 10   and name HN  ))
      2.300     2.300     3.700 peak     7 spectrum    1 weight  0.10000E+01 volume  0.10310E-01 ppm1      9.035 ppm2      4.793 CV     1
 OR {    7}
   (( segid "ATXH" and resid 8    and name HA  ))
   (( segid "ATXH" and resid 10   and name HN  ))
 ASSI {    8}
   (( segid "ATXH" and resid 59   and name HB  ))
   (( segid "ATXH" and resid 60   and name HN  ))
      2.100     0.500     0.500 peak     8 spectrum    1 weight  0.10000E+01 volume  0.10068E-01 ppm1      8.537 ppm2      2.015 CV     1
 OR {    8}
   (( segid "ATXH" and resid 60   and name HB  ))
   (( segid "ATXH" and resid 60   and name HN  ))
 ASSI {   18}
   (  segid "ATXH" and resid 22   and name HB% )
   (( segid "ATXH" and resid 23   and name HN  ))
      2.200     0.600     0.600 peak    18 spectrum    1 weight  0.10000E+01 volume  0.85603E-02 ppm1      8.268 ppm2      1.631 CV     1
 OR {   18}
   (( segid "ATXH" and resid 23   and name HB  ))
   (( segid "ATXH" and resid 23   and name HN  ))
 ASSI {   25}
   (( segid "ATXH" and resid 44   and name HN  ))
   (( segid "ATXH" and resid 43   and name HN  ))
      2.300     0.600     0.600 peak    25 spectrum    1 weight  0.10000E+01 volume  0.67450E-02 ppm1      7.940 ppm2      7.578 CV     1
 OR {   25}
   (( segid "ATXH" and resid 42   and name HN  ))
   (( segid "ATXH" and resid 43   and name HN  ))
 ASSI {   30}
   (( segid "ATXH" and resid 70   and name HA  ))
   (( segid "ATXH" and resid 71   and name HN  ))
      2.300     0.700     0.700 peak    30 spectrum    1 weight  0.10000E+01 volume  0.61948E-02 ppm1      8.788 ppm2      4.543 CV     1
 OR {   30}
   (( segid "ATXH" and resid 71   and name HA  ))
   (( segid "ATXH" and resid 71   and name HN  ))
 ASSI {   31}
   (  segid "ATXH" and resid 33   and name HG1%)
   (( segid "ATXH" and resid 33   and name HN  ))
      2.700     0.900     0.900 peak    31 spectrum    1 weight  0.10000E+01 volume  0.61728E-02 ppm1      7.523 ppm2      0.836 CV     1
 OR {   31}
   (  segid "ATXH" and resid 53   and name HG1%)
   (( segid "ATXH" and resid 33   and name HN  ))
 ASSI {   34}
   (( segid "ATXH" and resid 30   and name HB2 ))
   (( segid "ATXH" and resid 30   and name HN  ))
      2.300     0.600     0.600 peak    34 spectrum    1 weight  0.10000E+01 volume  0.59528E-02 ppm1      7.448 ppm2      2.012 CV     1
 OR {   34}
   (( segid "ATXH" and resid 29   and name HB2 ))
   (( segid "ATXH" and resid 30   and name HN  ))
 ASSI {   48}
   (( segid "ATXH" and resid 63   and name HN  ))
   (( segid "ATXH" and resid 62   and name HN  ))
      2.400     0.700     0.700 peak    48 spectrum    1 weight  0.10000E+01 volume  0.49624E-02 ppm1      7.187 ppm2      7.677 CV     1
 OR {   48}
   (( segid "ATXH" and resid 61   and name HN  ))
   (( segid "ATXH" and resid 62   and name HN  ))
 ASSI {   53}
   (( segid "ATXH" and resid 25   and name HN  ))
   (( segid "ATXH" and resid 26   and name HN  ))
      2.400     0.700     0.700 peak    53 spectrum    1 weight  0.10000E+01 volume  0.48304E-02 ppm1      7.528 ppm2      8.193 CV     1
 OR {   53}
   (( segid "ATXH" and resid 27   and name HN  ))
   (( segid "ATXH" and resid 26   and name HN  ))
 ASSI {   63}
   (  segid "ATXH" and resid 36   and name HG2%)
   (( segid "ATXH" and resid 38   and name HN  ))
      2.500     0.800     0.800 peak    63 spectrum    1 weight  0.10000E+01 volume  0.45443E-02 ppm1      9.833 ppm2      0.884 CV     1
 OR {   63}
   (  segid "ATXH" and resid 20   and name HG2%)
   (( segid "ATXH" and resid 38   and name HN  ))
 ASSI {   64}
   (( segid "ATXH" and resid 5    and name HB3 ))
   (( segid "ATXH" and resid 5    and name HN  ))
      2.600     0.900     0.900 peak    64 spectrum    1 weight  0.10000E+01 volume  0.44343E-02 ppm1      9.161 ppm2      1.826 CV     1
 OR {   64}
   (( segid "ATXH" and resid 4    and name HB3 ))
   (( segid "ATXH" and resid 5    and name HN  ))
 ASSI {   70}
   (( segid "ATXH" and resid 12   and name HA  ))
   (( segid "ATXH" and resid 13   and name HN  ))
      2.500     0.800     0.800 peak    70 spectrum    1 weight  0.10000E+01 volume  0.42913E-02 ppm1      8.568 ppm2      4.622 CV     1
 OR {   70}
   (( segid "ATXH" and resid 13   and name HA2 ))
   (( segid "ATXH" and resid 13   and name HN  ))
 ASSI {   73}
   (( segid "ATXH" and resid 37   and name HB2 ))
   (( segid "ATXH" and resid 37   and name HN  ))
      2.500     0.800     0.800 peak    73 spectrum    1 weight  0.10000E+01 volume  0.41922E-02 ppm1      9.018 ppm2      1.752 CV     1
 OR {   73}
   (( segid "ATXH" and resid 37   and name HB2 ))
   (( segid "ATXH" and resid 46   and name HN  ))
 ASSI {   74}
   (( segid "ATXH" and resid 64   and name HA  ))
   (( segid "ATXH" and resid 68   and name HN  ))
      2.400     0.700     0.700 peak    74 spectrum    1 weight  0.10000E+01 volume  0.41812E-02 ppm1      6.775 ppm2      4.656 CV     1
 OR {   74}
   (( segid "ATXH" and resid 68   and name HA  ))
   (( segid "ATXH" and resid 68   and name HN  ))
 ASSI {   80}
   (  segid "ATXH" and resid 45   and name HG1%)
   (( segid "ATXH" and resid 45   and name HN  ))
      2.700     0.900     0.900 peak    80 spectrum    1 weight  0.10000E+01 volume  0.38622E-02 ppm1      8.993 ppm2      0.765 CV     1
 OR {   80}
   (  segid "ATXH" and resid 63   and name HG2%)
   (( segid "ATXH" and resid 64   and name HN  ))
 ASSI {   85}
   (( segid "ATXH" and resid 30   and name HG  ))
   (( segid "ATXH" and resid 30   and name HN  ))
      2.700     2.700     3.300 peak    85 spectrum    1 weight  0.10000E+01 volume  0.37961E-02 ppm1      7.448 ppm2      1.843 CV     1
 OR {   85}
   (( segid "ATXH" and resid 28   and name HB3 ))
   (( segid "ATXH" and resid 30   and name HN  ))
 ASSI {   88}
   (( segid "ATXH" and resid 57   and name HA  ))
   (( segid "ATXH" and resid 57   and name HN  ))
      2.600     0.800     0.800 peak    88 spectrum    1 weight  0.10000E+01 volume  0.36970E-02 ppm1      8.104 ppm2      3.854 CV     1
 OR {   88}
   (( segid "ATXH" and resid 56   and name HA  ))
   (( segid "ATXH" and resid 57   and name HN  ))
 ASSI {  101}
   (( segid "ATXH" and resid 20   and name HA  ))
   (( segid "ATXH" and resid 20   and name HN  ))
      2.600     0.800     0.800 peak   101 spectrum    1 weight  0.10000E+01 volume  0.35100E-02 ppm1      7.018 ppm2      3.256 CV     1
 OR {  101}
   (( segid "ATXH" and resid 19   and name HB2 ))
   (( segid "ATXH" and resid 20   and name HN  ))
 ASSI {  102}
   (( segid "ATXH" and resid 6    and name HB3 ))
   (( segid "ATXH" and resid 6    and name HN  ))
      2.800     1.000     1.000 peak   102 spectrum    1 weight  0.10000E+01 volume  0.34990E-02 ppm1      8.621 ppm2      1.870 CV     1
 OR {  102}
   (( segid "ATXH" and resid 5    and name HB3 ))
   (( segid "ATXH" and resid 6    and name HN  ))
 ASSI {  106}
   (  segid "ATXH" and resid 59   and name HG2%)
   (( segid "ATXH" and resid 60   and name HN  ))
      2.900     1.000     1.000 peak   106 spectrum    1 weight  0.10000E+01 volume  0.34660E-02 ppm1      8.531 ppm2      0.725 CV     1
 OR {  106}
   (  segid "ATXH" and resid 49   and name HG2%)
   (( segid "ATXH" and resid 50   and name HN  ))
 ASSI {  107}
   (  segid "ATXH" and resid 47   and name HG2%)
   (( segid "ATXH" and resid 37   and name HN  ))
      2.700     0.900     0.900 peak   107 spectrum    1 weight  0.10000E+01 volume  0.34110E-02 ppm1      9.026 ppm2      0.825 CV     1
 OR {  107}
   (  segid "ATXH" and resid 36   and name HG2%)
   (( segid "ATXH" and resid 37   and name HN  ))
 OR {  107}
   (  segid "ATXH" and resid 36   and name HG1%)
   (( segid "ATXH" and resid 37   and name HN  ))
 ASSI {  112}
   (( segid "ATXH" and resid 24   and name HN  ))
   (( segid "ATXH" and resid 23   and name HN  ))
      2.600     0.800     0.800 peak   112 spectrum    1 weight  0.10000E+01 volume  0.33450E-02 ppm1      8.267 ppm2      8.574 CV     1
 OR {  112}
   (( segid "ATXH" and resid 22   and name HN  ))
   (( segid "ATXH" and resid 23   and name HN  ))
 ASSI {  118}
   (  segid "ATXH" and resid 44   and name HG2%)
   (( segid "ATXH" and resid 45   and name HN  ))
      2.900     1.100     1.100 peak   118 spectrum    1 weight  0.10000E+01 volume  0.32679E-02 ppm1      8.996 ppm2      0.943 CV     1
 OR {  118}
   (( segid "ATXH" and resid 63   and name HG12))
   (( segid "ATXH" and resid 64   and name HN  ))
 OR {  118}
   (  segid "ATXH" and resid 60   and name HG1%)
   (( segid "ATXH" and resid 64   and name HN  ))
 ASSI {  120}
   (( segid "ATXH" and resid 26   and name HB2 ))
   (( segid "ATXH" and resid 26   and name HN  ))
      2.600     0.900     0.900 peak   120 spectrum    1 weight  0.10000E+01 volume  0.32240E-02 ppm1      7.528 ppm2      3.914 CV     1
 OR {  120}
   (( segid "ATXH" and resid 25   and name HB2 ))
   (( segid "ATXH" and resid 26   and name HN  ))
 ASSI {  122}
   (( segid "ATXH" and resid 24   and name HB3 ))
   (( segid "ATXH" and resid 38   and name HN  ))
      2.800     1.000     1.000 peak   122 spectrum    1 weight  0.10000E+01 volume  0.31689E-02 ppm1      9.834 ppm2      1.927 CV     1
 OR {  122}
   (( segid "ATXH" and resid 36   and name HB  ))
   (( segid "ATXH" and resid 38   and name HN  ))
 ASSI {  130}
   (( segid "ATXH" and resid 63   and name HB  ))
   (( segid "ATXH" and resid 64   and name HN  ))
      2.600     0.800     0.800 peak   130 spectrum    1 weight  0.10000E+01 volume  0.30369E-02 ppm1      9.005 ppm2      1.770 CV     1
 OR {  130}
   (( segid "ATXH" and resid 45   and name HB  ))
   (( segid "ATXH" and resid 45   and name HN  ))
 ASSI {  134}
   (( segid "ATXH" and resid 23   and name HN  ))
   (( segid "ATXH" and resid 24   and name HN  ))
      2.600     0.800     0.800 peak   134 spectrum    1 weight  0.10000E+01 volume  0.30039E-02 ppm1      8.598 ppm2      8.238 CV     1
 OR {  134}
   (( segid "ATXH" and resid 25   and name HN  ))
   (( segid "ATXH" and resid 24   and name HN  ))
 ASSI {  143}
   (  segid "ATXH" and resid 45   and name HG1%)
   (( segid "ATXH" and resid 39   and name HN  ))
      2.900     1.100     1.100 peak   143 spectrum    1 weight  0.10000E+01 volume  0.28718E-02 ppm1      8.891 ppm2      0.784 CV     1
 OR {  143}
   (  segid "ATXH" and resid 38   and name HG2%)
   (( segid "ATXH" and resid 39   and name HN  ))
 ASSI {  145}
   (( segid "ATXH" and resid 39   and name HG3 ))
   (( segid "ATXH" and resid 39   and name HN  ))
      2.800     1.000     1.000 peak   145 spectrum    1 weight  0.10000E+01 volume  0.28718E-02 ppm1      8.892 ppm2      2.075 CV     1
 OR {  145}
   (( segid "ATXH" and resid 38   and name HB  ))
   (( segid "ATXH" and resid 39   and name HN  ))
 ASSI {  161}
   (( segid "ATXH" and resid 35   and name HB3 ))
   (( segid "ATXH" and resid 36   and name HN  ))
      2.800     1.000     1.000 peak   161 spectrum    1 weight  0.10000E+01 volume  0.25858E-02 ppm1      8.665 ppm2      1.924 CV     1
 OR {  161}
   (( segid "ATXH" and resid 36   and name HB  ))
   (( segid "ATXH" and resid 36   and name HN  ))
 ASSI {  162}
   (( segid "ATXH" and resid 51   and name HB3 ))
   (( segid "ATXH" and resid 51   and name HN  ))
      2.600     0.900     0.900 peak   162 spectrum    1 weight  0.10000E+01 volume  0.25858E-02 ppm1      8.795 ppm2      3.841 CV     1
 OR {  162}
   (( segid "ATXH" and resid 56   and name HA  ))
   (( segid "ATXH" and resid 56   and name HN  ))
 ASSI {  167}
   (  segid "ATXH" and resid 59   and name HD1%)
   (( segid "ATXH" and resid 59   and name HN  ))
      2.900     1.000     1.000 peak   167 spectrum    1 weight  0.10000E+01 volume  0.25417E-02 ppm1      7.360 ppm2      0.732 CV     1
 OR {  167}
   (  segid "ATXH" and resid 59   and name HG2%)
   (( segid "ATXH" and resid 59   and name HN  ))
 OR {  167}
   (  segid "ATXH" and resid 54   and name HG2%)
   (( segid "ATXH" and resid 59   and name HN  ))
 ASSI {  171}
   (( segid "ATXH" and resid 29   and name HA  ))
   (( segid "ATXH" and resid 29   and name HN  ))
      2.700     0.900     0.900 peak   171 spectrum    1 weight  0.10000E+01 volume  0.24647E-02 ppm1      6.875 ppm2      4.064 CV     1
 OR {  171}
   (( segid "ATXH" and resid 25   and name HA  ))
   (( segid "ATXH" and resid 29   and name HN  ))
 ASSI {  176}
   (  segid "ATXH" and resid 36   and name HG2%)
   (( segid "ATXH" and resid 28   and name HN  ))
      2.900     1.100     1.100 peak   176 spectrum    1 weight  0.10000E+01 volume  0.23987E-02 ppm1      7.699 ppm2      0.866 CV     1
 OR {  176}
   (  segid "ATXH" and resid 27   and name HG2%)
   (( segid "ATXH" and resid 28   and name HN  ))
 OR {  176}
   (  segid "ATXH" and resid 27   and name HG1%)
   (( segid "ATXH" and resid 28   and name HN  ))
 ASSI {  183}
   (( segid "ATXH" and resid 27   and name HA  ))
   (( segid "ATXH" and resid 27   and name HN  ))
      2.700     0.900     0.900 peak   183 spectrum    1 weight  0.10000E+01 volume  0.23437E-02 ppm1      8.177 ppm2      3.676 CV     1
 OR {  183}
   (( segid "ATXH" and resid 26   and name HB3 ))
   (( segid "ATXH" and resid 27   and name HN  ))
 ASSI {  184}
   (( segid "ATXH" and resid 19   and name HB2 ))
   (( segid "ATXH" and resid 19   and name HN  ))
      2.800     1.000     1.000 peak   184 spectrum    1 weight  0.10000E+01 volume  0.23437E-02 ppm1      7.840 ppm2      3.270 CV     1
 OR {  184}
   (( segid "ATXH" and resid 18   and name HB2 ))
   (( segid "ATXH" and resid 19   and name HN  ))
 ASSI {  189}
   (( segid "ATXH" and resid 47   and name HB  ))
   (( segid "ATXH" and resid 48   and name HN  ))
      3.000     1.100     1.100 peak   189 spectrum    1 weight  0.10000E+01 volume  0.23107E-02 ppm1      8.715 ppm2      1.898 CV     1
 OR {  189}
   (( segid "ATXH" and resid 34   and name HB2 ))
   (( segid "ATXH" and resid 48   and name HN  ))
 ASSI {  190}
   (( segid "ATXH" and resid 35   and name HA  ))
   (( segid "ATXH" and resid 35   and name HN  ))
      2.700     0.900     0.900 peak   190 spectrum    1 weight  0.10000E+01 volume  0.22997E-02 ppm1      7.512 ppm2      4.618 CV     1
 OR {  190}
   (( segid "ATXH" and resid 64   and name HA  ))
   (( segid "ATXH" and resid 66   and name HN  ))
 ASSI {  192}
   (( segid "ATXH" and resid 19   and name HN  ))
   (( segid "ATXH" and resid 20   and name HN  ))
      2.800     0.900     0.900 peak   192 spectrum    1 weight  0.10000E+01 volume  0.22777E-02 ppm1      7.018 ppm2      7.839 CV     1
 OR {  192}
   (( segid "ATXH" and resid 21   and name HN  ))
   (( segid "ATXH" and resid 20   and name HN  ))
 ASSI {  197}
   (( segid "ATXH" and resid 64   and name HA  ))
   (( segid "ATXH" and resid 64   and name HN  ))
      2.800     1.000     1.000 peak   197 spectrum    1 weight  0.10000E+01 volume  0.22446E-02 ppm1      9.007 ppm2      4.680 CV     1
 OR {  197}
   (( segid "ATXH" and resid 10   and name HA  ))
   (( segid "ATXH" and resid 45   and name HN  ))
 ASSI {  198}
   (  segid "ATXH" and resid 60   and name HG2%)
   (( segid "ATXH" and resid 61   and name HN  ))
      3.200     1.300     1.300 peak   198 spectrum    1 weight  0.10000E+01 volume  0.22336E-02 ppm1      7.709 ppm2      0.852 CV     1
 OR {  198}
   (  segid "ATXH" and resid 62   and name HG2%)
   (( segid "ATXH" and resid 61   and name HN  ))
 ASSI {  204}
   (( segid "ATXH" and resid 4    and name HB2 ))
   (( segid "ATXH" and resid 5    and name HN  ))
      2.800     1.000     1.000 peak   204 spectrum    1 weight  0.10000E+01 volume  0.21456E-02 ppm1      9.160 ppm2      1.963 CV     1
 OR {  204}
   (( segid "ATXH" and resid 5    and name HB2 ))
   (( segid "ATXH" and resid 5    and name HN  ))
 ASSI {  209}
   (  segid "ATXH" and resid 47   and name HG1%)
   (( segid "ATXH" and resid 35   and name HN  ))
      2.800     1.000     1.000 peak   209 spectrum    1 weight  0.10000E+01 volume  0.20686E-02 ppm1      7.511 ppm2      0.843 CV     1
 OR {  209}
   (  segid "ATXH" and resid 33   and name HG1%)
   (( segid "ATXH" and resid 35   and name HN  ))
 ASSI {  213}
   (( segid "ATXH" and resid 63   and name HB  ))
   (( segid "ATXH" and resid 61   and name HN  ))
      3.000     3.000     3.000 peak   213 spectrum    1 weight  0.10000E+01 volume  0.20246E-02 ppm1      7.711 ppm2      1.793 CV     1
 OR {  213}
   (( segid "ATXH" and resid 57   and name HB2 ))
   (( segid "ATXH" and resid 61   and name HN  ))
 ASSI {  214}
   (  segid "ATXH" and resid 45   and name HG2%)
   (( segid "ATXH" and resid 46   and name HN  ))
      3.300     1.400     1.400 peak   214 spectrum    1 weight  0.10000E+01 volume  0.20026E-02 ppm1      9.027 ppm2      0.590 CV     1
 OR {  214}
   (  segid "ATXH" and resid 45   and name HG2%)
   (( segid "ATXH" and resid 37   and name HN  ))
 ASSI {  232}
   (  segid "ATXH" and resid 49   and name HG2%)
   (( segid "ATXH" and resid 48   and name HN  ))
      3.000     1.100     1.100 peak   232 spectrum    1 weight  0.10000E+01 volume  0.18595E-02 ppm1      8.713 ppm2      0.708 CV     1
 OR {  232}
   (  segid "ATXH" and resid 45   and name HG1%)
   (( segid "ATXH" and resid 48   and name HN  ))
 ASSI {  234}
   (( segid "ATXH" and resid 6    and name HG2 ))
   (( segid "ATXH" and resid 6    and name HN  ))
      3.300     1.300     1.300 peak   234 spectrum    1 weight  0.10000E+01 volume  0.18265E-02 ppm1      8.621 ppm2      2.196 CV     1
 OR {  234}
   (( segid "ATXH" and resid 5    and name HG2 ))
   (( segid "ATXH" and resid 6    and name HN  ))
 ASSI {  245}
   (  segid "ATXH" and resid 45   and name HG2%)
   (( segid "ATXH" and resid 45   and name HN  ))
      3.000     1.100     1.100 peak   245 spectrum    1 weight  0.10000E+01 volume  0.17055E-02 ppm1      8.998 ppm2      0.587 CV     1
 OR {  245}
   (( segid "ATXH" and resid 63   and name HG13))
   (( segid "ATXH" and resid 64   and name HN  ))
 OR {  245}
   (  segid "ATXH" and resid 63   and name HD1%)
   (( segid "ATXH" and resid 64   and name HN  ))
 ASSI {  248}
   (( segid "ATXH" and resid 42   and name HG3 ))
   (( segid "ATXH" and resid 42   and name HN  ))
      3.200     1.300     1.300 peak   248 spectrum    1 weight  0.10000E+01 volume  0.16945E-02 ppm1      7.561 ppm2      2.297 CV     1
 OR {  248}
   (( segid "ATXH" and resid 39   and name HB2 ))
   (( segid "ATXH" and resid 42   and name HN  ))
 ASSI {  255}
   (  segid "ATXH" and resid 55   and name HG2%)
   (( segid "ATXH" and resid 58   and name HN  ))
      3.300     1.300     1.300 peak   255 spectrum    1 weight  0.10000E+01 volume  0.16285E-02 ppm1      7.583 ppm2      1.170 CV     1
 OR {  255}
   (( segid "ATXH" and resid 59   and name HG13))
   (( segid "ATXH" and resid 58   and name HN  ))
 ASSI {  261}
   (( segid "ATXH" and resid 71   and name HG2 ))
   (( segid "ATXH" and resid 71   and name HN  ))
      3.000     1.200     1.200 peak   261 spectrum    1 weight  0.10000E+01 volume  0.15625E-02 ppm1      8.788 ppm2      2.263 CV     1
 OR {  261}
   (( segid "ATXH" and resid 10   and name HG3 ))
   (( segid "ATXH" and resid 71   and name HN  ))
 OR {  261}
   (( segid "ATXH" and resid 71   and name HG3 ))
   (( segid "ATXH" and resid 71   and name HN  ))
 ASSI {  269}
   (( segid "ATXH" and resid 12   and name HG2 ))
   (( segid "ATXH" and resid 12   and name HN  ))
      3.000     1.100     1.100 peak   269 spectrum    1 weight  0.10000E+01 volume  0.14744E-02 ppm1      9.282 ppm2      2.276 CV     1
 OR {  269}
   (( segid "ATXH" and resid 68   and name HB3 ))
   (( segid "ATXH" and resid 12   and name HN  ))
 ASSI {  274}
   (  segid "ATXH" and resid 30   and name HD1%)
   (( segid "ATXH" and resid 58   and name HN  ))
      3.200     1.300     1.300 peak   274 spectrum    1 weight  0.10000E+01 volume  0.14084E-02 ppm1      7.578 ppm2      0.852 CV     1
 OR {  274}
   (( segid "ATXH" and resid 56   and name HG  ))
   (( segid "ATXH" and resid 58   and name HN  ))
 OR {  274}
   (  segid "ATXH" and resid 56   and name HD1%)
   (( segid "ATXH" and resid 58   and name HN  ))
 OR {  274}
   (  segid "ATXH" and resid 56   and name HD2%)
   (( segid "ATXH" and resid 58   and name HN  ))
 OR {  274}
   (  segid "ATXH" and resid 60   and name HG2%)
   (( segid "ATXH" and resid 58   and name HN  ))
 ASSI {  276}
   (  segid "ATXH" and resid 20   and name HG2%)
   (( segid "ATXH" and resid 24   and name HN  ))
      3.200     1.200     1.200 peak   276 spectrum    1 weight  0.10000E+01 volume  0.13974E-02 ppm1      8.599 ppm2      0.884 CV     1
 OR {  276}
   (  segid "ATXH" and resid 36   and name HG2%)
   (( segid "ATXH" and resid 24   and name HN  ))
 OR {  276}
   (  segid "ATXH" and resid 27   and name HG2%)
   (( segid "ATXH" and resid 24   and name HN  ))
 ASSI {  281}
   (( segid "ATXH" and resid 63   and name HG12))
   (( segid "ATXH" and resid 63   and name HN  ))
      3.600     1.700     1.700 peak   281 spectrum    1 weight  0.10000E+01 volume  0.13314E-02 ppm1      7.635 ppm2      0.890 CV     1
 OR {  281}
   (  segid "ATXH" and resid 62   and name HG2%)
   (( segid "ATXH" and resid 63   and name HN  ))
 ASSI {  290}
   (( segid "ATXH" and resid 13   and name HA2 ))
   (( segid "ATXH" and resid 14   and name HN  ))
      3.300     1.300     1.300 peak   290 spectrum    1 weight  0.10000E+01 volume  0.12984E-02 ppm1      8.889 ppm2      4.625 CV     1
 OR {  290}
   (( segid "ATXH" and resid 12   and name HA  ))
   (( segid "ATXH" and resid 14   and name HN  ))
 ASSI {  295}
   (( segid "ATXH" and resid 57   and name HA  ))
   (( segid "ATXH" and resid 61   and name HN  ))
      3.200     1.300     1.300 peak   295 spectrum    1 weight  0.10000E+01 volume  0.12654E-02 ppm1      7.710 ppm2      3.853 CV     1
 OR {  295}
   (( segid "ATXH" and resid 62   and name HA  ))
   (( segid "ATXH" and resid 61   and name HN  ))
 ASSI {  303}
   (( segid "ATXH" and resid 9    and name HB2 ))
   (( segid "ATXH" and resid 45   and name HN  ))
      3.200     3.200     2.800 peak   303 spectrum    1 weight  0.10000E+01 volume  0.12103E-02 ppm1      8.976 ppm2      1.563 CV     1
 OR {  303}
   (( segid "ATXH" and resid 23   and name HG12))
   (( segid "ATXH" and resid 64   and name HN  ))
 OR {  303}
   (( segid "ATXH" and resid 23   and name HG13))
   (( segid "ATXH" and resid 64   and name HN  ))
 ASSI {  304}
   (  segid "ATXH" and resid 9    and name HD2%)
   (( segid "ATXH" and resid 10   and name HN  ))
      3.400     1.500     1.500 peak   304 spectrum    1 weight  0.10000E+01 volume  0.12103E-02 ppm1      9.034 ppm2      0.724 CV     1
 OR {  304}
   (  segid "ATXH" and resid 11   and name HG2%)
   (( segid "ATXH" and resid 10   and name HN  ))
 ASSI {  305}
   (( segid "ATXH" and resid 57   and name HA  ))
   (( segid "ATXH" and resid 60   and name HN  ))
      3.100     1.200     1.200 peak   305 spectrum    1 weight  0.10000E+01 volume  0.12103E-02 ppm1      8.537 ppm2      3.855 CV     1
 OR {  305}
   (( segid "ATXH" and resid 56   and name HA  ))
   (( segid "ATXH" and resid 60   and name HN  ))
 ASSI {  312}
   (( segid "ATXH" and resid 7    and name HB2 ))
   (( segid "ATXH" and resid 47   and name HN  ))
      3.100     1.200     1.200 peak   312 spectrum    1 weight  0.10000E+01 volume  0.11773E-02 ppm1      9.162 ppm2      1.576 CV     1
 OR {  312}
   (( segid "ATXH" and resid 9    and name HB2 ))
   (( segid "ATXH" and resid 47   and name HN  ))
 ASSI {  314}
   (( segid "ATXH" and resid 5    and name HB3 ))
   (( segid "ATXH" and resid 49   and name HN  ))
      3.300     1.400     1.400 peak   314 spectrum    1 weight  0.10000E+01 volume  0.11554E-02 ppm1      9.252 ppm2      1.864 CV     1
 OR {  314}
   (  segid "ATXH" and resid 4    and name HE% )
   (( segid "ATXH" and resid 49   and name HN  ))
 OR {  314}
   (( segid "ATXH" and resid 47   and name HB  ))
   (( segid "ATXH" and resid 49   and name HN  ))
 OR {  314}
   (( segid "ATXH" and resid 6    and name HB3 ))
   (( segid "ATXH" and resid 49   and name HN  ))
 ASSI {  315}
   (( segid "ATXH" and resid 41   and name HA  ))
   (( segid "ATXH" and resid 42   and name HN  ))
      3.300     1.300     1.300 peak   315 spectrum    1 weight  0.10000E+01 volume  0.11554E-02 ppm1      7.559 ppm2      4.025 CV     1
 OR {  315}
   (( segid "ATXH" and resid 43   and name HA2 ))
   (( segid "ATXH" and resid 42   and name HN  ))
 ASSI {  325}
   (( segid "ATXH" and resid 47   and name HB  ))
   (( segid "ATXH" and resid 47   and name HN  ))
      3.100     1.200     1.200 peak   325 spectrum    1 weight  0.10000E+01 volume  0.10794E-02 ppm1      9.161 ppm2      1.896 CV     1
 OR {  325}
   (( segid "ATXH" and resid 46   and name HB3 ))
   (( segid "ATXH" and resid 47   and name HN  ))
 ASSI {  327}
   (  segid "ATXH" and resid 3    and name HB% )
   (( segid "ATXH" and resid 51   and name HN  ))
      3.100     1.200     1.200 peak   327 spectrum    1 weight  0.10000E+01 volume  0.10684E-02 ppm1      8.794 ppm2      1.390 CV     1
 OR {  327}
   (( segid "ATXH" and resid 49   and name HG13))
   (( segid "ATXH" and resid 51   and name HN  ))
 ASSI {  331}
   (( segid "ATXH" and resid 42   and name HB2 ))
   (( segid "ATXH" and resid 44   and name HN  ))
      3.300     1.300     1.300 peak   331 spectrum    1 weight  0.10000E+01 volume  0.10563E-02 ppm1      7.597 ppm2      2.082 CV     1
 OR {  331}
   (( segid "ATXH" and resid 39   and name HG3 ))
   (( segid "ATXH" and resid 44   and name HN  ))
 ASSI {  332}
   (( segid "ATXH" and resid 33   and name HB  ))
   (( segid "ATXH" and resid 34   and name HN  ))
      3.500     1.500     1.500 peak   332 spectrum    1 weight  0.10000E+01 volume  0.10563E-02 ppm1      8.788 ppm2      2.219 CV     1
 OR {  332}
   (( segid "ATXH" and resid 34   and name HG2 ))
   (( segid "ATXH" and resid 34   and name HN  ))
 ASSI {  336}
   (( segid "ATXH" and resid 22   and name HA  ))
   (( segid "ATXH" and resid 22   and name HN  ))
      3.200     1.300     1.300 peak   336 spectrum    1 weight  0.10000E+01 volume  0.10255E-02 ppm1      8.534 ppm2      4.089 CV     1
 OR {  336}
   (( segid "ATXH" and resid 19   and name HA  ))
   (( segid "ATXH" and resid 22   and name HN  ))
 ASSI {  339}
   (( segid "ATXH" and resid 30   and name HB2 ))
   (( segid "ATXH" and resid 33   and name HN  ))
      3.500     1.500     1.500 peak   339 spectrum    1 weight  0.10000E+01 volume  0.10035E-02 ppm1      7.524 ppm2      2.008 CV     1
 OR {  339}
   (( segid "ATXH" and resid 53   and name HB  ))
   (( segid "ATXH" and resid 33   and name HN  ))
 ASSI {  342}
   (( segid "ATXH" and resid 32   and name HA2 ))
   (( segid "ATXH" and resid 54   and name HN  ))
      3.200     1.300     1.300 peak   342 spectrum    1 weight  0.10000E+01 volume  0.98696E-03 ppm1      8.016 ppm2      4.181 CV     1
 OR {  342}
   (( segid "ATXH" and resid 53   and name HA  ))
   (( segid "ATXH" and resid 54   and name HN  ))
 ASSI {  347}
   (( segid "ATXH" and resid 46   and name HG2 ))
   (( segid "ATXH" and resid 46   and name HN  ))
      3.500     1.500     1.500 peak   347 spectrum    1 weight  0.10000E+01 volume  0.95725E-03 ppm1      9.030 ppm2      2.161 CV     1
 OR {  347}
   (( segid "ATXH" and resid 39   and name HG2 ))
   (( segid "ATXH" and resid 46   and name HN  ))
 ASSI {  351}
   (  segid "ATXH" and resid 59   and name HD1%)
   (( segid "ATXH" and resid 58   and name HN  ))
      3.400     1.500     1.500 peak   351 spectrum    1 weight  0.10000E+01 volume  0.94408E-03 ppm1      7.583 ppm2      0.721 CV     1
 OR {  351}
   (  segid "ATXH" and resid 54   and name HG2%)
   (( segid "ATXH" and resid 58   and name HN  ))
 ASSI {  353}
   (  segid "ATXH" and resid 63   and name HG2%)
   (( segid "ATXH" and resid 63   and name HN  ))
      3.700     1.700     1.700 peak   353 spectrum    1 weight  0.10000E+01 volume  0.92977E-03 ppm1      7.636 ppm2      0.762 CV     1
 OR {  353}
   (  segid "ATXH" and resid 59   and name HG2%)
   (( segid "ATXH" and resid 63   and name HN  ))
 ASSI {  355}
   (  segid "ATXH" and resid 49   and name HD1%)
   (( segid "ATXH" and resid 51   and name HN  ))
      3.200     1.300     1.300 peak   355 spectrum    1 weight  0.10000E+01 volume  0.92430E-03 ppm1      8.795 ppm2      0.666 CV     1
 OR {  355}
   (  segid "ATXH" and resid 49   and name HD1%)
   (( segid "ATXH" and resid 56   and name HN  ))
 ASSI {  357}
   (( segid "ATXH" and resid 57   and name HA  ))
   (( segid "ATXH" and resid 58   and name HN  ))
      3.300     1.300     1.300 peak   357 spectrum    1 weight  0.10000E+01 volume  0.92099E-03 ppm1      7.582 ppm2      3.853 CV     1
 OR {  357}
   (( segid "ATXH" and resid 56   and name HA  ))
   (( segid "ATXH" and resid 58   and name HN  ))
 ASSI {  366}
   (( segid "ATXH" and resid 60   and name HB  ))
   (( segid "ATXH" and resid 62   and name HN  ))
      3.600     1.600     1.600 peak   366 spectrum    1 weight  0.10000E+01 volume  0.89675E-03 ppm1      7.188 ppm2      2.029 CV     1
 OR {  366}
   (( segid "ATXH" and resid 59   and name HB  ))
   (( segid "ATXH" and resid 62   and name HN  ))
 ASSI {  373}
   (( segid "ATXH" and resid 19   and name HB3 ))
   (( segid "ATXH" and resid 20   and name HN  ))
      3.500     1.500     1.500 peak   373 spectrum    1 weight  0.10000E+01 volume  0.84948E-03 ppm1      7.017 ppm2      2.767 CV     1
 OR {  373}
   (( segid "ATXH" and resid 21   and name HB2 ))
   (( segid "ATXH" and resid 20   and name HN  ))
 ASSI {  374}
   (  segid "ATXH" and resid 62   and name HG1%)
   (( segid "ATXH" and resid 30   and name HN  ))
      3.000     3.000     3.000 peak   374 spectrum    1 weight  0.10000E+01 volume  0.83732E-03 ppm1      7.448 ppm2      1.165 CV     1
 OR {  374}
   (  segid "ATXH" and resid 54   and name HG1%)
   (( segid "ATXH" and resid 30   and name HN  ))
 ASSI {  381}
   (( segid "ATXH" and resid 28   and name HB3 ))
   (( segid "ATXH" and resid 26   and name HN  ))
      3.700     1.700     1.700 peak   381 spectrum    1 weight  0.10000E+01 volume  0.82301E-03 ppm1      7.527 ppm2      1.888 CV     1
 OR {  381}
   (( segid "ATXH" and resid 24   and name HB3 ))
   (( segid "ATXH" and resid 26   and name HN  ))
 ASSI {  382}
   (( segid "ATXH" and resid 56   and name HA  ))
   (( segid "ATXH" and resid 59   and name HN  ))
      3.300     1.400     1.400 peak   382 spectrum    1 weight  0.10000E+01 volume  0.81862E-03 ppm1      7.361 ppm2      3.871 CV     1
 OR {  382}
   (( segid "ATXH" and resid 57   and name HA  ))
   (( segid "ATXH" and resid 59   and name HN  ))
 ASSI {  391}
   (( segid "ATXH" and resid 37   and name HB3 ))
   (( segid "ATXH" and resid 37   and name HN  ))
      3.600     1.600     1.600 peak   391 spectrum    1 weight  0.10000E+01 volume  0.78013E-03 ppm1      8.993 ppm2      1.595 CV     1
 OR {  391}
   (( segid "ATXH" and resid 37   and name HB3 ))
   (( segid "ATXH" and resid 46   and name HN  ))
 OR {  391}
   (( segid "ATXH" and resid 37   and name HD3 ))
   (( segid "ATXH" and resid 37   and name HN  ))
 ASSI {  394}
   (( segid "ATXH" and resid 52   and name HN  ))
   (( segid "ATXH" and resid 54   and name HN  ))
      3.700     1.700     1.700 peak   394 spectrum    1 weight  0.10000E+01 volume  0.76473E-03 ppm1      8.011 ppm2      8.774 CV     1
 OR {  394}
   (( segid "ATXH" and resid 51   and name HN  ))
   (( segid "ATXH" and resid 54   and name HN  ))
 ASSI {  396}
   (( segid "ATXH" and resid 59   and name HA  ))
   (( segid "ATXH" and resid 62   and name HN  ))
      3.400     1.500     1.500 peak   396 spectrum    1 weight  0.10000E+01 volume  0.75811E-03 ppm1      7.187 ppm2      3.492 CV     1
 OR {  396}
   (( segid "ATXH" and resid 63   and name HA  ))
   (( segid "ATXH" and resid 62   and name HN  ))
 ASSI {  397}
   (( segid "ATXH" and resid 64   and name HA  ))
   (( segid "ATXH" and resid 70   and name HN  ))
      3.500     1.500     1.500 peak   397 spectrum    1 weight  0.10000E+01 volume  0.75481E-03 ppm1      9.463 ppm2      4.658 CV     1
 OR {  397}
   (( segid "ATXH" and resid 68   and name HA  ))
   (( segid "ATXH" and resid 70   and name HN  ))
 ASSI {  415}
   (( segid "ATXH" and resid 59   and name HB  ))
   (( segid "ATXH" and resid 58   and name HN  ))
      3.700     1.700     1.700 peak   415 spectrum    1 weight  0.10000E+01 volume  0.69653E-03 ppm1      7.584 ppm2      2.004 CV     1
 OR {  415}
   (( segid "ATXH" and resid 60   and name HB  ))
   (( segid "ATXH" and resid 58   and name HN  ))
 ASSI {  417}
   (  segid "ATXH" and resid 62   and name HG2%)
   (( segid "ATXH" and resid 65   and name HN  ))
      3.700     1.700     1.700 peak   417 spectrum    1 weight  0.10000E+01 volume  0.68107E-03 ppm1      8.422 ppm2      0.851 CV     1
 OR {  417}
   (  segid "ATXH" and resid 60   and name HG2%)
   (( segid "ATXH" and resid 65   and name HN  ))
 ASSI {  422}
   (( segid "ATXH" and resid 21   and name HA  ))
   (( segid "ATXH" and resid 22   and name HN  ))
      3.500     1.500     1.500 peak   422 spectrum    1 weight  0.10000E+01 volume  0.65469E-03 ppm1      8.534 ppm2      4.455 CV     1
 OR {  422}
   (( segid "ATXH" and resid 18   and name HA  ))
   (( segid "ATXH" and resid 22   and name HN  ))
 ASSI {  434}
   (( segid "ATXH" and resid 45   and name HN  ))
   (( segid "ATXH" and resid 11   and name HN  ))
      3.900     1.900     1.900 peak   434 spectrum    1 weight  0.10000E+01 volume  0.61178E-03 ppm1      8.526 ppm2      8.995 CV     1
 OR {  434}
   (( segid "ATXH" and resid 10   and name HN  ))
   (( segid "ATXH" and resid 11   and name HN  ))
 ASSI {  440}
   (  segid "ATXH" and resid 45   and name HG1%)
   (( segid "ATXH" and resid 44   and name HN  ))
      3.200     1.300     1.300 peak   440 spectrum    1 weight  0.10000E+01 volume  0.60297E-03 ppm1      7.592 ppm2      0.767 CV     1
 OR {  440}
   (  segid "ATXH" and resid 40   and name HD2%)
   (( segid "ATXH" and resid 44   and name HN  ))
 ASSI {  444}
   (( segid "ATXH" and resid 27   and name HA  ))
   (( segid "ATXH" and resid 29   and name HN  ))
      3.600     1.600     1.600 peak   444 spectrum    1 weight  0.10000E+01 volume  0.59087E-03 ppm1      6.873 ppm2      3.680 CV     1
 OR {  444}
   (( segid "ATXH" and resid 26   and name HB3 ))
   (( segid "ATXH" and resid 29   and name HN  ))
 ASSI {  452}
   (( segid "ATXH" and resid 6    and name HG2 ))
   (( segid "ATXH" and resid 49   and name HN  ))
      3.900     1.900     1.900 peak   452 spectrum    1 weight  0.10000E+01 volume  0.55677E-03 ppm1      9.248 ppm2      2.181 CV     1
 OR {  452}
   (( segid "ATXH" and resid 5    and name HG2 ))
   (( segid "ATXH" and resid 49   and name HN  ))
 ASSI {  455}
   (( segid "ATXH" and resid 66   and name HB2 ))
   (( segid "ATXH" and resid 68   and name HN  ))
      3.800     1.800     1.800 peak   455 spectrum    1 weight  0.10000E+01 volume  0.54466E-03 ppm1      6.768 ppm2      2.478 CV     1
 OR {  455}
   (( segid "ATXH" and resid 64   and name HG3 ))
   (( segid "ATXH" and resid 68   and name HN  ))
 OR {  455}
   (( segid "ATXH" and resid 66   and name HG2 ))
   (( segid "ATXH" and resid 68   and name HN  ))
 ASSI {  457}
   (( segid "ATXH" and resid 22   and name HA  ))
   (( segid "ATXH" and resid 23   and name HN  ))
      3.700     1.700     1.700 peak   457 spectrum    1 weight  0.10000E+01 volume  0.53805E-03 ppm1      8.267 ppm2      4.090 CV     1
 OR {  457}
   (( segid "ATXH" and resid 19   and name HA  ))
   (( segid "ATXH" and resid 23   and name HN  ))
 ASSI {  458}
   (( segid "ATXH" and resid 32   and name HA2 ))
   (( segid "ATXH" and resid 50   and name HN  ))
      3.600     1.600     1.600 peak   458 spectrum    1 weight  0.10000E+01 volume  0.53366E-03 ppm1      8.532 ppm2      4.219 CV     1
 OR {  458}
   (( segid "ATXH" and resid 61   and name HA  ))
   (( segid "ATXH" and resid 60   and name HN  ))
 ASSI {  459}
   (( segid "ATXH" and resid 51   and name HB2 ))
   (( segid "ATXH" and resid 52   and name HN  ))
      3.900     1.900     1.900 peak   459 spectrum    1 weight  0.10000E+01 volume  0.53256E-03 ppm1      8.773 ppm2      4.181 CV     1
 OR {  459}
   (( segid "ATXH" and resid 53   and name HA  ))
   (( segid "ATXH" and resid 52   and name HN  ))
 ASSI {  463}
   (  segid "ATXH" and resid 45   and name HG2%)
   (( segid "ATXH" and resid 47   and name HN  ))
      3.700     1.700     1.700 peak   463 spectrum    1 weight  0.10000E+01 volume  0.50725E-03 ppm1      9.160 ppm2      0.626 CV     1
 OR {  463}
   (  segid "ATXH" and resid 9    and name HD1%)
   (( segid "ATXH" and resid 47   and name HN  ))
 OR {  463}
   (( segid "ATXH" and resid 9    and name HG  ))
   (( segid "ATXH" and resid 47   and name HN  ))
 ASSI {  475}
   (( segid "ATXH" and resid 40   and name HA  ))
   (( segid "ATXH" and resid 20   and name HN  ))
      3.900     1.900     1.900 peak   475 spectrum    1 weight  0.10000E+01 volume  0.47534E-03 ppm1      7.016 ppm2      3.811 CV     1
 OR {  475}
   (( segid "ATXH" and resid 15   and name HB3 ))
   (( segid "ATXH" and resid 20   and name HN  ))
 ASSI {  477}
   (( segid "ATXH" and resid 28   and name HB3 ))
   (( segid "ATXH" and resid 27   and name HN  ))
      4.100     2.100     1.900 peak   477 spectrum    1 weight  0.10000E+01 volume  0.46434E-03 ppm1      8.179 ppm2      1.860 CV     1
 OR {  477}
   (( segid "ATXH" and resid 28   and name HB2 ))
   (( segid "ATXH" and resid 27   and name HN  ))
 OR {  477}
   (( segid "ATXH" and resid 36   and name HB  ))
   (( segid "ATXH" and resid 27   and name HN  ))
 ASSI {  479}
   (( segid "ATXH" and resid 6    and name HB3 ))
   (( segid "ATXH" and resid 7    and name HN  ))
      3.800     1.800     1.800 peak   479 spectrum    1 weight  0.10000E+01 volume  0.44673E-03 ppm1      9.258 ppm2      1.868 CV     1
 OR {  479}
   (( segid "ATXH" and resid 47   and name HB  ))
   (( segid "ATXH" and resid 7    and name HN  ))
 ASSI {  480}
   (  segid "ATXH" and resid 22   and name HB% )
   (( segid "ATXH" and resid 25   and name HN  ))
      3.900     1.900     1.900 peak   480 spectrum    1 weight  0.10000E+01 volume  0.44673E-03 ppm1      8.210 ppm2      1.611 CV     1
 OR {  480}
   (( segid "ATXH" and resid 23   and name HB  ))
   (( segid "ATXH" and resid 25   and name HN  ))
 OR {  480}
   (( segid "ATXH" and resid 23   and name HG12))
   (( segid "ATXH" and resid 25   and name HN  ))
 ASSI {  490}
   (( segid "ATXH" and resid 27   and name HN  ))
   (( segid "ATXH" and resid 29   and name HN  ))
      3.900     1.900     1.900 peak   490 spectrum    1 weight  0.10000E+01 volume  0.42362E-03 ppm1      6.877 ppm2      8.179 CV     1
 OR {  490}
   (( segid "ATXH" and resid 25   and name HN  ))
   (( segid "ATXH" and resid 29   and name HN  ))
 ASSI {  491}
   (  segid "ATXH" and resid 36   and name HG2%)
   (( segid "ATXH" and resid 37   and name HN  ))
      4.000     2.000     2.000 peak   491 spectrum    1 weight  0.10000E+01 volume  0.42032E-03 ppm1      8.994 ppm2      0.858 CV     1
 OR {  491}
   (  segid "ATXH" and resid 47   and name HG1%)
   (( segid "ATXH" and resid 37   and name HN  ))
 OR {  491}
   (  segid "ATXH" and resid 38   and name HG2%)
   (( segid "ATXH" and resid 46   and name HN  ))
 OR {  491}
   (  segid "ATXH" and resid 27   and name HG1%)
   (( segid "ATXH" and resid 37   and name HN  ))
 ASSI {  492}
   (( segid "ATXH" and resid 9    and name HN  ))
   (( segid "ATXH" and resid 8    and name HN  ))
      4.000     2.000     2.000 peak   492 spectrum    1 weight  0.10000E+01 volume  0.42032E-03 ppm1      8.804 ppm2      9.278 CV     1
 OR {  492}
   (( segid "ATXH" and resid 7    and name HN  ))
   (( segid "ATXH" and resid 8    and name HN  ))
 ASSI {  493}
   (  segid "ATXH" and resid 38   and name HG2%)
   (( segid "ATXH" and resid 38   and name HN  ))
      3.800     1.800     1.800 peak   493 spectrum    1 weight  0.10000E+01 volume  0.41702E-03 ppm1      9.833 ppm2      0.782 CV     1
 OR {  493}
   (  segid "ATXH" and resid 45   and name HG1%)
   (( segid "ATXH" and resid 38   and name HN  ))
 ASSI {  495}
   (  segid "ATXH" and resid 30   and name HD2%)
   (( segid "ATXH" and resid 29   and name HN  ))
      3.600     1.600     1.600 peak   495 spectrum    1 weight  0.10000E+01 volume  0.41262E-03 ppm1      6.876 ppm2      0.867 CV     1
 OR {  495}
   (  segid "ATXH" and resid 27   and name HG2%)
   (( segid "ATXH" and resid 29   and name HN  ))
 OR {  495}
   (  segid "ATXH" and resid 33   and name HG1%)
   (( segid "ATXH" and resid 29   and name HN  ))
 OR {  495}
   (  segid "ATXH" and resid 27   and name HG1%)
   (( segid "ATXH" and resid 29   and name HN  ))
 ASSI {  496}
   (  segid "ATXH" and resid 62   and name HG1%)
   (( segid "ATXH" and resid 61   and name HN  ))
      4.200     2.200     1.800 peak   496 spectrum    1 weight  0.10000E+01 volume  0.41042E-03 ppm1      7.710 ppm2      1.153 CV     1
 OR {  496}
   (( segid "ATXH" and resid 59   and name HG13))
   (( segid "ATXH" and resid 61   and name HN  ))
 ASSI {  500}
   (( segid "ATXH" and resid 57   and name HN  ))
   (( segid "ATXH" and resid 59   and name HN  ))
      3.900     1.900     1.900 peak   500 spectrum    1 weight  0.10000E+01 volume  0.39942E-03 ppm1      7.366 ppm2      8.090 CV     1
 OR {  500}
   (( segid "ATXH" and resid 55   and name HN  ))
   (( segid "ATXH" and resid 59   and name HN  ))
 ASSI {  503}
   (  segid "ATXH" and resid 63   and name HD1%)
   (( segid "ATXH" and resid 27   and name HN  ))
      3.800     1.800     1.800 peak   503 spectrum    1 weight  0.10000E+01 volume  0.39611E-03 ppm1      8.175 ppm2      0.574 CV     1
 OR {  503}
   (( segid "ATXH" and resid 63   and name HG13))
   (( segid "ATXH" and resid 27   and name HN  ))
 OR {  503}
   (  segid "ATXH" and resid 23   and name HG2%)
   (( segid "ATXH" and resid 27   and name HN  ))
 ASSI {  506}
   (( segid "ATXH" and resid 24   and name HB2 ))
   (( segid "ATXH" and resid 26   and name HN  ))
      4.100     2.100     1.900 peak   506 spectrum    1 weight  0.10000E+01 volume  0.39061E-03 ppm1      7.529 ppm2      2.072 CV     1
 OR {  506}
   (( segid "ATXH" and resid 27   and name HB  ))
   (( segid "ATXH" and resid 26   and name HN  ))
 ASSI {  509}
   (  segid "ATXH" and resid 44   and name HG2%)
   (( segid "ATXH" and resid 10   and name HN  ))
      3.900     1.900     1.900 peak   509 spectrum    1 weight  0.10000E+01 volume  0.38291E-03 ppm1      9.036 ppm2      0.954 CV     1
 OR {  509}
   (  segid "ATXH" and resid 70   and name HG1%)
   (( segid "ATXH" and resid 10   and name HN  ))
 ASSI {  514}
   (( segid "ATXH" and resid 20   and name HA  ))
   (( segid "ATXH" and resid 23   and name HN  ))
      3.900     1.900     1.900 peak   514 spectrum    1 weight  0.10000E+01 volume  0.37081E-03 ppm1      8.269 ppm2      3.238 CV     1
 OR {  514}
   (( segid "ATXH" and resid 19   and name HB2 ))
   (( segid "ATXH" and resid 23   and name HN  ))
 ASSI {  515}
   (( segid "ATXH" and resid 12   and name HG2 ))
   (( segid "ATXH" and resid 13   and name HN  ))
      4.000     2.000     2.000 peak   515 spectrum    1 weight  0.10000E+01 volume  0.36860E-03 ppm1      8.569 ppm2      2.285 CV     1
 OR {  515}
   (( segid "ATXH" and resid 14   and name HB2 ))
   (( segid "ATXH" and resid 13   and name HN  ))
 ASSI {  518}
   (( segid "ATXH" and resid 37   and name HB3 ))
   (( segid "ATXH" and resid 36   and name HN  ))
      3.900     1.900     1.900 peak   518 spectrum    1 weight  0.10000E+01 volume  0.36201E-03 ppm1      8.628 ppm2      1.561 CV     1
 OR {  518}
   (( segid "ATXH" and resid 7    and name HB2 ))
   (( segid "ATXH" and resid 6    and name HN  ))
 ASSI {  519}
   (( segid "ATXH" and resid 23   and name HG12))
   (( segid "ATXH" and resid 26   and name HN  ))
      4.100     2.100     1.900 peak   519 spectrum    1 weight  0.10000E+01 volume  0.36201E-03 ppm1      7.528 ppm2      1.600 CV     1
 OR {  519}
   (( segid "ATXH" and resid 23   and name HG13))
   (( segid "ATXH" and resid 26   and name HN  ))
 OR {  519}
   (  segid "ATXH" and resid 22   and name HB% )
   (( segid "ATXH" and resid 26   and name HN  ))
 OR {  519}
   (( segid "ATXH" and resid 23   and name HB  ))
   (( segid "ATXH" and resid 26   and name HN  ))
 ASSI {  522}
   (  segid "ATXH" and resid 33   and name HG2%)
   (( segid "ATXH" and resid 36   and name HN  ))
      4.000     2.000     2.000 peak   522 spectrum    1 weight  0.10000E+01 volume  0.35540E-03 ppm1      8.667 ppm2      0.635 CV     1
 OR {  522}
   (  segid "ATXH" and resid 9    and name HD1%)
   (( segid "ATXH" and resid 36   and name HN  ))
 ASSI {  523}
   (  segid "ATXH" and resid 63   and name HG2%)
   (( segid "ATXH" and resid 23   and name HN  ))
      3.900     1.900     1.900 peak   523 spectrum    1 weight  0.10000E+01 volume  0.35320E-03 ppm1      8.268 ppm2      0.775 CV     1
 OR {  523}
   (  segid "ATXH" and resid 45   and name HG1%)
   (( segid "ATXH" and resid 23   and name HN  ))
 ASSI {  524}
   (( segid "ATXH" and resid 17   and name HA2 ))
   (( segid "ATXH" and resid 17   and name HN  ))
      3.800     1.800     1.800 peak   524 spectrum    1 weight  0.10000E+01 volume  0.35100E-03 ppm1      8.523 ppm2      4.321 CV     1
 OR {  524}
   (( segid "ATXH" and resid 16   and name HA  ))
   (( segid "ATXH" and resid 17   and name HN  ))
 ASSI {  535}
   (( segid "ATXH" and resid 11   and name HB  ))
   (( segid "ATXH" and resid 14   and name HN  ))
      4.000     2.000     2.000 peak   535 spectrum    1 weight  0.10000E+01 volume  0.32789E-03 ppm1      8.889 ppm2      1.632 CV     1
 OR {  535}
   (( segid "ATXH" and resid 23   and name HB  ))
   (( segid "ATXH" and resid 14   and name HN  ))
 ASSI {  537}
   (  segid "ATXH" and resid 14   and name HE% )
   (( segid "ATXH" and resid 39   and name HN  ))
      3.900     1.900     1.900 peak   537 spectrum    1 weight  0.10000E+01 volume  0.32019E-03 ppm1      8.894 ppm2      1.776 CV     1
 OR {  537}
   (( segid "ATXH" and resid 37   and name HB2 ))
   (( segid "ATXH" and resid 39   and name HN  ))
 ASSI {  546}
   (( segid "ATXH" and resid 53   and name HB  ))
   (( segid "ATXH" and resid 52   and name HN  ))
      4.200     2.300     1.800 peak   546 spectrum    1 weight  0.10000E+01 volume  0.31139E-03 ppm1      8.773 ppm2      1.993 CV     1
 OR {  546}
   (( segid "ATXH" and resid 5    and name HG3 ))
   (( segid "ATXH" and resid 52   and name HN  ))
 ASSI {  554}
   (( segid "ATXH" and resid 49   and name HB  ))
   (( segid "ATXH" and resid 55   and name HN  ))
      4.200     2.200     1.800 peak   554 spectrum    1 weight  0.10000E+01 volume  0.29379E-03 ppm1      8.078 ppm2      1.569 CV     1
 OR {  554}
   (( segid "ATXH" and resid 56   and name HB3 ))
   (( segid "ATXH" and resid 55   and name HN  ))
 ASSI {  556}
   (  segid "ATXH" and resid 11   and name HG1%)
   (( segid "ATXH" and resid 43   and name HN  ))
      4.100     2.100     1.900 peak   556 spectrum    1 weight  0.10000E+01 volume  0.28718E-03 ppm1      7.938 ppm2      0.626 CV     1
 OR {  556}
   (  segid "ATXH" and resid 45   and name HG2%)
   (( segid "ATXH" and resid 43   and name HN  ))
 ASSI {  558}
   (( segid "ATXH" and resid 64   and name HG2 ))
   (( segid "ATXH" and resid 63   and name HN  ))
      4.000     2.000     2.000 peak   558 spectrum    1 weight  0.10000E+01 volume  0.28498E-03 ppm1      7.634 ppm2      2.679 CV     1
 OR {  558}
   (( segid "ATXH" and resid 65   and name HB3 ))
   (( segid "ATXH" and resid 63   and name HN  ))
 ASSI {  571}
   (  segid "ATXH" and resid 44   and name HG2%)
   (( segid "ATXH" and resid 42   and name HN  ))
      3.900     1.900     1.900 peak   571 spectrum    1 weight  0.10000E+01 volume  0.25968E-03 ppm1      7.563 ppm2      0.941 CV     1
 OR {  571}
   (  segid "ATXH" and resid 38   and name HG1%)
   (( segid "ATXH" and resid 42   and name HN  ))
 OR {  571}
   (  segid "ATXH" and resid 20   and name HG2%)
   (( segid "ATXH" and resid 42   and name HN  ))
 ASSI {  573}
   (( segid "ATXH" and resid 22   and name HN  ))
   (( segid "ATXH" and resid 20   and name HN  ))
      4.100     2.100     1.900 peak   573 spectrum    1 weight  0.10000E+01 volume  0.25528E-03 ppm1      7.025 ppm2      8.562 CV     1
 OR {  573}
   (( segid "ATXH" and resid 17   and name HN  ))
   (( segid "ATXH" and resid 20   and name HN  ))
 ASSI {  574}
   (( segid "ATXH" and resid 65   and name HB3 ))
   (( segid "ATXH" and resid 62   and name HN  ))
      4.000     2.000     2.000 peak   574 spectrum    1 weight  0.10000E+01 volume  0.24757E-03 ppm1      7.190 ppm2      2.617 CV     1
 OR {  574}
   (( segid "ATXH" and resid 58   and name HB3 ))
   (( segid "ATXH" and resid 62   and name HN  ))
 ASSI {  575}
   (  segid "ATXH" and resid 9    and name HD2%)
   (( segid "ATXH" and resid 71   and name HN  ))
      4.300     2.400     1.700 peak   575 spectrum    1 weight  0.10000E+01 volume  0.24647E-03 ppm1      8.790 ppm2      0.738 CV     1
 OR {  575}
   (  segid "ATXH" and resid 11   and name HG2%)
   (( segid "ATXH" and resid 71   and name HN  ))
 OR {  575}
   (  segid "ATXH" and resid 63   and name HG2%)
   (( segid "ATXH" and resid 71   and name HN  ))
 ASSI {  577}
   (( segid "ATXH" and resid 58   and name HB2 ))
   (( segid "ATXH" and resid 57   and name HN  ))
      4.500     2.600     1.500 peak   577 spectrum    1 weight  0.10000E+01 volume  0.24427E-03 ppm1      8.105 ppm2      2.995 CV     1
 OR {  577}
   (( segid "ATXH" and resid 57   and name HE2 ))
   (( segid "ATXH" and resid 57   and name HN  ))
 ASSI {  588}
   (  segid "ATXH" and resid 44   and name HG2%)
   (( segid "ATXH" and resid 43   and name HN  ))
      3.900     1.900     1.900 peak   588 spectrum    1 weight  0.10000E+01 volume  0.22777E-03 ppm1      7.940 ppm2      0.942 CV     1
 OR {  588}
   (  segid "ATXH" and resid 38   and name HG1%)
   (( segid "ATXH" and resid 43   and name HN  ))
 ASSI {  589}
   (( segid "ATXH" and resid 13   and name HN  ))
   (( segid "ATXH" and resid 12   and name HN  ))
      4.500     2.500     1.500 peak   589 spectrum    1 weight  0.10000E+01 volume  0.22446E-03 ppm1      9.286 ppm2      8.523 CV     1
 OR {  589}
   (( segid "ATXH" and resid 11   and name HN  ))
   (( segid "ATXH" and resid 12   and name HN  ))
 ASSI {  596}
   (  segid "ATXH" and resid 36   and name HG2%)
   (( segid "ATXH" and resid 25   and name HN  ))
      4.200     2.200     1.800 peak   596 spectrum    1 weight  0.10000E+01 volume  0.20906E-03 ppm1      8.210 ppm2      0.882 CV     1
 OR {  596}
   (  segid "ATXH" and resid 27   and name HG1%)
   (( segid "ATXH" and resid 25   and name HN  ))
 OR {  596}
   (  segid "ATXH" and resid 27   and name HG2%)
   (( segid "ATXH" and resid 25   and name HN  ))
 ASSI {  601}
   (( segid "ATXH" and resid 40   and name HB3 ))
   (( segid "ATXH" and resid 20   and name HN  ))
      4.400     2.400     1.600 peak   601 spectrum    1 weight  0.10000E+01 volume  0.20136E-03 ppm1      7.015 ppm2      1.438 CV     1
 OR {  601}
   (( segid "ATXH" and resid 14   and name HB3 ))
   (( segid "ATXH" and resid 20   and name HN  ))
 ASSI {  603}
   (  segid "ATXH" and resid 22   and name HB% )
   (( segid "ATXH" and resid 66   and name HE21))
      4.200     2.200     1.800 peak   603 spectrum    1 weight  0.10000E+01 volume  0.20026E-03 ppm1      7.524 ppm2      1.589 CV     1
 OR {  603}
   (( segid "ATXH" and resid 23   and name HB  ))
   (( segid "ATXH" and resid 66   and name HE21))
 ASSI {  614}
   (( segid "ATXH" and resid 19   and name HA  ))
   (( segid "ATXH" and resid 21   and name HN  ))
      4.700     2.700     1.300 peak   614 spectrum    1 weight  0.10000E+01 volume  0.16945E-03 ppm1      7.842 ppm2      4.110 CV     1
 OR {  614}
   (( segid "ATXH" and resid 22   and name HA  ))
   (( segid "ATXH" and resid 21   and name HN  ))
 ASSI {  620}
   (  segid "ATXH" and resid 45   and name HG2%)
   (( segid "ATXH" and resid 38   and name HN  ))
      4.600     2.600     1.400 peak   620 spectrum    1 weight  0.10000E+01 volume  0.15515E-03 ppm1      9.833 ppm2      0.565 CV     1
 OR {  620}
   (  segid "ATXH" and resid 23   and name HG2%)
   (( segid "ATXH" and resid 38   and name HN  ))
 ASSI {  633}
   (( segid "ATXH" and resid 26   and name HB2 ))
   (( segid "ATXH" and resid 24   and name HN  ))
      4.500     2.600     1.500 peak   633 spectrum    1 weight  0.10000E+01 volume  0.13644E-03 ppm1      8.603 ppm2      3.912 CV     1
 OR {  633}
   (( segid "ATXH" and resid 25   and name HB2 ))
   (( segid "ATXH" and resid 24   and name HN  ))
 ASSI {  634}
   (( segid "ATXH" and resid 65   and name HB3 ))
   (( segid "ATXH" and resid 67   and name HN  ))
      4.900     3.000     1.100 peak   634 spectrum    1 weight  0.10000E+01 volume  0.13424E-03 ppm1      7.876 ppm2      2.663 CV     1
 OR {  634}
   (( segid "ATXH" and resid 64   and name HG2 ))
   (( segid "ATXH" and resid 67   and name HN  ))
 ASSI {  647}
   (( segid "ATXH" and resid 8    and name HB  ))
   (( segid "ATXH" and resid 47   and name HN  ))
      4.800     2.900     1.200 peak   647 spectrum    1 weight  0.10000E+01 volume  0.11444E-03 ppm1      9.171 ppm2      3.881 CV     1
 OR {  647}
   (( segid "ATXH" and resid 48   and name HB  ))
   (( segid "ATXH" and resid 47   and name HN  ))
 ASSI {  652}
   (( segid "ATXH" and resid 19   and name HB3 ))
   (( segid "ATXH" and resid 23   and name HN  ))
      5.000     3.100     1.000 peak   652 spectrum    1 weight  0.10000E+01 volume  0.10266E-03 ppm1      8.271 ppm2      2.771 CV     1
 OR {  652}
   (( segid "ATXH" and resid 21   and name HB3 ))
   (( segid "ATXH" and resid 23   and name HN  ))
 OR {  652}
   (( segid "ATXH" and resid 21   and name HB2 ))
   (( segid "ATXH" and resid 23   and name HN  ))
 ASSI {  654}
   (  segid "ATXH" and resid 11   and name HG1%)
   (( segid "ATXH" and resid 44   and name HN  ))
      4.500     2.600     1.500 peak   654 spectrum    1 weight  0.10000E+01 volume  0.10057E-03 ppm1      7.592 ppm2      0.625 CV     1
 OR {  654}
   (  segid "ATXH" and resid 45   and name HG2%)
   (( segid "ATXH" and resid 44   and name HN  ))
 ASSI {  655}
   (( segid "ATXH" and resid 39   and name HA  ))
   (( segid "ATXH" and resid 46   and name HN  ))
      5.100     3.200     0.900 peak   655 spectrum    1 weight  0.10000E+01 volume  0.95840E-04 ppm1      8.995 ppm2      4.753 CV     1
 OR {  655}
   (( segid "ATXH" and resid 39   and name HA  ))
   (( segid "ATXH" and resid 37   and name HN  ))
 ASSI {  658}
   (( segid "ATXH" and resid 34   and name HB3 ))
   (( segid "ATXH" and resid 33   and name HN  ))
      5.200     3.400     0.800 peak   658 spectrum    1 weight  0.10000E+01 volume  0.92207E-04 ppm1      7.529 ppm2      1.669 CV     1
 OR {  658}
   (( segid "ATXH" and resid 28   and name HD2 ))
   (( segid "ATXH" and resid 33   and name HN  ))
 ASSI {  663}
   (( segid "ATXH" and resid 22   and name HA  ))
   (( segid "ATXH" and resid 24   and name HN  ))
      5.200     3.300     0.800 peak   663 spectrum    1 weight  0.10000E+01 volume  0.73833E-04 ppm1      8.599 ppm2      4.075 CV     1
 OR {  663}
   (( segid "ATXH" and resid 25   and name HA  ))
   (( segid "ATXH" and resid 24   and name HN  ))
 ASSI {  671}
   (( segid "ATXH" and resid 64   and name HG3 ))
   (( segid "ATXH" and resid 65   and name HN  ))
      6.000     4.500     0.000 peak   671 spectrum    1 weight  0.10000E+01 volume  0.39611E-04 ppm1      8.426 ppm2      2.488 CV     1
 OR {  671}
   (( segid "ATXH" and resid 66   and name HB2 ))
   (( segid "ATXH" and resid 65   and name HN  ))
 OR {  671}
   (( segid "ATXH" and resid 66   and name HG2 ))
   (( segid "ATXH" and resid 65   and name HN  ))
 ASSI {  676}
   (( segid "ATXH" and resid 68   and name HB3 ))
   (( segid "ATXH" and resid 65   and name HN  ))
      6.000     4.600     0.000 peak   676 spectrum    1 weight  0.10000E+01 volume  0.13974E-04 ppm1      8.428 ppm2      2.307 CV     1
 OR {  676}
   (( segid "ATXH" and resid 71   and name HG2 ))
   (( segid "ATXH" and resid 65   and name HN  ))
 ASSI {    5}
   (  segid "ATXH" and resid 45   and name HG1%)
   (  segid "ATXH" and resid 45   and name HG2%)
      1.700     0.300     0.500 peak     5 spectrum    1 weight  0.10000E+01 volume  0.56615E-01 ppm1      0.593 ppm2      0.785 CV     1
 OR {    5}
   (  segid "ATXH" and resid 38   and name HG2%)
   (  segid "ATXH" and resid 45   and name HG2%)
 ASSI {    7}
   (( segid "ATXH" and resid 49   and name HG12))
   (( segid "ATXH" and resid 49   and name HA  ))
      2.000     2.000     4.000 peak     7 spectrum    1 weight  0.10000E+01 volume  0.42965E-01 ppm1      5.310 ppm2      0.828 CV     1
 OR {    7}
   (  segid "ATXH" and resid 33   and name HG1%)
   (( segid "ATXH" and resid 49   and name HA  ))
 OR {    7}
   (  segid "ATXH" and resid 47   and name HG1%)
   (( segid "ATXH" and resid 49   and name HA  ))
 ASSI {    8}
   (( segid "ATXH" and resid 6    and name HG3 ))
   (( segid "ATXH" and resid 48   and name HA  ))
      2.100     2.100     3.900 peak     8 spectrum    1 weight  0.10000E+01 volume  0.37981E-01 ppm1      5.251 ppm2      1.976 CV     1
 OR {    8}
   (( segid "ATXH" and resid 6    and name HB2 ))
   (( segid "ATXH" and resid 48   and name HA  ))
 OR {    8}
   (( segid "ATXH" and resid 5    and name HB2 ))
   (( segid "ATXH" and resid 48   and name HA  ))
 OR {    8}
   (( segid "ATXH" and resid 4    and name HB2 ))
   (( segid "ATXH" and resid 48   and name HA  ))
 ASSI {    9}
   (  segid "ATXH" and resid 33   and name HG1%)
   (  segid "ATXH" and resid 33   and name HG2%)
      1.800     0.400     0.400 peak     9 spectrum    1 weight  0.10000E+01 volume  0.37387E-01 ppm1      0.646 ppm2      0.850 CV     1
 OR {    9}
   (  segid "ATXH" and resid 47   and name HG1%)
   (  segid "ATXH" and resid 33   and name HG2%)
 OR {    9}
   (  segid "ATXH" and resid 27   and name HG1%)
   (  segid "ATXH" and resid 33   and name HG2%)
 ASSI {   11}
   (  segid "ATXH" and resid 40   and name HD1%)
   (( segid "ATXH" and resid 40   and name HA  ))
      1.800     0.400     0.400 peak    11 spectrum    1 weight  0.10000E+01 volume  0.33352E-01 ppm1      3.785 ppm2      0.822 CV     1
 OR {   11}
   (  segid "ATXH" and resid 40   and name HD2%)
   (( segid "ATXH" and resid 40   and name HA  ))
 OR {   11}
   (  segid "ATXH" and resid 33   and name HG1%)
   (( segid "ATXH" and resid 28   and name HA  ))
 ASSI {   12}
   (( segid "ATXH" and resid 46   and name HB3 ))
   (( segid "ATXH" and resid 46   and name HG2 ))
      1.800     0.400     0.400 peak    12 spectrum    1 weight  0.10000E+01 volume  0.32758E-01 ppm1      2.196 ppm2      1.904 CV     1
 OR {   12}
   (( segid "ATXH" and resid 34   and name HB2 ))
   (( segid "ATXH" and resid 34   and name HG2 ))
 OR {   12}
   (  segid "ATXH" and resid 4    and name HE% )
   (( segid "ATXH" and resid 34   and name HG2 ))
 ASSI {   13}
   (( segid "ATXH" and resid 6    and name HG3 ))
   (( segid "ATXH" and resid 6    and name HA  ))
      1.900     0.500     0.500 peak    13 spectrum    1 weight  0.10000E+01 volume  0.31809E-01 ppm1      5.199 ppm2      1.975 CV     1
 OR {   13}
   (( segid "ATXH" and resid 6    and name HB2 ))
   (( segid "ATXH" and resid 6    and name HA  ))
 OR {   13}
   (( segid "ATXH" and resid 4    and name HB2 ))
   (( segid "ATXH" and resid 4    and name HA  ))
 ASSI {   14}
   (  segid "ATXH" and resid 59   and name HG2%)
   (  segid "ATXH" and resid 63   and name HD1%)
      1.800     0.400     0.400 peak    14 spectrum    1 weight  0.10000E+01 volume  0.26824E-01 ppm1      0.563 ppm2      0.762 CV     1
 OR {   14}
   (  segid "ATXH" and resid 63   and name HG2%)
   (  segid "ATXH" and resid 63   and name HD1%)
 ASSI {   18}
   (  segid "ATXH" and resid 62   and name HG2%)
   (  segid "ATXH" and resid 62   and name HG1%)
      2.000     0.500     0.500 peak    18 spectrum    1 weight  0.10000E+01 volume  0.23145E-01 ppm1      1.150 ppm2      0.886 CV     1
 OR {   18}
   (  segid "ATXH" and resid 30   and name HD2%)
   (  segid "ATXH" and resid 62   and name HG1%)
 ASSI {   19}
   (  segid "ATXH" and resid 48   and name HG2%)
   (( segid "ATXH" and resid 48   and name HB  ))
      2.000     0.500     0.500 peak    19 spectrum    1 weight  0.10000E+01 volume  0.21483E-01 ppm1      3.868 ppm2      1.087 CV     1
 OR {   19}
   (  segid "ATXH" and resid 8    and name HG2%)
   (( segid "ATXH" and resid 8    and name HB  ))
 ASSI {   28}
   (( segid "ATXH" and resid 60   and name HB  ))
   (  segid "ATXH" and resid 60   and name HG2%)
      2.000     0.500     0.500 peak    28 spectrum    1 weight  0.10000E+01 volume  0.18634E-01 ppm1      0.823 ppm2      1.997 CV     1
 OR {   28}
   (( segid "ATXH" and resid 53   and name HB  ))
   (  segid "ATXH" and resid 53   and name HG1%)
 OR {   28}
   (( segid "ATXH" and resid 53   and name HB  ))
   (  segid "ATXH" and resid 53   and name HG2%)
 ASSI {   33}
   (  segid "ATXH" and resid 27   and name HG2%)
   (( segid "ATXH" and resid 27   and name HB  ))
      2.000     0.500     0.500 peak    33 spectrum    1 weight  0.10000E+01 volume  0.17447E-01 ppm1      2.025 ppm2      0.856 CV     1
 OR {   33}
   (  segid "ATXH" and resid 60   and name HG2%)
   (( segid "ATXH" and resid 60   and name HB  ))
 OR {   33}
   (  segid "ATXH" and resid 38   and name HG2%)
   (( segid "ATXH" and resid 38   and name HB  ))
 OR {   33}
   (  segid "ATXH" and resid 27   and name HG1%)
   (( segid "ATXH" and resid 27   and name HB  ))
 ASSI {   39}
   (( segid "ATXH" and resid 10   and name HB2 ))
   (( segid "ATXH" and resid 10   and name HG3 ))
      2.100     0.500     0.500 peak    39 spectrum    1 weight  0.10000E+01 volume  0.15667E-01 ppm1      2.304 ppm2      2.078 CV     1
 OR {   39}
   (( segid "ATXH" and resid 14   and name HG2 ))
   (( segid "ATXH" and resid 14   and name HB2 ))
 OR {   39}
   (( segid "ATXH" and resid 14   and name HG3 ))
   (( segid "ATXH" and resid 14   and name HB2 ))
 OR {   39}
   (( segid "ATXH" and resid 10   and name HB2 ))
   (( segid "ATXH" and resid 10   and name HG2 ))
 ASSI {   40}
   (( segid "ATXH" and resid 35   and name HB3 ))
   (( segid "ATXH" and resid 35   and name HA  ))
      2.100     0.600     0.600 peak    40 spectrum    1 weight  0.10000E+01 volume  0.15667E-01 ppm1      4.627 ppm2      1.967 CV     1
 OR {   40}
   (( segid "ATXH" and resid 5    and name HB2 ))
   (( segid "ATXH" and resid 5    and name HA  ))
 OR {   40}
   (( segid "ATXH" and resid 12   and name HB3 ))
   (( segid "ATXH" and resid 12   and name HA  ))
 OR {   40}
   (( segid "ATXH" and resid 5    and name HG3 ))
   (( segid "ATXH" and resid 5    and name HA  ))
 ASSI {   47}
   (( segid "ATXH" and resid 35   and name HG3 ))
   (( segid "ATXH" and resid 35   and name HG2 ))
      1.900     0.500     0.500 peak    47 spectrum    1 weight  0.10000E+01 volume  0.14717E-01 ppm1      2.264 ppm2      1.959 CV     1
 OR {   47}
   (( segid "ATXH" and resid 10   and name HB3 ))
   (( segid "ATXH" and resid 10   and name HG2 ))
 OR {   47}
   (( segid "ATXH" and resid 35   and name HB3 ))
   (( segid "ATXH" and resid 35   and name HG2 ))
 ASSI {   48}
   (  segid "ATXH" and resid 54   and name HG2%)
   (  segid "ATXH" and resid 54   and name HG1%)
      2.100     0.500     0.500 peak    48 spectrum    1 weight  0.10000E+01 volume  0.14480E-01 ppm1      1.160 ppm2      0.722 CV     1
 OR {   48}
   (  segid "ATXH" and resid 59   and name HD1%)
   (  segid "ATXH" and resid 54   and name HG1%)
 ASSI {   50}
   (  segid "ATXH" and resid 20   and name HG2%)
   (( segid "ATXH" and resid 20   and name HB  ))
      2.100     0.500     0.500 peak    50 spectrum    1 weight  0.10000E+01 volume  0.14243E-01 ppm1      2.084 ppm2      0.929 CV     1
 OR {   50}
   (  segid "ATXH" and resid 70   and name HG2%)
   (( segid "ATXH" and resid 70   and name HB  ))
 OR {   50}
   (  segid "ATXH" and resid 70   and name HG1%)
   (( segid "ATXH" and resid 70   and name HB  ))
 ASSI {   54}
   (( segid "ATXH" and resid 34   and name HB2 ))
   (( segid "ATXH" and resid 34   and name HG3 ))
      2.400     0.700     0.700 peak    54 spectrum    1 weight  0.10000E+01 volume  0.13768E-01 ppm1      2.092 ppm2      1.901 CV     1
 OR {   54}
   (( segid "ATXH" and resid 46   and name HB3 ))
   (( segid "ATXH" and resid 46   and name HG3 ))
 OR {   54}
   (  segid "ATXH" and resid 4    and name HE% )
   (( segid "ATXH" and resid 34   and name HG3 ))
 ASSI {   75}
   (( segid "ATXH" and resid 10   and name HA  ))
   (  segid "ATXH" and resid 9    and name HD2%)
      2.500     2.500     3.500 peak    75 spectrum    1 weight  0.10000E+01 volume  0.11988E-01 ppm1      0.704 ppm2      4.761 CV     1
 OR {   75}
   (( segid "ATXH" and resid 11   and name HA  ))
   (  segid "ATXH" and resid 9    and name HD2%)
 ASSI {   77}
   (  segid "ATXH" and resid 49   and name HG2%)
   (( segid "ATXH" and resid 33   and name HB  ))
      2.000     2.000     4.000 peak    77 spectrum    1 weight  0.10000E+01 volume  0.11988E-01 ppm1      2.262 ppm2      0.729 CV     1
 OR {   77}
   (  segid "ATXH" and resid 59   and name HD1%)
   (( segid "ATXH" and resid 33   and name HB  ))
 OR {   77}
   (  segid "ATXH" and resid 36   and name HG1%)
   (( segid "ATXH" and resid 33   and name HB  ))
 ASSI {   88}
   (  segid "ATXH" and resid 11   and name HG1%)
   (( segid "ATXH" and resid 11   and name HB  ))
      2.200     0.600     0.600 peak    88 spectrum    1 weight  0.10000E+01 volume  0.10777E-01 ppm1      1.724 ppm2      0.597 CV     1
 OR {   88}
   (  segid "ATXH" and resid 45   and name HG2%)
   (( segid "ATXH" and resid 45   and name HB  ))
 OR {   88}
   (( segid "ATXH" and resid 9    and name HG  ))
   (( segid "ATXH" and resid 45   and name HB  ))
 ASSI {   90}
   (  segid "ATXH" and resid 70   and name HG1%)
   (  segid "ATXH" and resid 9    and name HD2%)
      2.300     0.600     0.600 peak    90 spectrum    1 weight  0.10000E+01 volume  0.10741E-01 ppm1      0.704 ppm2      0.956 CV     1
 OR {   90}
   (  segid "ATXH" and resid 60   and name HG1%)
   (  segid "ATXH" and resid 9    and name HD2%)
 OR {   90}
   (  segid "ATXH" and resid 70   and name HG2%)
   (  segid "ATXH" and resid 9    and name HD2%)
 OR {   90}
   (  segid "ATXH" and resid 27   and name HG1%)
   (  segid "ATXH" and resid 9    and name HD2%)
 OR {   90}
   (( segid "ATXH" and resid 63   and name HG12))
   (  segid "ATXH" and resid 9    and name HD2%)
 ASSI {  103}
   (( segid "ATXH" and resid 38   and name HB  ))
   (  segid "ATXH" and resid 38   and name HG1%)
      2.200     0.600     0.600 peak   103 spectrum    1 weight  0.10000E+01 volume  0.10302E-01 ppm1      0.990 ppm2      2.089 CV     1
 OR {  103}
   (( segid "ATXH" and resid 70   and name HB  ))
   (  segid "ATXH" and resid 70   and name HG1%)
 ASSI {  109}
   (( segid "ATXH" and resid 35   and name HG3 ))
   (( segid "ATXH" and resid 48   and name HB  ))
      2.500     0.800     0.800 peak   109 spectrum    1 weight  0.10000E+01 volume  0.98750E-02 ppm1      3.879 ppm2      1.937 CV     1
 OR {  109}
   (  segid "ATXH" and resid 4    and name HE% )
   (( segid "ATXH" and resid 48   and name HB  ))
 OR {  109}
   (( segid "ATXH" and resid 35   and name HB3 ))
   (( segid "ATXH" and resid 48   and name HB  ))
 OR {  109}
   (( segid "ATXH" and resid 6    and name HG3 ))
   (( segid "ATXH" and resid 48   and name HB  ))
 OR {  109}
   (( segid "ATXH" and resid 4    and name HB2 ))
   (( segid "ATXH" and resid 48   and name HB  ))
 ASSI {  112}
   (  segid "ATXH" and resid 4    and name HE% )
   (  segid "ATXH" and resid 48   and name HG2%)
      2.400     0.700     0.700 peak   112 spectrum    1 weight  0.10000E+01 volume  0.95543E-02 ppm1      1.103 ppm2      1.917 CV     1
 OR {  112}
   (( segid "ATXH" and resid 4    and name HB2 ))
   (  segid "ATXH" and resid 48   and name HG2%)
 OR {  112}
   (( segid "ATXH" and resid 34   and name HB2 ))
   (  segid "ATXH" and resid 48   and name HG2%)
 ASSI {  113}
   (  segid "ATXH" and resid 49   and name HD1%)
   (( segid "ATXH" and resid 7    and name HA  ))
      2.000     2.000     4.000 peak   113 spectrum    1 weight  0.10000E+01 volume  0.95191E-02 ppm1      4.811 ppm2      0.712 CV     1
 OR {  113}
   (  segid "ATXH" and resid 9    and name HD2%)
   (( segid "ATXH" and resid 7    and name HA  ))
 OR {  113}
   (  segid "ATXH" and resid 49   and name HG2%)
   (( segid "ATXH" and resid 7    and name HA  ))
 ASSI {  114}
   (  segid "ATXH" and resid 11   and name HG2%)
   (( segid "ATXH" and resid 11   and name HB  ))
      2.200     0.600     0.600 peak   114 spectrum    1 weight  0.10000E+01 volume  0.95191E-02 ppm1      1.723 ppm2      0.751 CV     1
 OR {  114}
   (  segid "ATXH" and resid 45   and name HG1%)
   (( segid "ATXH" and resid 45   and name HB  ))
 ASSI {  132}
   (  segid "ATXH" and resid 54   and name HG1%)
   (( segid "ATXH" and resid 54   and name HA  ))
      2.600     0.900     0.900 peak   132 spectrum    1 weight  0.10000E+01 volume  0.84624E-02 ppm1      4.643 ppm2      1.164 CV     1
 OR {  132}
   (  segid "ATXH" and resid 55   and name HG2%)
   (( segid "ATXH" and resid 54   and name HA  ))
 ASSI {  138}
   (  segid "ATXH" and resid 62   and name HG1%)
   (  segid "ATXH" and resid 30   and name HD1%)
      2.600     0.900     0.900 peak   138 spectrum    1 weight  0.10000E+01 volume  0.80356E-02 ppm1      0.878 ppm2      1.153 CV     1
 OR {  138}
   (( segid "ATXH" and resid 59   and name HG13))
   (  segid "ATXH" and resid 30   and name HD1%)
 ASSI {  141}
   (( segid "ATXH" and resid 48   and name HA  ))
   (  segid "ATXH" and resid 48   and name HG2%)
      2.300     0.700     0.700 peak   141 spectrum    1 weight  0.10000E+01 volume  0.79519E-02 ppm1      1.102 ppm2      5.224 CV     1
 OR {  141}
   (( segid "ATXH" and resid 6    and name HA  ))
   (  segid "ATXH" and resid 48   and name HG2%)
 ASSI {  144}
   (  segid "ATXH" and resid 38   and name HG1%)
   (( segid "ATXH" and resid 38   and name HB  ))
      2.300     0.700     0.700 peak   144 spectrum    1 weight  0.10000E+01 volume  0.77857E-02 ppm1      2.013 ppm2      0.965 CV     1
 OR {  144}
   (  segid "ATXH" and resid 60   and name HG1%)
   (( segid "ATXH" and resid 60   and name HB  ))
 ASSI {  158}
   (  segid "ATXH" and resid 63   and name HD1%)
   (  segid "ATXH" and resid 70   and name HG2%)
      2.400     0.700     0.700 peak   158 spectrum    1 weight  0.10000E+01 volume  0.71807E-02 ppm1      0.923 ppm2      0.584 CV     1
 OR {  158}
   (  segid "ATXH" and resid 9    and name HD1%)
   (  segid "ATXH" and resid 70   and name HG2%)
 OR {  158}
   (( segid "ATXH" and resid 63   and name HG13))
   (  segid "ATXH" and resid 70   and name HG2%)
 ASSI {  162}
   (( segid "ATXH" and resid 6    and name HB3 ))
   (( segid "ATXH" and resid 6    and name HA  ))
      2.400     0.700     0.700 peak   162 spectrum    1 weight  0.10000E+01 volume  0.70977E-02 ppm1      5.181 ppm2      1.874 CV     1
 OR {  162}
   (  segid "ATXH" and resid 4    and name HE% )
   (( segid "ATXH" and resid 4    and name HA  ))
 ASSI {  163}
   (  segid "ATXH" and resid 47   and name HG2%)
   (( segid "ATXH" and resid 36   and name HA  ))
      2.300     0.700     0.700 peak   163 spectrum    1 weight  0.10000E+01 volume  0.70740E-02 ppm1      4.944 ppm2      0.806 CV     1
 OR {  163}
   (  segid "ATXH" and resid 36   and name HG1%)
   (( segid "ATXH" and resid 36   and name HA  ))
 OR {  163}
   (  segid "ATXH" and resid 36   and name HG2%)
   (( segid "ATXH" and resid 36   and name HA  ))
 ASSI {  164}
   (  segid "ATXH" and resid 49   and name HD1%)
   (( segid "ATXH" and resid 51   and name HA  ))
      2.500     0.800     0.800 peak   164 spectrum    1 weight  0.10000E+01 volume  0.70382E-02 ppm1      4.941 ppm2      0.709 CV     1
 OR {  164}
   (  segid "ATXH" and resid 45   and name HG1%)
   (( segid "ATXH" and resid 36   and name HA  ))
 ASSI {  171}
   (( segid "ATXH" and resid 36   and name HB  ))
   (  segid "ATXH" and resid 36   and name HG1%)
      2.300     0.700     0.700 peak   171 spectrum    1 weight  0.10000E+01 volume  0.68249E-02 ppm1      0.781 ppm2      1.882 CV     1
 OR {  171}
   (( segid "ATXH" and resid 28   and name HB2 ))
   (  segid "ATXH" and resid 36   and name HG1%)
 ASSI {  182}
   (( segid "ATXH" and resid 12   and name HB2 ))
   (( segid "ATXH" and resid 12   and name HA  ))
      2.500     0.800     0.800 peak   182 spectrum    1 weight  0.10000E+01 volume  0.66348E-02 ppm1      4.629 ppm2      2.176 CV     1
 OR {  182}
   (( segid "ATXH" and resid 5    and name HG2 ))
   (( segid "ATXH" and resid 5    and name HA  ))
 ASSI {  184}
   (  segid "ATXH" and resid 63   and name HD1%)
   (  segid "ATXH" and resid 27   and name HG1%)
      2.200     2.200     3.800 peak   184 spectrum    1 weight  0.10000E+01 volume  0.65279E-02 ppm1      0.923 ppm2      0.564 CV     1
 OR {  184}
   (( segid "ATXH" and resid 63   and name HG13))
   (  segid "ATXH" and resid 27   and name HG1%)
 OR {  184}
   (  segid "ATXH" and resid 45   and name HG2%)
   (  segid "ATXH" and resid 27   and name HG1%)
 ASSI {  196}
   (( segid "ATXH" and resid 35   and name HB2 ))
   (( segid "ATXH" and resid 35   and name HA  ))
      2.500     0.800     0.800 peak   196 spectrum    1 weight  0.10000E+01 volume  0.62430E-02 ppm1      4.628 ppm2      2.256 CV     1
 OR {  196}
   (( segid "ATXH" and resid 35   and name HG2 ))
   (( segid "ATXH" and resid 35   and name HA  ))
 OR {  196}
   (( segid "ATXH" and resid 12   and name HG2 ))
   (( segid "ATXH" and resid 12   and name HA  ))
 ASSI {  209}
   (  segid "ATXH" and resid 38   and name HG1%)
   (  segid "ATXH" and resid 23   and name HG2%)
      2.500     0.800     0.800 peak   209 spectrum    1 weight  0.10000E+01 volume  0.58751E-02 ppm1      0.564 ppm2      0.909 CV     1
 OR {  209}
   (  segid "ATXH" and resid 20   and name HG2%)
   (  segid "ATXH" and resid 23   and name HG2%)
 ASSI {  210}
   (  segid "ATXH" and resid 54   and name HG1%)
   (  segid "ATXH" and resid 33   and name HG1%)
      2.400     0.700     0.700 peak   210 spectrum    1 weight  0.10000E+01 volume  0.58633E-02 ppm1      0.834 ppm2      1.156 CV     1
 OR {  210}
   (  segid "ATXH" and resid 48   and name HG2%)
   (  segid "ATXH" and resid 33   and name HG1%)
 ASSI {  212}
   (( segid "ATXH" and resid 34   and name HB3 ))
   (  segid "ATXH" and resid 33   and name HG2%)
      2.800     1.000     1.000 peak   212 spectrum    1 weight  0.10000E+01 volume  0.58395E-02 ppm1      0.661 ppm2      1.640 CV     1
 OR {  212}
   (( segid "ATXH" and resid 28   and name HD2 ))
   (  segid "ATXH" and resid 33   and name HG2%)
 OR {  212}
   (( segid "ATXH" and resid 23   and name HB  ))
   (  segid "ATXH" and resid 11   and name HG1%)
 OR {  212}
   (( segid "ATXH" and resid 23   and name HG12))
   (  segid "ATXH" and resid 11   and name HG1%)
 OR {  212}
   (( segid "ATXH" and resid 23   and name HG13))
   (  segid "ATXH" and resid 11   and name HG1%)
 ASSI {  221}
   (( segid "ATXH" and resid 56   and name HB3 ))
   (  segid "ATXH" and resid 56   and name HD1%)
      2.600     0.800     0.800 peak   221 spectrum    1 weight  0.10000E+01 volume  0.55903E-02 ppm1      0.875 ppm2      1.574 CV     1
 OR {  221}
   (( segid "ATXH" and resid 49   and name HB  ))
   (( segid "ATXH" and resid 49   and name HG12))
 ASSI {  222}
   (  segid "ATXH" and resid 48   and name HG2%)
   (( segid "ATXH" and resid 6    and name HA  ))
      2.600     0.900     0.900 peak   222 spectrum    1 weight  0.10000E+01 volume  0.55547E-02 ppm1      5.187 ppm2      1.104 CV     1
 OR {  222}
   (  segid "ATXH" and resid 48   and name HG2%)
   (( segid "ATXH" and resid 4    and name HA  ))
 ASSI {  230}
   (( segid "ATXH" and resid 35   and name HA  ))
   (( segid "ATXH" and resid 35   and name HB3 ))
      2.400     0.700     0.700 peak   230 spectrum    1 weight  0.10000E+01 volume  0.54004E-02 ppm1      1.957 ppm2      4.623 CV     1
 OR {  230}
   (( segid "ATXH" and resid 12   and name HA  ))
   (( segid "ATXH" and resid 12   and name HB3 ))
 ASSI {  237}
   (( segid "ATXH" and resid 35   and name HA  ))
   (  segid "ATXH" and resid 36   and name HG1%)
      2.700     0.900     0.900 peak   237 spectrum    1 weight  0.10000E+01 volume  0.53173E-02 ppm1      0.752 ppm2      4.657 CV     1
 OR {  237}
   (( segid "ATXH" and resid 37   and name HA  ))
   (  segid "ATXH" and resid 36   and name HG1%)
 ASSI {  242}
   (  segid "ATXH" and resid 59   and name HG2%)
   (( segid "ATXH" and resid 56   and name HA  ))
      2.700     0.900     0.900 peak   242 spectrum    1 weight  0.10000E+01 volume  0.51512E-02 ppm1      3.863 ppm2      0.770 CV     1
 OR {  242}
   (  segid "ATXH" and resid 49   and name HG2%)
   (( segid "ATXH" and resid 56   and name HA  ))
 OR {  242}
   (  segid "ATXH" and resid 54   and name HG2%)
   (( segid "ATXH" and resid 56   and name HA  ))
 OR {  242}
   (  segid "ATXH" and resid 60   and name HG2%)
   (( segid "ATXH" and resid 56   and name HA  ))
 ASSI {  245}
   (( segid "ATXH" and resid 5    and name HB3 ))
   (( segid "ATXH" and resid 5    and name HA  ))
      2.500     0.800     0.800 peak   245 spectrum    1 weight  0.10000E+01 volume  0.50918E-02 ppm1      4.627 ppm2      1.832 CV     1
 OR {  245}
   (( segid "ATXH" and resid 6    and name HB3 ))
   (( segid "ATXH" and resid 5    and name HA  ))
 ASSI {  250}
   (( segid "ATXH" and resid 9    and name HB2 ))
   (( segid "ATXH" and resid 9    and name HA  ))
      2.600     0.900     0.900 peak   250 spectrum    1 weight  0.10000E+01 volume  0.50324E-02 ppm1      4.848 ppm2      1.575 CV     1
 OR {  250}
   (( segid "ATXH" and resid 7    and name HB2 ))
   (( segid "ATXH" and resid 7    and name HA  ))
 ASSI {  252}
   (  segid "ATXH" and resid 14   and name HE% )
   (  segid "ATXH" and resid 23   and name HG2%)
      2.600     0.800     0.800 peak   252 spectrum    1 weight  0.10000E+01 volume  0.50087E-02 ppm1      0.599 ppm2      1.803 CV     1
 OR {  252}
   (( segid "ATXH" and resid 11   and name HB  ))
   (  segid "ATXH" and resid 23   and name HG2%)
 ASSI {  257}
   (  segid "ATXH" and resid 23   and name HG2%)
   (  segid "ATXH" and resid 23   and name HD1%)
      2.400     0.700     0.700 peak   257 spectrum    1 weight  0.10000E+01 volume  0.48544E-02 ppm1      0.146 ppm2      0.568 CV     1
 OR {  257}
   (  segid "ATXH" and resid 45   and name HG2%)
   (  segid "ATXH" and resid 23   and name HD1%)
 ASSI {  272}
   (( segid "ATXH" and resid 28   and name HG2 ))
   (( segid "ATXH" and resid 28   and name HE2 ))
      2.700     0.900     0.900 peak   272 spectrum    1 weight  0.10000E+01 volume  0.46526E-02 ppm1      2.949 ppm2      1.439 CV     1
 OR {  272}
   (( segid "ATXH" and resid 57   and name HG3 ))
   (( segid "ATXH" and resid 57   and name HE3 ))
 OR {  272}
   (( segid "ATXH" and resid 57   and name HG2 ))
   (( segid "ATXH" and resid 57   and name HE3 ))
 OR {  272}
   (( segid "ATXH" and resid 57   and name HG2 ))
   (( segid "ATXH" and resid 57   and name HE2 ))
 OR {  272}
   (( segid "ATXH" and resid 57   and name HG3 ))
   (( segid "ATXH" and resid 57   and name HE2 ))
 ASSI {  277}
   (  segid "ATXH" and resid 30   and name HD1%)
   (( segid "ATXH" and resid 59   and name HA  ))
      2.800     1.000     1.000 peak   277 spectrum    1 weight  0.10000E+01 volume  0.46051E-02 ppm1      3.498 ppm2      0.877 CV     1
 OR {  277}
   (  segid "ATXH" and resid 62   and name HG2%)
   (( segid "ATXH" and resid 59   and name HA  ))
 OR {  277}
   (  segid "ATXH" and resid 27   and name HG1%)
   (( segid "ATXH" and resid 59   and name HA  ))
 OR {  277}
   (  segid "ATXH" and resid 27   and name HG2%)
   (( segid "ATXH" and resid 59   and name HA  ))
 OR {  277}
   (  segid "ATXH" and resid 30   and name HD2%)
   (( segid "ATXH" and resid 59   and name HA  ))
 ASSI {  292}
   (  segid "ATXH" and resid 70   and name HG2%)
   (( segid "ATXH" and resid 64   and name HG3 ))
      2.600     0.800     0.800 peak   292 spectrum    1 weight  0.10000E+01 volume  0.44390E-02 ppm1      2.414 ppm2      0.914 CV     1
 OR {  292}
   (  segid "ATXH" and resid 60   and name HG1%)
   (( segid "ATXH" and resid 64   and name HG3 ))
 ASSI {  296}
   (  segid "ATXH" and resid 33   and name HG2%)
   (( segid "ATXH" and resid 27   and name HB  ))
      2.800     1.000     1.000 peak   296 spectrum    1 weight  0.10000E+01 volume  0.43678E-02 ppm1      2.027 ppm2      0.650 CV     1
 OR {  296}
   (  segid "ATXH" and resid 9    and name HD2%)
   (( segid "ATXH" and resid 27   and name HB  ))
 OR {  296}
   (  segid "ATXH" and resid 9    and name HD1%)
   (( segid "ATXH" and resid 27   and name HB  ))
 ASSI {  306}
   (  segid "ATXH" and resid 45   and name HG1%)
   (  segid "ATXH" and resid 23   and name HD1%)
      2.600     0.800     0.800 peak   306 spectrum    1 weight  0.10000E+01 volume  0.42016E-02 ppm1      0.153 ppm2      0.788 CV     1
 OR {  306}
   (  segid "ATXH" and resid 63   and name HG2%)
   (  segid "ATXH" and resid 23   and name HD1%)
 OR {  306}
   (  segid "ATXH" and resid 38   and name HG2%)
   (  segid "ATXH" and resid 23   and name HD1%)
 ASSI {  307}
   (( segid "ATXH" and resid 60   and name HA  ))
   (  segid "ATXH" and resid 70   and name HG1%)
      2.800     1.000     1.000 peak   307 spectrum    1 weight  0.10000E+01 volume  0.42016E-02 ppm1      0.988 ppm2      3.239 CV     1
 OR {  307}
   (( segid "ATXH" and resid 19   and name HB2 ))
   (  segid "ATXH" and resid 38   and name HG1%)
 ASSI {  308}
   (( segid "ATXH" and resid 14   and name HB3 ))
   (  segid "ATXH" and resid 14   and name HE% )
      2.900     1.100     1.100 peak   308 spectrum    1 weight  0.10000E+01 volume  0.41897E-02 ppm1      1.778 ppm2      1.420 CV     1
 OR {  308}
   (( segid "ATXH" and resid 40   and name HB3 ))
   (  segid "ATXH" and resid 14   and name HE% )
 ASSI {  310}
   (( segid "ATXH" and resid 6    and name HG2 ))
   (  segid "ATXH" and resid 48   and name HG2%)
      2.700     0.900     0.900 peak   310 spectrum    1 weight  0.10000E+01 volume  0.41897E-02 ppm1      1.099 ppm2      2.200 CV     1
 OR {  310}
   (( segid "ATXH" and resid 34   and name HG2 ))
   (  segid "ATXH" and resid 48   and name HG2%)
 OR {  310}
   (( segid "ATXH" and resid 46   and name HG2 ))
   (  segid "ATXH" and resid 8    and name HG2%)
 ASSI {  318}
   (( segid "ATXH" and resid 48   and name HB  ))
   (( segid "ATXH" and resid 35   and name HB3 ))
      3.100     1.200     1.200 peak   318 spectrum    1 weight  0.10000E+01 volume  0.40354E-02 ppm1      1.953 ppm2      3.874 CV     1
 OR {  318}
   (( segid "ATXH" and resid 48   and name HB  ))
   (( segid "ATXH" and resid 4    and name HB2 ))
 ASSI {  319}
   (( segid "ATXH" and resid 47   and name HB  ))
   (( segid "ATXH" and resid 47   and name HA  ))
      2.700     0.900     0.900 peak   319 spectrum    1 weight  0.10000E+01 volume  0.40354E-02 ppm1      5.065 ppm2      1.891 CV     1
 OR {  319}
   (( segid "ATXH" and resid 36   and name HB  ))
   (( segid "ATXH" and resid 47   and name HA  ))
 ASSI {  331}
   (( segid "ATXH" and resid 49   and name HG12))
   (( segid "ATXH" and resid 5    and name HB2 ))
      2.800     1.000     1.000 peak   331 spectrum    1 weight  0.10000E+01 volume  0.38811E-02 ppm1      1.988 ppm2      0.864 CV     1
 OR {  331}
   (  segid "ATXH" and resid 33   and name HG1%)
   (( segid "ATXH" and resid 35   and name HG3 ))
 ASSI {  334}
   (( segid "ATXH" and resid 10   and name HA  ))
   (  segid "ATXH" and resid 70   and name HG2%)
      3.000     1.100     1.100 peak   334 spectrum    1 weight  0.10000E+01 volume  0.38100E-02 ppm1      0.937 ppm2      4.648 CV     1
 OR {  334}
   (( segid "ATXH" and resid 68   and name HA  ))
   (  segid "ATXH" and resid 70   and name HG2%)
 ASSI {  336}
   (  segid "ATXH" and resid 60   and name HG2%)
   (( segid "ATXH" and resid 57   and name HD3 ))
      2.900     1.100     1.100 peak   336 spectrum    1 weight  0.10000E+01 volume  0.38100E-02 ppm1      1.570 ppm2      0.863 CV     1
 OR {  336}
   (  segid "ATXH" and resid 56   and name HD1%)
   (( segid "ATXH" and resid 57   and name HD3 ))
 ASSI {  342}
   (  segid "ATXH" and resid 48   and name HG2%)
   (( segid "ATXH" and resid 34   and name HB2 ))
      3.000     1.100     1.100 peak   342 spectrum    1 weight  0.10000E+01 volume  0.36794E-02 ppm1      1.890 ppm2      1.100 CV     1
 OR {  342}
   (  segid "ATXH" and resid 8    and name HG2%)
   (( segid "ATXH" and resid 46   and name HB3 ))
 ASSI {  347}
   (  segid "ATXH" and resid 54   and name HG1%)
   (( segid "ATXH" and resid 58   and name HB2 ))
      3.100     1.200     1.200 peak   347 spectrum    1 weight  0.10000E+01 volume  0.36319E-02 ppm1      3.017 ppm2      1.161 CV     1
 OR {  347}
   (( segid "ATXH" and resid 59   and name HG13))
   (( segid "ATXH" and resid 58   and name HB2 ))
 OR {  347}
   (  segid "ATXH" and resid 55   and name HG2%)
   (( segid "ATXH" and resid 58   and name HB2 ))
 ASSI {  350}
   (( segid "ATXH" and resid 68   and name HB3 ))
   (  segid "ATXH" and resid 70   and name HG1%)
      2.700     0.900     0.900 peak   350 spectrum    1 weight  0.10000E+01 volume  0.35963E-02 ppm1      0.985 ppm2      2.254 CV     1
 OR {  350}
   (( segid "ATXH" and resid 10   and name HG3 ))
   (  segid "ATXH" and resid 70   and name HG1%)
 OR {  350}
   (( segid "ATXH" and resid 10   and name HG2 ))
   (  segid "ATXH" and resid 70   and name HG1%)
 ASSI {  351}
   (( segid "ATXH" and resid 7    and name HB2 ))
   (  segid "ATXH" and resid 7    and name HD2%)
      2.700     0.900     0.900 peak   351 spectrum    1 weight  0.10000E+01 volume  0.35725E-02 ppm1      0.865 ppm2      1.572 CV     1
 OR {  351}
   (( segid "ATXH" and resid 23   and name HG13))
   (  segid "ATXH" and resid 27   and name HG2%)
 OR {  351}
   (( segid "ATXH" and resid 23   and name HG12))
   (  segid "ATXH" and resid 27   and name HG2%)
 ASSI {  354}
   (( segid "ATXH" and resid 40   and name HB3 ))
   (  segid "ATXH" and resid 38   and name HG1%)
      2.500     2.500     3.500 peak   354 spectrum    1 weight  0.10000E+01 volume  0.35251E-02 ppm1      0.983 ppm2      1.408 CV     1
 OR {  354}
   (( segid "ATXH" and resid 14   and name HB3 ))
   (  segid "ATXH" and resid 38   and name HG1%)
 OR {  354}
   (( segid "ATXH" and resid 7    and name HB3 ))
   (  segid "ATXH" and resid 70   and name HG1%)
 ASSI {  363}
   (( segid "ATXH" and resid 49   and name HG12))
   (( segid "ATXH" and resid 5    and name HG2 ))
      3.000     1.100     1.100 peak   363 spectrum    1 weight  0.10000E+01 volume  0.33945E-02 ppm1      2.191 ppm2      0.864 CV     1
 OR {  363}
   (  segid "ATXH" and resid 7    and name HD2%)
   (( segid "ATXH" and resid 5    and name HG2 ))
 OR {  363}
   (  segid "ATXH" and resid 56   and name HD2%)
   (( segid "ATXH" and resid 5    and name HG2 ))
 OR {  363}
   (  segid "ATXH" and resid 38   and name HG2%)
   (( segid "ATXH" and resid 46   and name HG2 ))
 OR {  363}
   (  segid "ATXH" and resid 7    and name HD2%)
   (( segid "ATXH" and resid 46   and name HG2 ))
 OR {  363}
   (  segid "ATXH" and resid 40   and name HD1%)
   (( segid "ATXH" and resid 42   and name HG2 ))
 ASSI {  365}
   (( segid "ATXH" and resid 11   and name HB  ))
   (  segid "ATXH" and resid 11   and name HG1%)
      2.700     0.900     0.900 peak   365 spectrum    1 weight  0.10000E+01 volume  0.33826E-02 ppm1      0.643 ppm2      1.806 CV     1
 OR {  365}
   (  segid "ATXH" and resid 14   and name HE% )
   (  segid "ATXH" and resid 11   and name HG1%)
 ASSI {  371}
   (  segid "ATXH" and resid 47   and name HG2%)
   (( segid "ATXH" and resid 47   and name HA  ))
      2.700     0.900     0.900 peak   371 spectrum    1 weight  0.10000E+01 volume  0.33471E-02 ppm1      5.050 ppm2      0.797 CV     1
 OR {  371}
   (  segid "ATXH" and resid 45   and name HG1%)
   (( segid "ATXH" and resid 47   and name HA  ))
 ASSI {  374}
   (( segid "ATXH" and resid 59   and name HB  ))
   (  segid "ATXH" and resid 59   and name HD1%)
      2.900     1.100     1.100 peak   374 spectrum    1 weight  0.10000E+01 volume  0.33114E-02 ppm1      0.693 ppm2      2.011 CV     1
 OR {  374}
   (( segid "ATXH" and resid 30   and name HB2 ))
   (  segid "ATXH" and resid 59   and name HD1%)
 ASSI {  380}
   (( segid "ATXH" and resid 46   and name HA  ))
   (( segid "ATXH" and resid 46   and name HB2 ))
      2.800     1.000     1.000 peak   380 spectrum    1 weight  0.10000E+01 volume  0.32758E-02 ppm1      1.955 ppm2      5.239 CV     1
 OR {  380}
   (( segid "ATXH" and resid 4    and name HA  ))
   (( segid "ATXH" and resid 4    and name HB2 ))
 ASSI {  389}
   (( segid "ATXH" and resid 68   and name HB2 ))
   (  segid "ATXH" and resid 11   and name HG1%)
      2.900     1.000     1.000 peak   389 spectrum    1 weight  0.10000E+01 volume  0.31453E-02 ppm1      0.653 ppm2      2.992 CV     1
 OR {  389}
   (( segid "ATXH" and resid 50   and name HB2 ))
   (  segid "ATXH" and resid 33   and name HG2%)
 OR {  389}
   (( segid "ATXH" and resid 58   and name HB2 ))
   (  segid "ATXH" and resid 33   and name HG2%)
 ASSI {  396}
   (  segid "ATXH" and resid 30   and name HD1%)
   (( segid "ATXH" and resid 58   and name HB3 ))
      2.700     0.900     0.900 peak   396 spectrum    1 weight  0.10000E+01 volume  0.30741E-02 ppm1      2.589 ppm2      0.852 CV     1
 OR {  396}
   (  segid "ATXH" and resid 62   and name HG2%)
   (( segid "ATXH" and resid 58   and name HB3 ))
 ASSI {  398}
   (  segid "ATXH" and resid 53   and name HG1%)
   (( segid "ATXH" and resid 31   and name HB2 ))
      3.000     1.100     1.100 peak   398 spectrum    1 weight  0.10000E+01 volume  0.30741E-02 ppm1      2.740 ppm2      0.820 CV     1
 OR {  398}
   (  segid "ATXH" and resid 30   and name HD1%)
   (( segid "ATXH" and resid 31   and name HB2 ))
 OR {  398}
   (  segid "ATXH" and resid 30   and name HD2%)
   (( segid "ATXH" and resid 31   and name HB2 ))
 ASSI {  399}
   (( segid "ATXH" and resid 59   and name HG13))
   (( segid "ATXH" and resid 59   and name HA  ))
      3.000     1.100     1.100 peak   399 spectrum    1 weight  0.10000E+01 volume  0.30622E-02 ppm1      3.502 ppm2      1.146 CV     1
 OR {  399}
   (  segid "ATXH" and resid 62   and name HG1%)
   (( segid "ATXH" and resid 59   and name HA  ))
 ASSI {  410}
   (( segid "ATXH" and resid 46   and name HG2 ))
   (( segid "ATXH" and resid 46   and name HB3 ))
      2.600     0.900     0.900 peak   410 spectrum    1 weight  0.10000E+01 volume  0.29791E-02 ppm1      1.897 ppm2      2.192 CV     1
 OR {  410}
   (( segid "ATXH" and resid 34   and name HG2 ))
   (( segid "ATXH" and resid 34   and name HB2 ))
 ASSI {  413}
   (  segid "ATXH" and resid 36   and name HG1%)
   (( segid "ATXH" and resid 28   and name HB2 ))
      2.800     1.000     1.000 peak   413 spectrum    1 weight  0.10000E+01 volume  0.29435E-02 ppm1      1.844 ppm2      0.841 CV     1
 OR {  413}
   (  segid "ATXH" and resid 36   and name HG2%)
   (( segid "ATXH" and resid 28   and name HB2 ))
 OR {  413}
   (  segid "ATXH" and resid 36   and name HG1%)
   (( segid "ATXH" and resid 28   and name HB3 ))
 OR {  413}
   (  segid "ATXH" and resid 36   and name HG2%)
   (( segid "ATXH" and resid 28   and name HB3 ))
 OR {  413}
   (  segid "ATXH" and resid 33   and name HG1%)
   (( segid "ATXH" and resid 28   and name HB2 ))
 ASSI {  415}
   (( segid "ATXH" and resid 47   and name HB  ))
   (  segid "ATXH" and resid 47   and name HG1%)
      2.700     0.900     0.900 peak   415 spectrum    1 weight  0.10000E+01 volume  0.29198E-02 ppm1      0.883 ppm2      1.886 CV     1
 OR {  415}
   (( segid "ATXH" and resid 30   and name HG  ))
   (  segid "ATXH" and resid 30   and name HD2%)
 ASSI {  417}
   (( segid "ATXH" and resid 27   and name HB  ))
   (  segid "ATXH" and resid 36   and name HG1%)
      2.800     1.000     1.000 peak   417 spectrum    1 weight  0.10000E+01 volume  0.29079E-02 ppm1      0.780 ppm2      2.063 CV     1
 OR {  417}
   (( segid "ATXH" and resid 38   and name HB  ))
   (  segid "ATXH" and resid 45   and name HG1%)
 OR {  417}
   (( segid "ATXH" and resid 24   and name HB2 ))
   (  segid "ATXH" and resid 36   and name HG1%)
 ASSI {  430}
   (  segid "ATXH" and resid 54   and name HG1%)
   (( segid "ATXH" and resid 58   and name HB3 ))
      3.400     1.500     1.500 peak   430 spectrum    1 weight  0.10000E+01 volume  0.28129E-02 ppm1      2.594 ppm2      1.161 CV     1
 OR {  430}
   (( segid "ATXH" and resid 59   and name HG13))
   (( segid "ATXH" and resid 58   and name HB3 ))
 OR {  430}
   (  segid "ATXH" and resid 55   and name HG2%)
   (( segid "ATXH" and resid 58   and name HB3 ))
 ASSI {  433}
   (  segid "ATXH" and resid 59   and name HD1%)
   (( segid "ATXH" and resid 30   and name HB3 ))
      2.700     0.900     0.900 peak   433 spectrum    1 weight  0.10000E+01 volume  0.27773E-02 ppm1      1.311 ppm2      0.729 CV     1
 OR {  433}
   (  segid "ATXH" and resid 54   and name HG2%)
   (( segid "ATXH" and resid 30   and name HB3 ))
 ASSI {  441}
   (( segid "ATXH" and resid 63   and name HG12))
   (( segid "ATXH" and resid 63   and name HA  ))
      2.700     0.900     0.900 peak   441 spectrum    1 weight  0.10000E+01 volume  0.27299E-02 ppm1      3.534 ppm2      0.919 CV     1
 OR {  441}
   (  segid "ATXH" and resid 38   and name HG1%)
   (( segid "ATXH" and resid 20   and name HA  ))
 OR {  441}
   (  segid "ATXH" and resid 20   and name HG2%)
   (( segid "ATXH" and resid 20   and name HA  ))
 ASSI {  442}
   (( segid "ATXH" and resid 49   and name HG12))
   (( segid "ATXH" and resid 5    and name HB3 ))
      3.000     1.100     1.100 peak   442 spectrum    1 weight  0.10000E+01 volume  0.27299E-02 ppm1      1.828 ppm2      0.867 CV     1
 OR {  442}
   (  segid "ATXH" and resid 7    and name HD2%)
   (( segid "ATXH" and resid 5    and name HB3 ))
 ASSI {  443}
   (( segid "ATXH" and resid 38   and name HB  ))
   (  segid "ATXH" and resid 45   and name HG2%)
      3.100     1.200     1.200 peak   443 spectrum    1 weight  0.10000E+01 volume  0.27180E-02 ppm1      0.595 ppm2      2.035 CV     1
 OR {  443}
   (( segid "ATXH" and resid 39   and name HG3 ))
   (  segid "ATXH" and resid 45   and name HG2%)
 OR {  443}
   (( segid "ATXH" and resid 39   and name HB3 ))
   (  segid "ATXH" and resid 45   and name HG2%)
 ASSI {  445}
   (  segid "ATXH" and resid 70   and name HG2%)
   (( segid "ATXH" and resid 64   and name HG2 ))
      3.000     1.100     1.100 peak   445 spectrum    1 weight  0.10000E+01 volume  0.26942E-02 ppm1      2.668 ppm2      0.964 CV     1
 OR {  445}
   (  segid "ATXH" and resid 60   and name HG1%)
   (( segid "ATXH" and resid 64   and name HG2 ))
 ASSI {  451}
   (( segid "ATXH" and resid 30   and name HB2 ))
   (( segid "ATXH" and resid 30   and name HA  ))
      2.900     1.100     1.100 peak   451 spectrum    1 weight  0.10000E+01 volume  0.26824E-02 ppm1      4.185 ppm2      1.998 CV     1
 OR {  451}
   (( segid "ATXH" and resid 60   and name HB  ))
   (( segid "ATXH" and resid 61   and name HA  ))
 OR {  451}
   (( segid "ATXH" and resid 64   and name HB3 ))
   (( segid "ATXH" and resid 61   and name HA  ))
 ASSI {  453}
   (  segid "ATXH" and resid 27   and name HG2%)
   (( segid "ATXH" and resid 59   and name HB  ))
      3.100     1.200     1.200 peak   453 spectrum    1 weight  0.10000E+01 volume  0.26586E-02 ppm1      2.011 ppm2      0.858 CV     1
 OR {  453}
   (  segid "ATXH" and resid 27   and name HG1%)
   (( segid "ATXH" and resid 59   and name HB  ))
 OR {  453}
   (  segid "ATXH" and resid 60   and name HG2%)
   (( segid "ATXH" and resid 59   and name HB  ))
 ASSI {  454}
   (  segid "ATXH" and resid 14   and name HE% )
   (  segid "ATXH" and resid 38   and name HG2%)
      3.100     1.200     1.200 peak   454 spectrum    1 weight  0.10000E+01 volume  0.26467E-02 ppm1      0.827 ppm2      1.758 CV     1
 OR {  454}
   (( segid "ATXH" and resid 45   and name HB  ))
   (  segid "ATXH" and resid 38   and name HG2%)
 ASSI {  455}
   (( segid "ATXH" and resid 59   and name HG12))
   (  segid "ATXH" and resid 54   and name HG1%)
      3.100     1.200     1.200 peak   455 spectrum    1 weight  0.10000E+01 volume  0.26467E-02 ppm1      1.152 ppm2      1.495 CV     1
 OR {  455}
   (  segid "ATXH" and resid 61   and name HB% )
   (  segid "ATXH" and resid 62   and name HG1%)
 OR {  455}
   (( segid "ATXH" and resid 49   and name HG13))
   (  segid "ATXH" and resid 54   and name HG1%)
 ASSI {  461}
   (  segid "ATXH" and resid 33   and name HG1%)
   (( segid "ATXH" and resid 59   and name HG12))
      3.100     1.200     1.200 peak   461 spectrum    1 weight  0.10000E+01 volume  0.25993E-02 ppm1      1.515 ppm2      0.860 CV     1
 OR {  461}
   (  segid "ATXH" and resid 30   and name HD1%)
   (( segid "ATXH" and resid 59   and name HG12))
 OR {  461}
   (  segid "ATXH" and resid 27   and name HG2%)
   (( segid "ATXH" and resid 59   and name HG12))
 OR {  461}
   (  segid "ATXH" and resid 27   and name HG1%)
   (( segid "ATXH" and resid 59   and name HG12))
 OR {  461}
   (  segid "ATXH" and resid 30   and name HD2%)
   (( segid "ATXH" and resid 59   and name HG12))
 OR {  461}
   (  segid "ATXH" and resid 47   and name HG1%)
   (( segid "ATXH" and resid 59   and name HG12))
 ASSI {  465}
   (( segid "ATXH" and resid 63   and name HG12))
   (( segid "ATXH" and resid 63   and name HB  ))
      2.900     1.100     1.100 peak   465 spectrum    1 weight  0.10000E+01 volume  0.25875E-02 ppm1      1.796 ppm2      0.960 CV     1
 OR {  465}
   (  segid "ATXH" and resid 70   and name HG2%)
   (( segid "ATXH" and resid 63   and name HB  ))
 ASSI {  468}
   (( segid "ATXH" and resid 6    and name HG2 ))
   (( segid "ATXH" and resid 48   and name HA  ))
      3.100     1.200     1.200 peak   468 spectrum    1 weight  0.10000E+01 volume  0.25637E-02 ppm1      5.234 ppm2      2.203 CV     1
 OR {  468}
   (( segid "ATXH" and resid 34   and name HG2 ))
   (( segid "ATXH" and resid 48   and name HA  ))
 ASSI {  476}
   (  segid "ATXH" and resid 8    and name HG2%)
   (( segid "ATXH" and resid 46   and name HG3 ))
      3.000     1.100     1.100 peak   476 spectrum    1 weight  0.10000E+01 volume  0.25043E-02 ppm1      2.099 ppm2      1.086 CV     1
 OR {  476}
   (  segid "ATXH" and resid 48   and name HG2%)
   (( segid "ATXH" and resid 34   and name HG3 ))
 ASSI {  480}
   (( segid "ATXH" and resid 8    and name HA  ))
   (( segid "ATXH" and resid 8    and name HB  ))
      3.000     1.100     1.100 peak   480 spectrum    1 weight  0.10000E+01 volume  0.24925E-02 ppm1      3.858 ppm2      4.856 CV     1
 OR {  480}
   (( segid "ATXH" and resid 7    and name HA  ))
   (( segid "ATXH" and resid 8    and name HB  ))
 ASSI {  481}
   (( segid "ATXH" and resid 7    and name HB2 ))
   (( segid "ATXH" and resid 47   and name HB  ))
      3.000     1.100     1.100 peak   481 spectrum    1 weight  0.10000E+01 volume  0.24688E-02 ppm1      1.885 ppm2      1.582 CV     1
 OR {  481}
   (( segid "ATXH" and resid 49   and name HB  ))
   (( segid "ATXH" and resid 47   and name HB  ))
 OR {  481}
   (( segid "ATXH" and resid 9    and name HB2 ))
   (( segid "ATXH" and resid 47   and name HB  ))
 OR {  481}
   (( segid "ATXH" and resid 34   and name HB3 ))
   (( segid "ATXH" and resid 47   and name HB  ))
 ASSI {  486}
   (( segid "ATXH" and resid 63   and name HG12))
   (( segid "ATXH" and resid 26   and name HB3 ))
      2.800     1.000     1.000 peak   486 spectrum    1 weight  0.10000E+01 volume  0.24569E-02 ppm1      3.695 ppm2      0.896 CV     1
 OR {  486}
   (  segid "ATXH" and resid 27   and name HG1%)
   (( segid "ATXH" and resid 26   and name HB3 ))
 OR {  486}
   (  segid "ATXH" and resid 27   and name HG2%)
   (( segid "ATXH" and resid 26   and name HB3 ))
 ASSI {  491}
   (( segid "ATXH" and resid 11   and name HA  ))
   (  segid "ATXH" and resid 70   and name HG1%)
      2.900     1.000     1.000 peak   491 spectrum    1 weight  0.10000E+01 volume  0.23975E-02 ppm1      0.960 ppm2      4.757 CV     1
 OR {  491}
   (( segid "ATXH" and resid 39   and name HA  ))
   (  segid "ATXH" and resid 38   and name HG1%)
 ASSI {  492}
   (( segid "ATXH" and resid 43   and name HA1 ))
   (  segid "ATXH" and resid 44   and name HG2%)
      3.300     1.300     1.300 peak   492 spectrum    1 weight  0.10000E+01 volume  0.23856E-02 ppm1      0.893 ppm2      3.697 CV     1
 OR {  492}
   (( segid "ATXH" and resid 27   and name HA  ))
   (  segid "ATXH" and resid 62   and name HG2%)
 ASSI {  497}
   (( segid "ATXH" and resid 36   and name HB  ))
   (  segid "ATXH" and resid 27   and name HG1%)
      3.200     1.200     1.200 peak   497 spectrum    1 weight  0.10000E+01 volume  0.23619E-02 ppm1      0.923 ppm2      1.873 CV     1
 OR {  497}
   (( segid "ATXH" and resid 47   and name HB  ))
   (  segid "ATXH" and resid 27   and name HG1%)
 OR {  497}
   (( segid "ATXH" and resid 28   and name HB2 ))
   (  segid "ATXH" and resid 27   and name HG1%)
 ASSI {  500}
   (( segid "ATXH" and resid 12   and name HA  ))
   (  segid "ATXH" and resid 11   and name HG1%)
      3.200     1.200     1.200 peak   500 spectrum    1 weight  0.10000E+01 volume  0.23263E-02 ppm1      0.648 ppm2      4.643 CV     1
 OR {  500}
   (( segid "ATXH" and resid 10   and name HA  ))
   (  segid "ATXH" and resid 11   and name HG1%)
 OR {  500}
   (( segid "ATXH" and resid 54   and name HA  ))
   (  segid "ATXH" and resid 33   and name HG2%)
 ASSI {  502}
   (( segid "ATXH" and resid 42   and name HB2 ))
   (( segid "ATXH" and resid 44   and name HB  ))
      3.300     1.300     1.300 peak   502 spectrum    1 weight  0.10000E+01 volume  0.23145E-02 ppm1      3.969 ppm2      2.099 CV     1
 OR {  502}
   (( segid "ATXH" and resid 10   and name HB2 ))
   (( segid "ATXH" and resid 44   and name HB  ))
 OR {  502}
   (( segid "ATXH" and resid 39   and name HG3 ))
   (( segid "ATXH" and resid 44   and name HB  ))
 ASSI {  504}
   (  segid "ATXH" and resid 60   and name HG2%)
   (( segid "ATXH" and resid 57   and name HA  ))
      3.100     1.200     1.200 peak   504 spectrum    1 weight  0.10000E+01 volume  0.22907E-02 ppm1      3.846 ppm2      0.849 CV     1
 OR {  504}
   (  segid "ATXH" and resid 56   and name HD1%)
   (( segid "ATXH" and resid 57   and name HA  ))
 ASSI {  508}
   (( segid "ATXH" and resid 60   and name HB  ))
   (( segid "ATXH" and resid 60   and name HA  ))
      3.000     1.100     1.100 peak   508 spectrum    1 weight  0.10000E+01 volume  0.22670E-02 ppm1      3.253 ppm2      2.022 CV     1
 OR {  508}
   (( segid "ATXH" and resid 59   and name HB  ))
   (( segid "ATXH" and resid 60   and name HA  ))
 ASSI {  519}
   (( segid "ATXH" and resid 59   and name HA  ))
   (( segid "ATXH" and resid 62   and name HB  ))
      2.900     1.100     1.100 peak   519 spectrum    1 weight  0.10000E+01 volume  0.21839E-02 ppm1      2.197 ppm2      3.501 CV     1
 OR {  519}
   (( segid "ATXH" and resid 63   and name HA  ))
   (( segid "ATXH" and resid 62   and name HB  ))
 ASSI {  520}
   (( segid "ATXH" and resid 9    and name HB2 ))
   (  segid "ATXH" and resid 70   and name HG2%)
      3.100     1.200     1.200 peak   520 spectrum    1 weight  0.10000E+01 volume  0.21720E-02 ppm1      0.942 ppm2      1.567 CV     1
 OR {  520}
   (( segid "ATXH" and resid 23   and name HG13))
   (  segid "ATXH" and resid 38   and name HG1%)
 OR {  520}
   (( segid "ATXH" and resid 40   and name HB2 ))
   (  segid "ATXH" and resid 38   and name HG1%)
 OR {  520}
   (( segid "ATXH" and resid 23   and name HG12))
   (  segid "ATXH" and resid 38   and name HG1%)
 OR {  520}
   (  segid "ATXH" and resid 22   and name HB% )
   (  segid "ATXH" and resid 38   and name HG1%)
 OR {  520}
   (( segid "ATXH" and resid 23   and name HG13))
   (  segid "ATXH" and resid 70   and name HG2%)
 ASSI {  523}
   (( segid "ATXH" and resid 5    and name HA  ))
   (( segid "ATXH" and resid 5    and name HB2 ))
      3.100     1.200     1.200 peak   523 spectrum    1 weight  0.10000E+01 volume  0.21602E-02 ppm1      1.987 ppm2      4.630 CV     1
 OR {  523}
   (( segid "ATXH" and resid 35   and name HA  ))
   (( segid "ATXH" and resid 35   and name HG3 ))
 ASSI {  526}
   (  segid "ATXH" and resid 9    and name HD1%)
   (( segid "ATXH" and resid 7    and name HB2 ))
      3.000     1.100     1.100 peak   526 spectrum    1 weight  0.10000E+01 volume  0.21483E-02 ppm1      1.599 ppm2      0.661 CV     1
 OR {  526}
   (  segid "ATXH" and resid 9    and name HD2%)
   (( segid "ATXH" and resid 7    and name HB2 ))
 OR {  526}
   (  segid "ATXH" and resid 49   and name HD1%)
   (( segid "ATXH" and resid 7    and name HB2 ))
 ASSI {  530}
   (  segid "ATXH" and resid 63   and name HG2%)
   (( segid "ATXH" and resid 64   and name HG2 ))
      3.100     1.200     1.200 peak   530 spectrum    1 weight  0.10000E+01 volume  0.21127E-02 ppm1      2.651 ppm2      0.813 CV     1
 OR {  530}
   (  segid "ATXH" and resid 53   and name HG1%)
   (( segid "ATXH" and resid 31   and name HB3 ))
 OR {  530}
   (  segid "ATXH" and resid 30   and name HD2%)
   (( segid "ATXH" and resid 31   and name HB3 ))
 ASSI {  531}
   (( segid "ATXH" and resid 23   and name HB  ))
   (  segid "ATXH" and resid 23   and name HD1%)
      2.900     1.100     1.100 peak   531 spectrum    1 weight  0.10000E+01 volume  0.21127E-02 ppm1      0.147 ppm2      1.735 CV     1
 OR {  531}
   (( segid "ATXH" and resid 45   and name HB  ))
   (  segid "ATXH" and resid 23   and name HD1%)
 ASSI {  541}
   (( segid "ATXH" and resid 26   and name HB3 ))
   (  segid "ATXH" and resid 62   and name HG1%)
      3.600     1.600     1.600 peak   541 spectrum    1 weight  0.10000E+01 volume  0.20177E-02 ppm1      1.151 ppm2      3.701 CV     1
 OR {  541}
   (( segid "ATXH" and resid 32   and name HA1 ))
   (  segid "ATXH" and resid 54   and name HG1%)
 ASSI {  546}
   (( segid "ATXH" and resid 30   and name HG  ))
   (  segid "ATXH" and resid 62   and name HG1%)
      3.200     1.300     1.300 peak   546 spectrum    1 weight  0.10000E+01 volume  0.19940E-02 ppm1      1.150 ppm2      1.857 CV     1
 OR {  546}
   (( segid "ATXH" and resid 30   and name HG  ))
   (  segid "ATXH" and resid 54   and name HG1%)
 ASSI {  548}
   (( segid "ATXH" and resid 64   and name HG3 ))
   (  segid "ATXH" and resid 70   and name HG1%)
      3.200     1.300     1.300 peak   548 spectrum    1 weight  0.10000E+01 volume  0.19703E-02 ppm1      0.977 ppm2      2.469 CV     1
 OR {  548}
   (( segid "ATXH" and resid 69   and name HB3 ))
   (  segid "ATXH" and resid 70   and name HG1%)
 ASSI {  563}
   (  segid "ATXH" and resid 23   and name HG2%)
   (( segid "ATXH" and resid 23   and name HG13))
      3.100     1.200     1.200 peak   563 spectrum    1 weight  0.10000E+01 volume  0.18871E-02 ppm1      1.627 ppm2      0.553 CV     1
 OR {  563}
   (  segid "ATXH" and resid 63   and name HD1%)
   (( segid "ATXH" and resid 23   and name HG12))
 OR {  563}
   (  segid "ATXH" and resid 23   and name HG2%)
   (( segid "ATXH" and resid 23   and name HG12))
 OR {  563}
   (  segid "ATXH" and resid 63   and name HD1%)
   (( segid "ATXH" and resid 23   and name HG13))
 OR {  563}
   (( segid "ATXH" and resid 63   and name HG13))
   (( segid "ATXH" and resid 23   and name HG13))
 ASSI {  566}
   (( segid "ATXH" and resid 63   and name HG12))
   (( segid "ATXH" and resid 26   and name HB2 ))
      3.200     1.300     1.300 peak   566 spectrum    1 weight  0.10000E+01 volume  0.18753E-02 ppm1      3.895 ppm2      0.896 CV     1
 OR {  566}
   (  segid "ATXH" and resid 30   and name HD2%)
   (( segid "ATXH" and resid 26   and name HB2 ))
 OR {  566}
   (  segid "ATXH" and resid 62   and name HG2%)
   (( segid "ATXH" and resid 26   and name HB2 ))
 OR {  566}
   (  segid "ATXH" and resid 27   and name HG2%)
   (( segid "ATXH" and resid 26   and name HB2 ))
 ASSI {  572}
   (  segid "ATXH" and resid 49   and name HD1%)
   (( segid "ATXH" and resid 56   and name HA  ))
      3.100     1.200     1.200 peak   572 spectrum    1 weight  0.10000E+01 volume  0.18397E-02 ppm1      3.875 ppm2      0.693 CV     1
 OR {  572}
   (  segid "ATXH" and resid 59   and name HD1%)
   (( segid "ATXH" and resid 56   and name HA  ))
 OR {  572}
   (  segid "ATXH" and resid 54   and name HG2%)
   (( segid "ATXH" and resid 56   and name HA  ))
 ASSI {  578}
   (( segid "ATXH" and resid 27   and name HB  ))
   (( segid "ATXH" and resid 28   and name HA  ))
      3.300     1.400     1.400 peak   578 spectrum    1 weight  0.10000E+01 volume  0.18041E-02 ppm1      3.777 ppm2      2.022 CV     1
 OR {  578}
   (( segid "ATXH" and resid 30   and name HB2 ))
   (( segid "ATXH" and resid 28   and name HA  ))
 OR {  578}
   (( segid "ATXH" and resid 39   and name HB3 ))
   (( segid "ATXH" and resid 40   and name HA  ))
 OR {  578}
   (( segid "ATXH" and resid 14   and name HG2 ))
   (( segid "ATXH" and resid 40   and name HA  ))
 OR {  578}
   (( segid "ATXH" and resid 14   and name HG3 ))
   (( segid "ATXH" and resid 40   and name HA  ))
 OR {  578}
   (( segid "ATXH" and resid 29   and name HB2 ))
   (( segid "ATXH" and resid 28   and name HA  ))
 ASSI {  580}
   (( segid "ATXH" and resid 63   and name HA  ))
   (  segid "ATXH" and resid 62   and name HG1%)
      3.100     1.200     1.200 peak   580 spectrum    1 weight  0.10000E+01 volume  0.18041E-02 ppm1      1.150 ppm2      3.499 CV     1
 OR {  580}
   (( segid "ATXH" and resid 59   and name HA  ))
   (  segid "ATXH" and resid 62   and name HG1%)
 ASSI {  581}
   (( segid "ATXH" and resid 39   and name HA  ))
   (( segid "ATXH" and resid 39   and name HG3 ))
      3.400     1.400     1.400 peak   581 spectrum    1 weight  0.10000E+01 volume  0.17922E-02 ppm1      2.073 ppm2      4.740 CV     1
 OR {  581}
   (( segid "ATXH" and resid 37   and name HA  ))
   (( segid "ATXH" and resid 38   and name HB  ))
 ASSI {  584}
   (  segid "ATXH" and resid 70   and name HG2%)
   (( segid "ATXH" and resid 9    and name HB2 ))
      2.900     1.100     1.100 peak   584 spectrum    1 weight  0.10000E+01 volume  0.17803E-02 ppm1      1.566 ppm2      0.948 CV     1
 OR {  584}
   (  segid "ATXH" and resid 70   and name HG1%)
   (( segid "ATXH" and resid 9    and name HB2 ))
 OR {  584}
   (  segid "ATXH" and resid 44   and name HG2%)
   (( segid "ATXH" and resid 9    and name HB2 ))
 ASSI {  586}
   (( segid "ATXH" and resid 63   and name HG12))
   (  segid "ATXH" and resid 23   and name HD1%)
      3.200     1.300     1.300 peak   586 spectrum    1 weight  0.10000E+01 volume  0.17685E-02 ppm1      0.152 ppm2      0.912 CV     1
 OR {  586}
   (  segid "ATXH" and resid 38   and name HG1%)
   (  segid "ATXH" and resid 23   and name HD1%)
 OR {  586}
   (  segid "ATXH" and resid 27   and name HG2%)
   (  segid "ATXH" and resid 23   and name HD1%)
 ASSI {  587}
   (  segid "ATXH" and resid 22   and name HB% )
   (( segid "ATXH" and resid 19   and name HA  ))
      3.000     1.100     1.100 peak   587 spectrum    1 weight  0.10000E+01 volume  0.17685E-02 ppm1      4.094 ppm2      1.599 CV     1
 OR {  587}
   (( segid "ATXH" and resid 49   and name HB  ))
   (( segid "ATXH" and resid 33   and name HA  ))
 ASSI {  588}
   (( segid "ATXH" and resid 30   and name HG  ))
   (( segid "ATXH" and resid 27   and name HA  ))
      3.000     1.200     1.200 peak   588 spectrum    1 weight  0.10000E+01 volume  0.17685E-02 ppm1      3.702 ppm2      1.865 CV     1
 OR {  588}
   (( segid "ATXH" and resid 28   and name HB2 ))
   (( segid "ATXH" and resid 27   and name HA  ))
 ASSI {  593}
   (( segid "ATXH" and resid 26   and name HA  ))
   (( segid "ATXH" and resid 29   and name HB2 ))
      3.000     1.100     1.100 peak   593 spectrum    1 weight  0.10000E+01 volume  0.17447E-02 ppm1      2.068 ppm2      4.164 CV     1
 OR {  593}
   (( segid "ATXH" and resid 30   and name HA  ))
   (( segid "ATXH" and resid 29   and name HB2 ))
 ASSI {  595}
   (( segid "ATXH" and resid 36   and name HB  ))
   (  segid "ATXH" and resid 45   and name HG2%)
      3.300     1.400     1.400 peak   595 spectrum    1 weight  0.10000E+01 volume  0.17329E-02 ppm1      0.593 ppm2      1.887 CV     1
 OR {  595}
   (( segid "ATXH" and resid 24   and name HB3 ))
   (  segid "ATXH" and resid 45   and name HG2%)
 OR {  595}
   (( segid "ATXH" and resid 42   and name HB3 ))
   (  segid "ATXH" and resid 45   and name HG2%)
 OR {  595}
   (( segid "ATXH" and resid 10   and name HB3 ))
   (  segid "ATXH" and resid 45   and name HG2%)
 ASSI {  599}
   (  segid "ATXH" and resid 41   and name HB% )
   (( segid "ATXH" and resid 42   and name HG2 ))
      3.300     1.300     1.300 peak   599 spectrum    1 weight  0.10000E+01 volume  0.17092E-02 ppm1      2.169 ppm2      1.393 CV     1
 OR {  599}
   (  segid "ATXH" and resid 3    and name HB% )
   (( segid "ATXH" and resid 5    and name HG2 ))
 OR {  599}
   (( segid "ATXH" and resid 49   and name HG13))
   (( segid "ATXH" and resid 5    and name HG2 ))
 ASSI {  600}
   (( segid "ATXH" and resid 57   and name HD3 ))
   (  segid "ATXH" and resid 60   and name HG2%)
      3.200     1.300     1.300 peak   600 spectrum    1 weight  0.10000E+01 volume  0.17092E-02 ppm1      0.804 ppm2      1.574 CV     1
 OR {  600}
   (( segid "ATXH" and resid 23   and name HG13))
   (  segid "ATXH" and resid 47   and name HG2%)
 OR {  600}
   (( segid "ATXH" and resid 7    and name HB2 ))
   (  segid "ATXH" and resid 47   and name HG2%)
 OR {  600}
   (( segid "ATXH" and resid 37   and name HB3 ))
   (  segid "ATXH" and resid 47   and name HG2%)
 OR {  600}
   (( segid "ATXH" and resid 9    and name HB2 ))
   (  segid "ATXH" and resid 47   and name HG2%)
 OR {  600}
   (( segid "ATXH" and resid 9    and name HB2 ))
   (  segid "ATXH" and resid 60   and name HG2%)
 OR {  600}
   (( segid "ATXH" and resid 23   and name HG12))
   (  segid "ATXH" and resid 47   and name HG2%)
 OR {  600}
   (( segid "ATXH" and resid 56   and name HB3 ))
   (  segid "ATXH" and resid 60   and name HG2%)
 ASSI {  603}
   (  segid "ATXH" and resid 36   and name HG2%)
   (( segid "ATXH" and resid 24   and name HA  ))
      3.100     1.200     1.200 peak   603 spectrum    1 weight  0.10000E+01 volume  0.16973E-02 ppm1      3.561 ppm2      0.828 CV     1
 OR {  603}
   (  segid "ATXH" and resid 36   and name HG1%)
   (( segid "ATXH" and resid 24   and name HA  ))
 OR {  603}
   (  segid "ATXH" and resid 38   and name HG2%)
   (( segid "ATXH" and resid 24   and name HA  ))
 ASSI {  605}
   (( segid "ATXH" and resid 63   and name HG12))
   (( segid "ATXH" and resid 23   and name HB  ))
      3.500     1.500     1.500 peak   605 spectrum    1 weight  0.10000E+01 volume  0.16735E-02 ppm1      1.729 ppm2      0.921 CV     1
 OR {  605}
   (  segid "ATXH" and resid 27   and name HG2%)
   (( segid "ATXH" and resid 23   and name HB  ))
 ASSI {  610}
   (  segid "ATXH" and resid 30   and name HD2%)
   (( segid "ATXH" and resid 26   and name HA  ))
      3.200     1.300     1.300 peak   610 spectrum    1 weight  0.10000E+01 volume  0.16617E-02 ppm1      4.154 ppm2      0.895 CV     1
 OR {  610}
   (  segid "ATXH" and resid 30   and name HD1%)
   (( segid "ATXH" and resid 26   and name HA  ))
 OR {  610}
   (  segid "ATXH" and resid 27   and name HG2%)
   (( segid "ATXH" and resid 26   and name HA  ))
 ASSI {  611}
   (( segid "ATXH" and resid 39   and name HB2 ))
   (( segid "ATXH" and resid 44   and name HB  ))
      3.400     1.400     1.400 peak   611 spectrum    1 weight  0.10000E+01 volume  0.16617E-02 ppm1      3.961 ppm2      2.280 CV     1
 OR {  611}
   (( segid "ATXH" and resid 10   and name HG2 ))
   (( segid "ATXH" and resid 44   and name HB  ))
 OR {  611}
   (( segid "ATXH" and resid 10   and name HG3 ))
   (( segid "ATXH" and resid 44   and name HB  ))
 ASSI {  613}
   (( segid "ATXH" and resid 5    and name HB3 ))
   (  segid "ATXH" and resid 7    and name HD1%)
      3.100     1.200     1.200 peak   613 spectrum    1 weight  0.10000E+01 volume  0.16617E-02 ppm1      0.786 ppm2      1.881 CV     1
 OR {  613}
   (( segid "ATXH" and resid 47   and name HB  ))
   (  segid "ATXH" and resid 7    and name HD1%)
 ASSI {  615}
   (( segid "ATXH" and resid 30   and name HB2 ))
   (  segid "ATXH" and resid 33   and name HG1%)
      3.300     1.400     1.400 peak   615 spectrum    1 weight  0.10000E+01 volume  0.16498E-02 ppm1      0.833 ppm2      1.999 CV     1
 OR {  615}
   (( segid "ATXH" and resid 27   and name HB  ))
   (  segid "ATXH" and resid 33   and name HG1%)
 OR {  615}
   (( segid "ATXH" and resid 35   and name HB3 ))
   (  segid "ATXH" and resid 33   and name HG1%)
 ASSI {  620}
   (( segid "ATXH" and resid 20   and name HA  ))
   (  segid "ATXH" and resid 23   and name HG2%)
      3.000     1.100     1.100 peak   620 spectrum    1 weight  0.10000E+01 volume  0.16142E-02 ppm1      0.567 ppm2      3.541 CV     1
 OR {  620}
   (( segid "ATXH" and resid 24   and name HA  ))
   (  segid "ATXH" and resid 23   and name HG2%)
 ASSI {  621}
   (  segid "ATXH" and resid 38   and name HG2%)
   (( segid "ATXH" and resid 39   and name HA  ))
      3.400     1.400     1.400 peak   621 spectrum    1 weight  0.10000E+01 volume  0.16142E-02 ppm1      4.757 ppm2      0.820 CV     1
 OR {  621}
   (  segid "ATXH" and resid 40   and name HD1%)
   (( segid "ATXH" and resid 39   and name HA  ))
 ASSI {  624}
   (( segid "ATXH" and resid 47   and name HB  ))
   (( segid "ATXH" and resid 7    and name HB2 ))
      3.100     1.200     1.200 peak   624 spectrum    1 weight  0.10000E+01 volume  0.15904E-02 ppm1      1.602 ppm2      1.879 CV     1
 OR {  624}
   (( segid "ATXH" and resid 6    and name HB3 ))
   (( segid "ATXH" and resid 7    and name HB2 ))
 OR {  624}
   (( segid "ATXH" and resid 5    and name HB3 ))
   (( segid "ATXH" and resid 7    and name HB2 ))
 ASSI {  631}
   (( segid "ATXH" and resid 7    and name HG  ))
   (( segid "ATXH" and resid 6    and name HA  ))
      3.500     1.500     1.500 peak   631 spectrum    1 weight  0.10000E+01 volume  0.15549E-02 ppm1      5.208 ppm2      0.739 CV     1
 OR {  631}
   (  segid "ATXH" and resid 7    and name HD1%)
   (( segid "ATXH" and resid 6    and name HA  ))
 OR {  631}
   (  segid "ATXH" and resid 49   and name HG2%)
   (( segid "ATXH" and resid 4    and name HA  ))
 ASSI {  634}
   (( segid "ATXH" and resid 56   and name HB3 ))
   (  segid "ATXH" and resid 60   and name HG1%)
      3.300     1.400     1.400 peak   634 spectrum    1 weight  0.10000E+01 volume  0.15549E-02 ppm1      0.972 ppm2      1.567 CV     1
 OR {  634}
   (( segid "ATXH" and resid 9    and name HB2 ))
   (  segid "ATXH" and resid 60   and name HG1%)
 OR {  634}
   (( segid "ATXH" and resid 57   and name HD3 ))
   (  segid "ATXH" and resid 60   and name HG1%)
 ASSI {  635}
   (( segid "ATXH" and resid 30   and name HA  ))
   (( segid "ATXH" and resid 31   and name HB3 ))
      3.700     1.700     1.700 peak   635 spectrum    1 weight  0.10000E+01 volume  0.15430E-02 ppm1      2.639 ppm2      4.181 CV     1
 OR {  635}
   (( segid "ATXH" and resid 32   and name HA2 ))
   (( segid "ATXH" and resid 31   and name HB3 ))
 ASSI {  636}
   (( segid "ATXH" and resid 28   and name HB2 ))
   (( segid "ATXH" and resid 28   and name HE2 ))
      3.400     1.400     1.400 peak   636 spectrum    1 weight  0.10000E+01 volume  0.15430E-02 ppm1      2.952 ppm2      1.838 CV     1
 OR {  636}
   (( segid "ATXH" and resid 28   and name HB3 ))
   (( segid "ATXH" and resid 28   and name HE2 ))
 OR {  636}
   (( segid "ATXH" and resid 57   and name HB2 ))
   (( segid "ATXH" and resid 57   and name HE2 ))
 OR {  636}
   (( segid "ATXH" and resid 57   and name HB2 ))
   (( segid "ATXH" and resid 57   and name HE3 ))
 ASSI {  640}
   (( segid "ATXH" and resid 47   and name HB  ))
   (  segid "ATXH" and resid 49   and name HG2%)
      3.300     1.300     1.300 peak   640 spectrum    1 weight  0.10000E+01 volume  0.15311E-02 ppm1      0.727 ppm2      1.885 CV     1
 OR {  640}
   (( segid "ATXH" and resid 5    and name HB3 ))
   (  segid "ATXH" and resid 49   and name HG2%)
 OR {  640}
   (( segid "ATXH" and resid 34   and name HB2 ))
   (  segid "ATXH" and resid 49   and name HG2%)
 ASSI {  641}
   (( segid "ATXH" and resid 39   and name HA  ))
   (( segid "ATXH" and resid 39   and name HG2 ))
      3.100     1.200     1.200 peak   641 spectrum    1 weight  0.10000E+01 volume  0.15311E-02 ppm1      2.180 ppm2      4.747 CV     1
 OR {  641}
   (( segid "ATXH" and resid 11   and name HA  ))
   (( segid "ATXH" and resid 12   and name HB2 ))
 ASSI {  647}
   (( segid "ATXH" and resid 51   and name HB2 ))
   (  segid "ATXH" and resid 49   and name HD1%)
      3.300     1.400     1.400 peak   647 spectrum    1 weight  0.10000E+01 volume  0.14955E-02 ppm1      0.647 ppm2      4.197 CV     1
 OR {  647}
   (( segid "ATXH" and resid 32   and name HA2 ))
   (  segid "ATXH" and resid 49   and name HD1%)
 ASSI {  648}
   (  segid "ATXH" and resid 62   and name HG1%)
   (( segid "ATXH" and resid 27   and name HA  ))
      3.400     1.400     1.400 peak   648 spectrum    1 weight  0.10000E+01 volume  0.14836E-02 ppm1      3.706 ppm2      1.146 CV     1
 OR {  648}
   (( segid "ATXH" and resid 59   and name HG13))
   (( segid "ATXH" and resid 27   and name HA  ))
 ASSI {  653}
   (( segid "ATXH" and resid 61   and name HA  ))
   (  segid "ATXH" and resid 62   and name HG2%)
      4.000     2.000     2.000 peak   653 spectrum    1 weight  0.10000E+01 volume  0.14599E-02 ppm1      0.894 ppm2      4.158 CV     1
 OR {  653}
   (( segid "ATXH" and resid 30   and name HA  ))
   (  segid "ATXH" and resid 62   and name HG2%)
 ASSI {  656}
   (  segid "ATXH" and resid 54   and name HG1%)
   (( segid "ATXH" and resid 30   and name HA  ))
      3.200     1.300     1.300 peak   656 spectrum    1 weight  0.10000E+01 volume  0.14480E-02 ppm1      4.179 ppm2      1.159 CV     1
 OR {  656}
   (  segid "ATXH" and resid 62   and name HG1%)
   (( segid "ATXH" and resid 30   and name HA  ))
 OR {  656}
   (  segid "ATXH" and resid 62   and name HG1%)
   (( segid "ATXH" and resid 61   and name HA  ))
 ASSI {  664}
   (( segid "ATXH" and resid 7    and name HB3 ))
   (( segid "ATXH" and resid 47   and name HB  ))
      3.400     1.400     1.400 peak   664 spectrum    1 weight  0.10000E+01 volume  0.14006E-02 ppm1      1.882 ppm2      1.405 CV     1
 OR {  664}
   (( segid "ATXH" and resid 49   and name HG13))
   (( segid "ATXH" and resid 47   and name HB  ))
 ASSI {  666}
   (( segid "ATXH" and resid 11   and name HB  ))
   (  segid "ATXH" and resid 11   and name HG2%)
      3.100     1.200     1.200 peak   666 spectrum    1 weight  0.10000E+01 volume  0.14006E-02 ppm1      0.705 ppm2      1.793 CV     1
 OR {  666}
   (  segid "ATXH" and resid 14   and name HE% )
   (  segid "ATXH" and resid 11   and name HG2%)
 ASSI {  676}
   (( segid "ATXH" and resid 38   and name HB  ))
   (( segid "ATXH" and resid 38   and name HA  ))
      3.100     1.200     1.200 peak   676 spectrum    1 weight  0.10000E+01 volume  0.13649E-02 ppm1      4.302 ppm2      2.047 CV     1
 OR {  676}
   (( segid "ATXH" and resid 39   and name HB3 ))
   (( segid "ATXH" and resid 38   and name HA  ))
 ASSI {  683}
   (( segid "ATXH" and resid 6    and name HA  ))
   (( segid "ATXH" and resid 5    and name HA  ))
      3.700     1.700     1.700 peak   683 spectrum    1 weight  0.10000E+01 volume  0.13412E-02 ppm1      4.627 ppm2      5.191 CV     1
 OR {  683}
   (( segid "ATXH" and resid 4    and name HA  ))
   (( segid "ATXH" and resid 5    and name HA  ))
 ASSI {  684}
   (( segid "ATXH" and resid 47   and name HB  ))
   (  segid "ATXH" and resid 9    and name HD1%)
      3.300     1.400     1.400 peak   684 spectrum    1 weight  0.10000E+01 volume  0.13293E-02 ppm1      0.637 ppm2      1.880 CV     1
 OR {  684}
   (( segid "ATXH" and resid 46   and name HB3 ))
   (  segid "ATXH" and resid 9    and name HD1%)
 ASSI {  686}
   (( segid "ATXH" and resid 24   and name HA  ))
   (( segid "ATXH" and resid 27   and name HB  ))
      3.300     1.400     1.400 peak   686 spectrum    1 weight  0.10000E+01 volume  0.13293E-02 ppm1      2.031 ppm2      3.555 CV     1
 OR {  686}
   (( segid "ATXH" and resid 59   and name HA  ))
   (( segid "ATXH" and resid 60   and name HB  ))
 OR {  686}
   (( segid "ATXH" and resid 59   and name HA  ))
   (( segid "ATXH" and resid 27   and name HB  ))
 ASSI {  688}
   (( segid "ATXH" and resid 63   and name HG12))
   (( segid "ATXH" and resid 23   and name HA  ))
      3.400     1.400     1.400 peak   688 spectrum    1 weight  0.10000E+01 volume  0.13174E-02 ppm1      3.445 ppm2      0.900 CV     1
 OR {  688}
   (  segid "ATXH" and resid 27   and name HG2%)
   (( segid "ATXH" and resid 23   and name HA  ))
 ASSI {  695}
   (( segid "ATXH" and resid 34   and name HB2 ))
   (( segid "ATXH" and resid 49   and name HA  ))
      3.400     1.500     1.500 peak   695 spectrum    1 weight  0.10000E+01 volume  0.12581E-02 ppm1      5.310 ppm2      1.906 CV     1
 OR {  695}
   (  segid "ATXH" and resid 4    and name HE% )
   (( segid "ATXH" and resid 49   and name HA  ))
 OR {  695}
   (( segid "ATXH" and resid 47   and name HB  ))
   (( segid "ATXH" and resid 49   and name HA  ))
 ASSI {  696}
   (( segid "ATXH" and resid 36   and name HB  ))
   (( segid "ATXH" and resid 36   and name HA  ))
      3.100     1.200     1.200 peak   696 spectrum    1 weight  0.10000E+01 volume  0.12463E-02 ppm1      4.930 ppm2      1.882 CV     1
 OR {  696}
   (( segid "ATXH" and resid 47   and name HB  ))
   (( segid "ATXH" and resid 36   and name HA  ))
 ASSI {  697}
   (( segid "ATXH" and resid 57   and name HB2 ))
   (( segid "ATXH" and resid 55   and name HB  ))
      3.500     1.600     1.600 peak   697 spectrum    1 weight  0.10000E+01 volume  0.12463E-02 ppm1      4.426 ppm2      1.761 CV     1
 OR {  697}
   (( segid "ATXH" and resid 57   and name HB3 ))
   (( segid "ATXH" and resid 55   and name HB  ))
 OR {  697}
   (( segid "ATXH" and resid 56   and name HB2 ))
   (( segid "ATXH" and resid 55   and name HB  ))
 ASSI {  702}
   (( segid "ATXH" and resid 45   and name HA  ))
   (  segid "ATXH" and resid 38   and name HG2%)
      3.500     1.600     1.600 peak   702 spectrum    1 weight  0.10000E+01 volume  0.12106E-02 ppm1      0.825 ppm2      4.448 CV     1
 OR {  702}
   (( segid "ATXH" and resid 34   and name HA  ))
   (  segid "ATXH" and resid 33   and name HG1%)
 ASSI {  715}
   (  segid "ATXH" and resid 53   and name HG1%)
   (( segid "ATXH" and resid 31   and name HA  ))
      3.300     1.400     1.400 peak   715 spectrum    1 weight  0.10000E+01 volume  0.11311E-02 ppm1      4.439 ppm2      0.812 CV     1
 OR {  715}
   (  segid "ATXH" and resid 30   and name HD2%)
   (( segid "ATXH" and resid 31   and name HA  ))
 ASSI {  716}
   (( segid "ATXH" and resid 8    and name HA  ))
   (( segid "ATXH" and resid 44   and name HB  ))
      3.600     1.600     1.600 peak   716 spectrum    1 weight  0.10000E+01 volume  0.11311E-02 ppm1      3.953 ppm2      4.845 CV     1
 OR {  716}
   (( segid "ATXH" and resid 9    and name HA  ))
   (( segid "ATXH" and resid 44   and name HB  ))
 ASSI {  719}
   (  segid "ATXH" and resid 59   and name HD1%)
   (( segid "ATXH" and resid 30   and name HB2 ))
      3.100     1.200     1.200 peak   719 spectrum    1 weight  0.10000E+01 volume  0.11169E-02 ppm1      1.978 ppm2      0.669 CV     1
 OR {  719}
   (  segid "ATXH" and resid 33   and name HG2%)
   (( segid "ATXH" and resid 30   and name HB2 ))
 ASSI {  720}
   (  segid "ATXH" and resid 54   and name HG1%)
   (( segid "ATXH" and resid 30   and name HB2 ))
      3.500     1.500     1.500 peak   720 spectrum    1 weight  0.10000E+01 volume  0.11157E-02 ppm1      1.991 ppm2      1.159 CV     1
 OR {  720}
   (( segid "ATXH" and resid 59   and name HG13))
   (( segid "ATXH" and resid 30   and name HB2 ))
 ASSI {  726}
   (( segid "ATXH" and resid 59   and name HA  ))
   (  segid "ATXH" and resid 27   and name HG2%)
      3.600     1.600     1.600 peak   726 spectrum    1 weight  0.10000E+01 volume  0.10884E-02 ppm1      0.900 ppm2      3.551 CV     1
 OR {  726}
   (( segid "ATXH" and resid 24   and name HA  ))
   (  segid "ATXH" and resid 27   and name HG2%)
 OR {  726}
   (( segid "ATXH" and resid 63   and name HA  ))
   (  segid "ATXH" and resid 27   and name HG2%)
 ASSI {  728}
   (  segid "ATXH" and resid 63   and name HG2%)
   (( segid "ATXH" and resid 26   and name HB2 ))
      3.600     1.600     1.600 peak   728 spectrum    1 weight  0.10000E+01 volume  0.10777E-02 ppm1      3.914 ppm2      0.819 CV     1
 OR {  728}
   (  segid "ATXH" and resid 30   and name HD2%)
   (( segid "ATXH" and resid 26   and name HB2 ))
 OR {  728}
   (  segid "ATXH" and resid 27   and name HG2%)
   (( segid "ATXH" and resid 26   and name HB2 ))
 ASSI {  730}
   (( segid "ATXH" and resid 9    and name HA  ))
   (  segid "ATXH" and resid 9    and name HD2%)
      3.800     1.800     1.800 peak   730 spectrum    1 weight  0.10000E+01 volume  0.10729E-02 ppm1      0.697 ppm2      4.848 CV     1
 OR {  730}
   (( segid "ATXH" and resid 8    and name HA  ))
   (  segid "ATXH" and resid 9    and name HD2%)
 ASSI {  735}
   (( segid "ATXH" and resid 63   and name HA  ))
   (  segid "ATXH" and resid 63   and name HD1%)
      4.100     2.100     1.900 peak   735 spectrum    1 weight  0.10000E+01 volume  0.10504E-02 ppm1      0.562 ppm2      3.539 CV     1
 OR {  735}
   (( segid "ATXH" and resid 59   and name HA  ))
   (  segid "ATXH" and resid 63   and name HD1%)
 ASSI {  738}
   (( segid "ATXH" and resid 27   and name HA  ))
   (( segid "ATXH" and resid 62   and name HB  ))
      3.400     1.500     1.500 peak   738 spectrum    1 weight  0.10000E+01 volume  0.10445E-02 ppm1      2.196 ppm2      3.696 CV     1
 OR {  738}
   (( segid "ATXH" and resid 26   and name HB3 ))
   (( segid "ATXH" and resid 62   and name HB  ))
 ASSI {  741}
   (( segid "ATXH" and resid 63   and name HB  ))
   (  segid "ATXH" and resid 70   and name HG1%)
      3.500     1.500     1.500 peak   741 spectrum    1 weight  0.10000E+01 volume  0.10350E-02 ppm1      0.975 ppm2      1.796 CV     1
 OR {  741}
   (  segid "ATXH" and resid 14   and name HE% )
   (  segid "ATXH" and resid 38   and name HG1%)
 OR {  741}
   (( segid "ATXH" and resid 11   and name HB  ))
   (  segid "ATXH" and resid 70   and name HG1%)
 ASSI {  742}
   (  segid "ATXH" and resid 44   and name HG2%)
   (( segid "ATXH" and resid 10   and name HG2 ))
      3.500     1.500     1.500 peak   742 spectrum    1 weight  0.10000E+01 volume  0.10338E-02 ppm1      2.270 ppm2      0.922 CV     1
 OR {  742}
   (  segid "ATXH" and resid 44   and name HG2%)
   (( segid "ATXH" and resid 10   and name HG3 ))
 OR {  742}
   (  segid "ATXH" and resid 70   and name HG1%)
   (( segid "ATXH" and resid 10   and name HG3 ))
 OR {  742}
   (  segid "ATXH" and resid 47   and name HG1%)
   (( segid "ATXH" and resid 35   and name HG2 ))
 OR {  742}
   (  segid "ATXH" and resid 70   and name HG1%)
   (( segid "ATXH" and resid 10   and name HG2 ))
 ASSI {  743}
   (( segid "ATXH" and resid 56   and name HB3 ))
   (( segid "ATXH" and resid 55   and name HB  ))
      4.100     2.100     1.900 peak   743 spectrum    1 weight  0.10000E+01 volume  0.10314E-02 ppm1      4.427 ppm2      1.616 CV     1
 OR {  743}
   (( segid "ATXH" and resid 57   and name HD2 ))
   (( segid "ATXH" and resid 55   and name HB  ))
 ASSI {  744}
   (( segid "ATXH" and resid 40   and name HA  ))
   (  segid "ATXH" and resid 38   and name HG1%)
      3.400     1.400     1.400 peak   744 spectrum    1 weight  0.10000E+01 volume  0.10290E-02 ppm1      0.984 ppm2      3.831 CV     1
 OR {  744}
   (( segid "ATXH" and resid 17   and name HA1 ))
   (  segid "ATXH" and resid 38   and name HG1%)
 ASSI {  745}
   (( segid "ATXH" and resid 5    and name HB2 ))
   (  segid "ATXH" and resid 7    and name HD1%)
      3.500     1.600     1.600 peak   745 spectrum    1 weight  0.10000E+01 volume  0.10219E-02 ppm1      0.785 ppm2      1.997 CV     1
 OR {  745}
   (( segid "ATXH" and resid 6    and name HB2 ))
   (  segid "ATXH" and resid 7    and name HD1%)
 OR {  745}
   (( segid "ATXH" and resid 5    and name HG3 ))
   (  segid "ATXH" and resid 7    and name HD1%)
 ASSI {  748}
   (  segid "ATXH" and resid 48   and name HG2%)
   (( segid "ATXH" and resid 34   and name HG2 ))
      3.500     1.500     1.500 peak   748 spectrum    1 weight  0.10000E+01 volume  0.10148E-02 ppm1      2.198 ppm2      1.090 CV     1
 OR {  748}
   (  segid "ATXH" and resid 8    and name HG2%)
   (( segid "ATXH" and resid 46   and name HG2 ))
 ASSI {  749}
   (( segid "ATXH" and resid 9    and name HA  ))
   (  segid "ATXH" and resid 9    and name HD1%)
      4.000     2.000     2.000 peak   749 spectrum    1 weight  0.10000E+01 volume  0.10112E-02 ppm1      0.633 ppm2      4.845 CV     1
 OR {  749}
   (( segid "ATXH" and resid 8    and name HA  ))
   (  segid "ATXH" and resid 9    and name HD1%)
 ASSI {  752}
   (  segid "ATXH" and resid 48   and name HG2%)
   (( segid "ATXH" and resid 6    and name HB3 ))
      3.100     1.200     1.200 peak   752 spectrum    1 weight  0.10000E+01 volume  0.99702E-03 ppm1      1.870 ppm2      1.098 CV     1
 OR {  752}
   (  segid "ATXH" and resid 8    and name HG2%)
   (( segid "ATXH" and resid 42   and name HB3 ))
 ASSI {  756}
   (( segid "ATXH" and resid 49   and name HB  ))
   (( segid "ATXH" and resid 5    and name HB3 ))
      3.600     1.700     1.700 peak   756 spectrum    1 weight  0.10000E+01 volume  0.97447E-03 ppm1      1.827 ppm2      1.559 CV     1
 OR {  756}
   (( segid "ATXH" and resid 7    and name HB2 ))
   (( segid "ATXH" and resid 5    and name HB3 ))
 ASSI {  757}
   (( segid "ATXH" and resid 10   and name HG3 ))
   (( segid "ATXH" and resid 11   and name HA  ))
      3.500     1.600     1.600 peak   757 spectrum    1 weight  0.10000E+01 volume  0.96967E-03 ppm1      4.769 ppm2      2.287 CV     1
 OR {  757}
   (( segid "ATXH" and resid 12   and name HG2 ))
   (( segid "ATXH" and resid 11   and name HA  ))
 OR {  757}
   (( segid "ATXH" and resid 68   and name HB3 ))
   (( segid "ATXH" and resid 11   and name HA  ))
 ASSI {  758}
   (( segid "ATXH" and resid 47   and name HB  ))
   (( segid "ATXH" and resid 48   and name HA  ))
      3.900     1.900     1.900 peak   758 spectrum    1 weight  0.10000E+01 volume  0.96373E-03 ppm1      5.241 ppm2      1.882 CV     1
 OR {  758}
   (( segid "ATXH" and resid 6    and name HB3 ))
   (( segid "ATXH" and resid 48   and name HA  ))
 OR {  758}
   (( segid "ATXH" and resid 5    and name HB3 ))
   (( segid "ATXH" and resid 48   and name HA  ))
 OR {  758}
   (  segid "ATXH" and resid 4    and name HE% )
   (( segid "ATXH" and resid 48   and name HA  ))
 ASSI {  759}
   (  segid "ATXH" and resid 62   and name HG1%)
   (( segid "ATXH" and resid 30   and name HG  ))
      3.600     1.700     1.700 peak   759 spectrum    1 weight  0.10000E+01 volume  0.96022E-03 ppm1      1.852 ppm2      1.161 CV     1
 OR {  759}
   (( segid "ATXH" and resid 59   and name HG13))
   (( segid "ATXH" and resid 30   and name HG  ))
 ASSI {  761}
   (  segid "ATXH" and resid 36   and name HG2%)
   (( segid "ATXH" and resid 28   and name HE2 ))
      3.200     1.300     1.300 peak   761 spectrum    1 weight  0.10000E+01 volume  0.94361E-03 ppm1      2.949 ppm2      0.822 CV     1
 OR {  761}
   (  segid "ATXH" and resid 36   and name HG1%)
   (( segid "ATXH" and resid 28   and name HE2 ))
 OR {  761}
   (  segid "ATXH" and resid 60   and name HG2%)
   (( segid "ATXH" and resid 57   and name HE3 ))
 OR {  761}
   (  segid "ATXH" and resid 60   and name HG2%)
   (( segid "ATXH" and resid 57   and name HE2 ))
 OR {  761}
   (  segid "ATXH" and resid 33   and name HG1%)
   (( segid "ATXH" and resid 28   and name HE2 ))
 ASSI {  766}
   (( segid "ATXH" and resid 30   and name HG  ))
   (  segid "ATXH" and resid 59   and name HD1%)
      3.500     1.500     1.500 peak   766 spectrum    1 weight  0.10000E+01 volume  0.92457E-03 ppm1      0.687 ppm2      1.899 CV     1
 OR {  766}
   (( segid "ATXH" and resid 47   and name HB  ))
   (  segid "ATXH" and resid 59   and name HD1%)
 ASSI {  770}
   (( segid "ATXH" and resid 56   and name HA  ))
   (  segid "ATXH" and resid 59   and name HG2%)
      3.900     1.900     1.900 peak   770 spectrum    1 weight  0.10000E+01 volume  0.92105E-03 ppm1      0.754 ppm2      3.869 CV     1
 OR {  770}
   (( segid "ATXH" and resid 26   and name HB2 ))
   (  segid "ATXH" and resid 59   and name HG2%)
 OR {  770}
   (( segid "ATXH" and resid 57   and name HA  ))
   (  segid "ATXH" and resid 59   and name HG2%)
 ASSI {  774}
   (( segid "ATXH" and resid 7    and name HB2 ))
   (( segid "ATXH" and resid 8    and name HA  ))
      4.000     2.000     2.000 peak   774 spectrum    1 weight  0.10000E+01 volume  0.90917E-03 ppm1      4.864 ppm2      1.559 CV     1
 OR {  774}
   (( segid "ATXH" and resid 9    and name HB2 ))
   (( segid "ATXH" and resid 8    and name HA  ))
 ASSI {  775}
   (( segid "ATXH" and resid 49   and name HB  ))
   (  segid "ATXH" and resid 33   and name HG1%)
      3.800     1.800     1.800 peak   775 spectrum    1 weight  0.10000E+01 volume  0.90795E-03 ppm1      0.827 ppm2      1.590 CV     1
 OR {  775}
   (( segid "ATXH" and resid 23   and name HG13))
   (  segid "ATXH" and resid 38   and name HG2%)
 OR {  775}
   (( segid "ATXH" and resid 23   and name HG12))
   (  segid "ATXH" and resid 38   and name HG2%)
 OR {  775}
   (( segid "ATXH" and resid 34   and name HB3 ))
   (  segid "ATXH" and resid 33   and name HG1%)
 ASSI {  776}
   (( segid "ATXH" and resid 59   and name HG13))
   (( segid "ATXH" and resid 58   and name HA  ))
      4.100     2.100     1.900 peak   776 spectrum    1 weight  0.10000E+01 volume  0.89850E-03 ppm1      4.361 ppm2      1.159 CV     1
 OR {  776}
   (  segid "ATXH" and resid 62   and name HG1%)
   (( segid "ATXH" and resid 58   and name HA  ))
 OR {  776}
   (  segid "ATXH" and resid 55   and name HG2%)
   (( segid "ATXH" and resid 58   and name HA  ))
 ASSI {  778}
   (( segid "ATXH" and resid 56   and name HA  ))
   (( segid "ATXH" and resid 59   and name HA  ))
      4.000     2.000     2.000 peak   778 spectrum    1 weight  0.10000E+01 volume  0.89492E-03 ppm1      3.518 ppm2      3.852 CV     1
 OR {  778}
   (( segid "ATXH" and resid 62   and name HA  ))
   (( segid "ATXH" and resid 59   and name HA  ))
 OR {  778}
   (( segid "ATXH" and resid 57   and name HA  ))
   (( segid "ATXH" and resid 59   and name HA  ))
 ASSI {  788}
   (( segid "ATXH" and resid 29   and name HA  ))
   (( segid "ATXH" and resid 28   and name HG2 ))
      3.900     1.900     1.900 peak   788 spectrum    1 weight  0.10000E+01 volume  0.87358E-03 ppm1      1.468 ppm2      4.049 CV     1
 OR {  788}
   (( segid "ATXH" and resid 25   and name HA  ))
   (( segid "ATXH" and resid 28   and name HG2 ))
 ASSI {  796}
   (( segid "ATXH" and resid 47   and name HB  ))
   (( segid "ATXH" and resid 7    and name HB3 ))
      3.500     1.500     1.500 peak   796 spectrum    1 weight  0.10000E+01 volume  0.84151E-03 ppm1      1.400 ppm2      1.878 CV     1
 OR {  796}
   (( segid "ATXH" and resid 5    and name HB3 ))
   (( segid "ATXH" and resid 7    and name HB3 ))
 OR {  796}
   (( segid "ATXH" and resid 6    and name HB3 ))
   (( segid "ATXH" and resid 7    and name HB3 ))
 ASSI {  800}
   (( segid "ATXH" and resid 39   and name HB2 ))
   (( segid "ATXH" and resid 44   and name HA  ))
      4.000     2.000     2.000 peak   800 spectrum    1 weight  0.10000E+01 volume  0.81896E-03 ppm1      5.492 ppm2      2.278 CV     1
 OR {  800}
   (( segid "ATXH" and resid 10   and name HG2 ))
   (( segid "ATXH" and resid 44   and name HA  ))
 OR {  800}
   (( segid "ATXH" and resid 10   and name HG3 ))
   (( segid "ATXH" and resid 44   and name HA  ))
 ASSI {  804}
   (( segid "ATXH" and resid 26   and name HA  ))
   (  segid "ATXH" and resid 62   and name HG1%)
      3.200     1.300     1.300 peak   804 spectrum    1 weight  0.10000E+01 volume  0.80471E-03 ppm1      1.158 ppm2      4.190 CV     1
 OR {  804}
   (( segid "ATXH" and resid 32   and name HA2 ))
   (  segid "ATXH" and resid 54   and name HG1%)
 ASSI {  808}
   (( segid "ATXH" and resid 27   and name HB  ))
   (  segid "ATXH" and resid 27   and name HG2%)
      3.400     1.400     1.400 peak   808 spectrum    1 weight  0.10000E+01 volume  0.79762E-03 ppm1      0.833 ppm2      1.992 CV     1
 OR {  808}
   (( segid "ATXH" and resid 30   and name HB2 ))
   (  segid "ATXH" and resid 30   and name HD2%)
 ASSI {  810}
   (  segid "ATXH" and resid 54   and name HG2%)
   (( segid "ATXH" and resid 32   and name HA1 ))
      3.600     1.600     1.600 peak   810 spectrum    1 weight  0.10000E+01 volume  0.79640E-03 ppm1      3.672 ppm2      0.726 CV     1
 OR {  810}
   (  segid "ATXH" and resid 49   and name HG2%)
   (( segid "ATXH" and resid 32   and name HA1 ))
 ASSI {  813}
   (( segid "ATXH" and resid 43   and name HA2 ))
   (( segid "ATXH" and resid 39   and name HB3 ))
      4.300     2.300     1.700 peak   813 spectrum    1 weight  0.10000E+01 volume  0.78810E-03 ppm1      2.017 ppm2      4.050 CV     1
 OR {  813}
   (( segid "ATXH" and resid 41   and name HA  ))
   (( segid "ATXH" and resid 39   and name HB3 ))
 ASSI {  822}
   (( segid "ATXH" and resid 62   and name HA  ))
   (  segid "ATXH" and resid 61   and name HB% )
      3.800     1.800     1.800 peak   822 spectrum    1 weight  0.10000E+01 volume  0.76196E-03 ppm1      1.489 ppm2      3.863 CV     1
 OR {  822}
   (( segid "ATXH" and resid 57   and name HA  ))
   (  segid "ATXH" and resid 61   and name HB% )
 ASSI {  824}
   (( segid "ATXH" and resid 24   and name HB2 ))
   (( segid "ATXH" and resid 21   and name HA  ))
      3.800     1.800     1.800 peak   824 spectrum    1 weight  0.10000E+01 volume  0.76082E-03 ppm1      4.439 ppm2      2.092 CV     1
 OR {  824}
   (( segid "ATXH" and resid 34   and name HG3 ))
   (( segid "ATXH" and resid 34   and name HA  ))
 ASSI {  827}
   (  segid "ATXH" and resid 45   and name HG1%)
   (( segid "ATXH" and resid 44   and name HB  ))
      3.400     1.400     1.400 peak   827 spectrum    1 weight  0.10000E+01 volume  0.74772E-03 ppm1      3.959 ppm2      0.779 CV     1
 OR {  827}
   (  segid "ATXH" and resid 47   and name HG2%)
   (( segid "ATXH" and resid 44   and name HB  ))
 OR {  827}
   (  segid "ATXH" and resid 38   and name HG2%)
   (( segid "ATXH" and resid 44   and name HB  ))
 OR {  827}
   (  segid "ATXH" and resid 7    and name HD1%)
   (( segid "ATXH" and resid 44   and name HB  ))
 ASSI {  829}
   (( segid "ATXH" and resid 52   and name HB3 ))
   (  segid "ATXH" and resid 53   and name HG2%)
      3.600     1.600     1.600 peak   829 spectrum    1 weight  0.10000E+01 volume  0.74657E-03 ppm1      0.841 ppm2      3.849 CV     1
 OR {  829}
   (( segid "ATXH" and resid 57   and name HA  ))
   (  segid "ATXH" and resid 60   and name HG2%)
 OR {  829}
   (( segid "ATXH" and resid 56   and name HA  ))
   (  segid "ATXH" and resid 60   and name HG2%)
 ASSI {  837}
   (  segid "ATXH" and resid 47   and name HG1%)
   (( segid "ATXH" and resid 46   and name HA  ))
      4.200     2.200     1.800 peak   837 spectrum    1 weight  0.10000E+01 volume  0.71807E-03 ppm1      5.254 ppm2      0.876 CV     1
 OR {  837}
   (  segid "ATXH" and resid 44   and name HG2%)
   (( segid "ATXH" and resid 46   and name HA  ))
 OR {  837}
   (  segid "ATXH" and resid 7    and name HD2%)
   (( segid "ATXH" and resid 46   and name HA  ))
 OR {  837}
   (  segid "ATXH" and resid 36   and name HG2%)
   (( segid "ATXH" and resid 46   and name HA  ))
 OR {  837}
   (  segid "ATXH" and resid 27   and name HG1%)
   (( segid "ATXH" and resid 46   and name HA  ))
 ASSI {  838}
   (  segid "ATXH" and resid 70   and name HG2%)
   (( segid "ATXH" and resid 9    and name HB3 ))
      3.300     1.400     1.400 peak   838 spectrum    1 weight  0.10000E+01 volume  0.71571E-03 ppm1      1.251 ppm2      0.949 CV     1
 OR {  838}
   (  segid "ATXH" and resid 70   and name HG1%)
   (( segid "ATXH" and resid 9    and name HB3 ))
 OR {  838}
   (  segid "ATXH" and resid 60   and name HG1%)
   (( segid "ATXH" and resid 9    and name HB3 ))
 OR {  838}
   (  segid "ATXH" and resid 44   and name HG2%)
   (( segid "ATXH" and resid 9    and name HB3 ))
 ASSI {  844}
   (( segid "ATXH" and resid 10   and name HB2 ))
   (( segid "ATXH" and resid 44   and name HB  ))
      4.200     2.200     1.800 peak   844 spectrum    1 weight  0.10000E+01 volume  0.69673E-03 ppm1      3.971 ppm2      2.173 CV     1
 OR {  844}
   (( segid "ATXH" and resid 39   and name HG2 ))
   (( segid "ATXH" and resid 44   and name HB  ))
 ASSI {  845}
   (  segid "ATXH" and resid 33   and name HG1%)
   (( segid "ATXH" and resid 59   and name HG13))
      3.900     1.900     1.900 peak   845 spectrum    1 weight  0.10000E+01 volume  0.69673E-03 ppm1      1.110 ppm2      0.876 CV     1
 OR {  845}
   (  segid "ATXH" and resid 27   and name HG2%)
   (( segid "ATXH" and resid 59   and name HG13))
 OR {  845}
   (  segid "ATXH" and resid 30   and name HD1%)
   (( segid "ATXH" and resid 59   and name HG13))
 OR {  845}
   (  segid "ATXH" and resid 27   and name HG1%)
   (( segid "ATXH" and resid 59   and name HG13))
 OR {  845}
   (  segid "ATXH" and resid 47   and name HG1%)
   (( segid "ATXH" and resid 59   and name HG13))
 OR {  845}
   (( segid "ATXH" and resid 49   and name HG12))
   (( segid "ATXH" and resid 59   and name HG13))
 ASSI {  849}
   (( segid "ATXH" and resid 66   and name HB2 ))
   (  segid "ATXH" and resid 63   and name HG2%)
      3.700     1.700     1.700 peak   849 spectrum    1 weight  0.10000E+01 volume  0.69079E-03 ppm1      0.778 ppm2      2.459 CV     1
 OR {  849}
   (( segid "ATXH" and resid 64   and name HG3 ))
   (  segid "ATXH" and resid 63   and name HG2%)
 OR {  849}
   (( segid "ATXH" and resid 66   and name HG2 ))
   (  segid "ATXH" and resid 63   and name HG2%)
 OR {  849}
   (( segid "ATXH" and resid 66   and name HG3 ))
   (  segid "ATXH" and resid 63   and name HG2%)
 ASSI {  854}
   (( segid "ATXH" and resid 33   and name HA  ))
   (  segid "ATXH" and resid 47   and name HG1%)
      4.000     2.000     2.000 peak   854 spectrum    1 weight  0.10000E+01 volume  0.66348E-03 ppm1      0.880 ppm2      4.076 CV     1
 OR {  854}
   (( segid "ATXH" and resid 29   and name HA  ))
   (  segid "ATXH" and resid 30   and name HD2%)
 ASSI {  861}
   (  segid "ATXH" and resid 40   and name HD1%)
   (( segid "ATXH" and resid 14   and name HB2 ))
      3.500     1.600     1.600 peak   861 spectrum    1 weight  0.10000E+01 volume  0.64567E-03 ppm1      2.274 ppm2      0.809 CV     1
 OR {  861}
   (  segid "ATXH" and resid 40   and name HD2%)
   (( segid "ATXH" and resid 14   and name HB2 ))
 OR {  861}
   (  segid "ATXH" and resid 36   and name HG1%)
   (( segid "ATXH" and resid 35   and name HG2 ))
 OR {  861}
   (  segid "ATXH" and resid 36   and name HG2%)
   (( segid "ATXH" and resid 35   and name HG2 ))
 OR {  861}
   (  segid "ATXH" and resid 47   and name HG2%)
   (( segid "ATXH" and resid 35   and name HG2 ))
 OR {  861}
   (  segid "ATXH" and resid 33   and name HG1%)
   (( segid "ATXH" and resid 35   and name HG2 ))
 ASSI {  863}
   (  segid "ATXH" and resid 48   and name HG2%)
   (( segid "ATXH" and resid 49   and name HA  ))
      3.900     1.900     1.900 peak   863 spectrum    1 weight  0.10000E+01 volume  0.63618E-03 ppm1      5.309 ppm2      1.110 CV     1
 OR {  863}
   (  segid "ATXH" and resid 54   and name HG1%)
   (( segid "ATXH" and resid 49   and name HA  ))
 ASSI {  866}
   (( segid "ATXH" and resid 38   and name HB  ))
   (  segid "ATXH" and resid 23   and name HD1%)
      4.000     2.000     2.000 peak   866 spectrum    1 weight  0.10000E+01 volume  0.62787E-03 ppm1      0.148 ppm2      2.008 CV     1
 OR {  866}
   (( segid "ATXH" and resid 14   and name HG2 ))
   (  segid "ATXH" and resid 23   and name HD1%)
 OR {  866}
   (( segid "ATXH" and resid 27   and name HB  ))
   (  segid "ATXH" and resid 23   and name HD1%)
 OR {  866}
   (( segid "ATXH" and resid 14   and name HG3 ))
   (  segid "ATXH" and resid 23   and name HD1%)
 OR {  866}
   (( segid "ATXH" and resid 24   and name HB2 ))
   (  segid "ATXH" and resid 23   and name HD1%)
 ASSI {  868}
   (( segid "ATXH" and resid 49   and name HG12))
   (( segid "ATXH" and resid 4    and name HA  ))
      4.100     2.100     1.900 peak   868 spectrum    1 weight  0.10000E+01 volume  0.62668E-03 ppm1      5.194 ppm2      0.846 CV     1
 OR {  868}
   (( segid "ATXH" and resid 7    and name HG  ))
   (( segid "ATXH" and resid 6    and name HA  ))
 OR {  868}
   (  segid "ATXH" and resid 7    and name HD1%)
   (( segid "ATXH" and resid 6    and name HA  ))
 OR {  868}
   (  segid "ATXH" and resid 7    and name HD2%)
   (( segid "ATXH" and resid 6    and name HA  ))
 OR {  868}
   (  segid "ATXH" and resid 47   and name HG1%)
   (( segid "ATXH" and resid 6    and name HA  ))
 ASSI {  872}
   (  segid "ATXH" and resid 11   and name HG2%)
   (( segid "ATXH" and resid 10   and name HG3 ))
      4.100     2.100     1.900 peak   872 spectrum    1 weight  0.10000E+01 volume  0.61600E-03 ppm1      2.264 ppm2      0.659 CV     1
 OR {  872}
   (( segid "ATXH" and resid 9    and name HG  ))
   (( segid "ATXH" and resid 10   and name HG2 ))
 OR {  872}
   (  segid "ATXH" and resid 11   and name HG2%)
   (( segid "ATXH" and resid 10   and name HG2 ))
 OR {  872}
   (  segid "ATXH" and resid 11   and name HG1%)
   (( segid "ATXH" and resid 10   and name HG3 ))
 OR {  872}
   (  segid "ATXH" and resid 9    and name HD2%)
   (( segid "ATXH" and resid 10   and name HG2 ))
 OR {  872}
   (( segid "ATXH" and resid 9    and name HG  ))
   (( segid "ATXH" and resid 10   and name HG3 ))
 OR {  872}
   (  segid "ATXH" and resid 9    and name HD1%)
   (( segid "ATXH" and resid 10   and name HG2 ))
 OR {  872}
   (  segid "ATXH" and resid 9    and name HD1%)
   (( segid "ATXH" and resid 10   and name HG3 ))
 ASSI {  873}
   (( segid "ATXH" and resid 59   and name HB  ))
   (  segid "ATXH" and resid 9    and name HD1%)
      3.700     1.700     1.700 peak   873 spectrum    1 weight  0.10000E+01 volume  0.61481E-03 ppm1      0.635 ppm2      2.011 CV     1
 OR {  873}
   (( segid "ATXH" and resid 70   and name HB  ))
   (  segid "ATXH" and resid 9    and name HD1%)
 OR {  873}
   (( segid "ATXH" and resid 27   and name HB  ))
   (  segid "ATXH" and resid 9    and name HD1%)
 OR {  873}
   (( segid "ATXH" and resid 60   and name HB  ))
   (  segid "ATXH" and resid 9    and name HD1%)
 OR {  873}
   (( segid "ATXH" and resid 46   and name HB2 ))
   (  segid "ATXH" and resid 9    and name HD1%)
 ASSI {  874}
   (( segid "ATXH" and resid 52   and name HB3 ))
   (  segid "ATXH" and resid 3    and name HB% )
      3.900     1.900     1.900 peak   874 spectrum    1 weight  0.10000E+01 volume  0.61125E-03 ppm1      1.360 ppm2      3.834 CV     1
 OR {  874}
   (( segid "ATXH" and resid 51   and name HB3 ))
   (  segid "ATXH" and resid 3    and name HB% )
 ASSI {  879}
   (  segid "ATXH" and resid 61   and name HB% )
   (  segid "ATXH" and resid 60   and name HG2%)
      4.300     2.300     1.700 peak   879 spectrum    1 weight  0.10000E+01 volume  0.60532E-03 ppm1      0.841 ppm2      1.477 CV     1
 OR {  879}
   (( segid "ATXH" and resid 57   and name HG2 ))
   (  segid "ATXH" and resid 60   and name HG2%)
 OR {  879}
   (( segid "ATXH" and resid 59   and name HG12))
   (  segid "ATXH" and resid 60   and name HG2%)
 ASSI {  881}
   (  segid "ATXH" and resid 45   and name HG2%)
   (( segid "ATXH" and resid 46   and name HA  ))
      4.000     2.000     2.000 peak   881 spectrum    1 weight  0.10000E+01 volume  0.60176E-03 ppm1      5.258 ppm2      0.601 CV     1
 OR {  881}
   (  segid "ATXH" and resid 9    and name HD1%)
   (( segid "ATXH" and resid 46   and name HA  ))
 OR {  881}
   (( segid "ATXH" and resid 9    and name HG  ))
   (( segid "ATXH" and resid 46   and name HA  ))
 ASSI {  883}
   (( segid "ATXH" and resid 58   and name HB3 ))
   (  segid "ATXH" and resid 54   and name HG1%)
      4.200     2.200     1.800 peak   883 spectrum    1 weight  0.10000E+01 volume  0.59108E-03 ppm1      1.153 ppm2      2.590 CV     1
 OR {  883}
   (( segid "ATXH" and resid 31   and name HB3 ))
   (  segid "ATXH" and resid 54   and name HG1%)
 ASSI {  895}
   (  segid "ATXH" and resid 45   and name HG1%)
   (( segid "ATXH" and resid 39   and name HA  ))
      3.600     1.700     1.700 peak   895 spectrum    1 weight  0.10000E+01 volume  0.55309E-03 ppm1      4.739 ppm2      0.704 CV     1
 OR {  895}
   (  segid "ATXH" and resid 11   and name HG2%)
   (( segid "ATXH" and resid 39   and name HA  ))
 ASSI {  903}
   (  segid "ATXH" and resid 60   and name HG2%)
   (( segid "ATXH" and resid 64   and name HG3 ))
      4.000     2.000     2.000 peak   903 spectrum    1 weight  0.10000E+01 volume  0.52817E-03 ppm1      2.467 ppm2      0.841 CV     1
 OR {  903}
   (  segid "ATXH" and resid 63   and name HG2%)
   (( segid "ATXH" and resid 64   and name HG3 ))
 ASSI {  904}
   (  segid "ATXH" and resid 59   and name HG2%)
   (( segid "ATXH" and resid 63   and name HG13))
      3.900     1.900     1.900 peak   904 spectrum    1 weight  0.10000E+01 volume  0.52342E-03 ppm1      0.571 ppm2      0.758 CV     1
 OR {  904}
   (  segid "ATXH" and resid 63   and name HG2%)
   (( segid "ATXH" and resid 63   and name HG13))
 ASSI {  906}
   (( segid "ATXH" and resid 28   and name HD2 ))
   (  segid "ATXH" and resid 36   and name HG1%)
      4.000     2.000     2.000 peak   906 spectrum    1 weight  0.10000E+01 volume  0.52223E-03 ppm1      0.751 ppm2      1.639 CV     1
 OR {  906}
   (( segid "ATXH" and resid 23   and name HG13))
   (  segid "ATXH" and resid 36   and name HG1%)
 OR {  906}
   (( segid "ATXH" and resid 37   and name HB3 ))
   (  segid "ATXH" and resid 36   and name HG1%)
 OR {  906}
   (( segid "ATXH" and resid 23   and name HG12))
   (  segid "ATXH" and resid 36   and name HG1%)
 ASSI {  908}
   (  segid "ATXH" and resid 47   and name HG2%)
   (( segid "ATXH" and resid 46   and name HA  ))
      4.000     2.000     2.000 peak   908 spectrum    1 weight  0.10000E+01 volume  0.51867E-03 ppm1      5.254 ppm2      0.797 CV     1
 OR {  908}
   (  segid "ATXH" and resid 45   and name HG1%)
   (( segid "ATXH" and resid 46   and name HA  ))
 ASSI {  914}
   (( segid "ATXH" and resid 57   and name HG3 ))
   (  segid "ATXH" and resid 60   and name HG2%)
      4.200     2.200     1.800 peak   914 spectrum    1 weight  0.10000E+01 volume  0.49493E-03 ppm1      0.805 ppm2      1.400 CV     1
 OR {  914}
   (( segid "ATXH" and resid 7    and name HB3 ))
   (  segid "ATXH" and resid 47   and name HG2%)
 OR {  914}
   (( segid "ATXH" and resid 57   and name HG2 ))
   (  segid "ATXH" and resid 60   and name HG2%)
 OR {  914}
   (  segid "ATXH" and resid 3    and name HB% )
   (  segid "ATXH" and resid 53   and name HG2%)
 ASSI {  919}
   (  segid "ATXH" and resid 47   and name HG1%)
   (( segid "ATXH" and resid 48   and name HA  ))
      4.200     2.200     1.800 peak   919 spectrum    1 weight  0.10000E+01 volume  0.48544E-03 ppm1      5.235 ppm2      0.868 CV     1
 OR {  919}
   (( segid "ATXH" and resid 49   and name HG12))
   (( segid "ATXH" and resid 48   and name HA  ))
 ASSI {  925}
   (( segid "ATXH" and resid 33   and name HB  ))
   (( segid "ATXH" and resid 49   and name HA  ))
      4.600     2.600     1.400 peak   925 spectrum    1 weight  0.10000E+01 volume  0.46764E-03 ppm1      5.307 ppm2      2.231 CV     1
 OR {  925}
   (( segid "ATXH" and resid 34   and name HG2 ))
   (( segid "ATXH" and resid 49   and name HA  ))
 ASSI {  927}
   (( segid "ATXH" and resid 7    and name HB2 ))
   (( segid "ATXH" and resid 46   and name HA  ))
      4.300     2.300     1.700 peak   927 spectrum    1 weight  0.10000E+01 volume  0.46407E-03 ppm1      5.256 ppm2      1.598 CV     1
 OR {  927}
   (( segid "ATXH" and resid 37   and name HB3 ))
   (( segid "ATXH" and resid 46   and name HA  ))
 OR {  927}
   (( segid "ATXH" and resid 9    and name HB2 ))
   (( segid "ATXH" and resid 46   and name HA  ))
 OR {  927}
   (( segid "ATXH" and resid 37   and name HD2 ))
   (( segid "ATXH" and resid 46   and name HA  ))
 ASSI {  928}
   (( segid "ATXH" and resid 30   and name HB2 ))
   (  segid "ATXH" and resid 54   and name HG1%)
      4.500     2.500     1.500 peak   928 spectrum    1 weight  0.10000E+01 volume  0.46289E-03 ppm1      1.149 ppm2      1.991 CV     1
 OR {  928}
   (( segid "ATXH" and resid 53   and name HB  ))
   (  segid "ATXH" and resid 54   and name HG1%)
 ASSI {  929}
   (( segid "ATXH" and resid 20   and name HA  ))
   (  segid "ATXH" and resid 38   and name HG2%)
      3.800     1.800     1.800 peak   929 spectrum    1 weight  0.10000E+01 volume  0.46051E-03 ppm1      0.821 ppm2      3.535 CV     1
 OR {  929}
   (( segid "ATXH" and resid 24   and name HA  ))
   (  segid "ATXH" and resid 38   and name HG2%)
 ASSI {  932}
   (( segid "ATXH" and resid 70   and name HB  ))
   (( segid "ATXH" and resid 11   and name HA  ))
      4.200     2.200     1.800 peak   932 spectrum    1 weight  0.10000E+01 volume  0.45458E-03 ppm1      4.765 ppm2      2.100 CV     1
 OR {  932}
   (( segid "ATXH" and resid 12   and name HB2 ))
   (( segid "ATXH" and resid 11   and name HA  ))
 OR {  932}
   (( segid "ATXH" and resid 10   and name HB2 ))
   (( segid "ATXH" and resid 11   and name HA  ))
 ASSI {  935}
   (( segid "ATXH" and resid 59   and name HA  ))
   (  segid "ATXH" and resid 27   and name HG2%)
      4.200     2.200     1.800 peak   935 spectrum    1 weight  0.10000E+01 volume  0.44153E-03 ppm1      0.834 ppm2      3.501 CV     1
 OR {  935}
   (( segid "ATXH" and resid 59   and name HA  ))
   (  segid "ATXH" and resid 30   and name HD2%)
 OR {  935}
   (( segid "ATXH" and resid 24   and name HA  ))
   (  segid "ATXH" and resid 27   and name HG2%)
 OR {  935}
   (( segid "ATXH" and resid 63   and name HA  ))
   (  segid "ATXH" and resid 27   and name HG2%)
 ASSI {  936}
   (( segid "ATXH" and resid 49   and name HG12))
   (  segid "ATXH" and resid 4    and name HE% )
      4.200     2.200     1.800 peak   936 spectrum    1 weight  0.10000E+01 volume  0.43559E-03 ppm1      1.915 ppm2      0.813 CV     1
 OR {  936}
   (  segid "ATXH" and resid 53   and name HG2%)
   (  segid "ATXH" and resid 4    and name HE% )
 OR {  936}
   (  segid "ATXH" and resid 33   and name HG1%)
   (  segid "ATXH" and resid 4    and name HE% )
 OR {  936}
   (  segid "ATXH" and resid 47   and name HG2%)
   (  segid "ATXH" and resid 4    and name HE% )
 ASSI {  938}
   (( segid "ATXH" and resid 5    and name HA  ))
   (  segid "ATXH" and resid 48   and name HG2%)
      4.200     2.200     1.800 peak   938 spectrum    1 weight  0.10000E+01 volume  0.43203E-03 ppm1      1.106 ppm2      4.627 CV     1
 OR {  938}
   (( segid "ATXH" and resid 35   and name HA  ))
   (  segid "ATXH" and resid 48   and name HG2%)
 ASSI {  943}
   (  segid "ATXH" and resid 23   and name HD1%)
   (( segid "ATXH" and resid 63   and name HA  ))
      4.600     2.700     1.400 peak   943 spectrum    1 weight  0.10000E+01 volume  0.41660E-03 ppm1      3.526 ppm2      0.145 CV     1
 OR {  943}
   (  segid "ATXH" and resid 23   and name HD1%)
   (( segid "ATXH" and resid 20   and name HA  ))
 ASSI {  947}
   (  segid "ATXH" and resid 59   and name HD1%)
   (( segid "ATXH" and resid 30   and name HB2 ))
      4.100     2.100     1.900 peak   947 spectrum    1 weight  0.10000E+01 volume  0.40948E-03 ppm1      1.962 ppm2      0.734 CV     1
 OR {  947}
   (  segid "ATXH" and resid 54   and name HG2%)
   (( segid "ATXH" and resid 30   and name HB2 ))
 OR {  947}
   (  segid "ATXH" and resid 49   and name HG2%)
   (( segid "ATXH" and resid 30   and name HB2 ))
 ASSI {  951}
   (( segid "ATXH" and resid 49   and name HG12))
   (( segid "ATXH" and resid 51   and name HB3 ))
      4.000     2.000     2.000 peak   951 spectrum    1 weight  0.10000E+01 volume  0.39880E-03 ppm1      3.813 ppm2      0.860 CV     1
 OR {  951}
   (  segid "ATXH" and resid 56   and name HD2%)
   (( segid "ATXH" and resid 51   and name HB3 ))
 OR {  951}
   (  segid "ATXH" and resid 56   and name HD1%)
   (( segid "ATXH" and resid 51   and name HB3 ))
 ASSI {  952}
   (( segid "ATXH" and resid 11   and name HA  ))
   (  segid "ATXH" and resid 14   and name HE% )
      4.600     2.700     1.400 peak   952 spectrum    1 weight  0.10000E+01 volume  0.39405E-03 ppm1      1.755 ppm2      4.747 CV     1
 OR {  952}
   (( segid "ATXH" and resid 39   and name HA  ))
   (  segid "ATXH" and resid 14   and name HE% )
 ASSI {  954}
   (  segid "ATXH" and resid 56   and name HD2%)
   (( segid "ATXH" and resid 55   and name HA  ))
      4.200     2.200     1.800 peak   954 spectrum    1 weight  0.10000E+01 volume  0.39168E-03 ppm1      4.810 ppm2      0.846 CV     1
 OR {  954}
   (( segid "ATXH" and resid 56   and name HG  ))
   (( segid "ATXH" and resid 55   and name HA  ))
 OR {  954}
   (  segid "ATXH" and resid 56   and name HD1%)
   (( segid "ATXH" and resid 55   and name HA  ))
 OR {  954}
   (( segid "ATXH" and resid 49   and name HG12))
   (( segid "ATXH" and resid 55   and name HA  ))
 ASSI {  960}
   (( segid "ATXH" and resid 49   and name HG12))
   (( segid "ATXH" and resid 50   and name HA  ))
      4.200     2.200     1.800 peak   960 spectrum    1 weight  0.10000E+01 volume  0.37981E-03 ppm1      5.023 ppm2      0.824 CV     1
 OR {  960}
   (  segid "ATXH" and resid 53   and name HG2%)
   (( segid "ATXH" and resid 50   and name HA  ))
 OR {  960}
   (  segid "ATXH" and resid 33   and name HG1%)
   (( segid "ATXH" and resid 50   and name HA  ))
 ASSI {  961}
   (( segid "ATXH" and resid 59   and name HB  ))
   (  segid "ATXH" and resid 63   and name HD1%)
      4.600     2.600     1.400 peak   961 spectrum    1 weight  0.10000E+01 volume  0.37268E-03 ppm1      0.561 ppm2      2.022 CV     1
 OR {  961}
   (( segid "ATXH" and resid 27   and name HB  ))
   (  segid "ATXH" and resid 63   and name HD1%)
 OR {  961}
   (( segid "ATXH" and resid 60   and name HB  ))
   (  segid "ATXH" and resid 63   and name HD1%)
 ASSI {  963}
   (  segid "ATXH" and resid 62   and name HG2%)
   (( segid "ATXH" and resid 58   and name HA  ))
      4.200     2.300     1.800 peak   963 spectrum    1 weight  0.10000E+01 volume  0.35132E-03 ppm1      4.361 ppm2      0.856 CV     1
 OR {  963}
   (  segid "ATXH" and resid 30   and name HD1%)
   (( segid "ATXH" and resid 58   and name HA  ))
 OR {  963}
   (  segid "ATXH" and resid 60   and name HG2%)
   (( segid "ATXH" and resid 58   and name HA  ))
 ASSI {  964}
   (( segid "ATXH" and resid 23   and name HG13))
   (( segid "ATXH" and resid 25   and name HA  ))
      4.400     2.400     1.600 peak   964 spectrum    1 weight  0.10000E+01 volume  0.35014E-03 ppm1      4.049 ppm2      1.575 CV     1
 OR {  964}
   (  segid "ATXH" and resid 22   and name HB% )
   (( segid "ATXH" and resid 25   and name HA  ))
 OR {  964}
   (( segid "ATXH" and resid 23   and name HG12))
   (( segid "ATXH" and resid 25   and name HA  ))
 ASSI {  965}
   (( segid "ATXH" and resid 37   and name HB3 ))
   (( segid "ATXH" and resid 38   and name HA  ))
      4.300     2.300     1.700 peak   965 spectrum    1 weight  0.10000E+01 volume  0.35014E-03 ppm1      4.307 ppm2      1.607 CV     1
 OR {  965}
   (( segid "ATXH" and resid 23   and name HG13))
   (( segid "ATXH" and resid 38   and name HA  ))
 OR {  965}
   (( segid "ATXH" and resid 23   and name HG12))
   (( segid "ATXH" and resid 38   and name HA  ))
 ASSI {  966}
   (  segid "ATXH" and resid 30   and name HD2%)
   (( segid "ATXH" and resid 29   and name HA  ))
      3.700     1.700     1.700 peak   966 spectrum    1 weight  0.10000E+01 volume  0.35014E-03 ppm1      4.052 ppm2      0.850 CV     1
 OR {  966}
   (  segid "ATXH" and resid 33   and name HG1%)
   (( segid "ATXH" and resid 29   and name HA  ))
 OR {  966}
   (  segid "ATXH" and resid 27   and name HG2%)
   (( segid "ATXH" and resid 29   and name HA  ))
 OR {  966}
   (  segid "ATXH" and resid 27   and name HG1%)
   (( segid "ATXH" and resid 29   and name HA  ))
 ASSI {  973}
   (( segid "ATXH" and resid 70   and name HB  ))
   (  segid "ATXH" and resid 9    and name HD2%)
      4.100     2.100     1.900 peak   973 spectrum    1 weight  0.10000E+01 volume  0.33471E-03 ppm1      0.704 ppm2      2.020 CV     1
 OR {  973}
   (( segid "ATXH" and resid 59   and name HB  ))
   (  segid "ATXH" and resid 9    and name HD2%)
 OR {  973}
   (( segid "ATXH" and resid 27   and name HB  ))
   (  segid "ATXH" and resid 9    and name HD2%)
 OR {  973}
   (( segid "ATXH" and resid 60   and name HB  ))
   (  segid "ATXH" and resid 9    and name HD2%)
 OR {  973}
   (( segid "ATXH" and resid 46   and name HB2 ))
   (  segid "ATXH" and resid 9    and name HD2%)
 ASSI {  975}
   (( segid "ATXH" and resid 4    and name HA  ))
   (( segid "ATXH" and resid 5    and name HB2 ))
      4.600     2.600     1.400 peak   975 spectrum    1 weight  0.10000E+01 volume  0.32521E-03 ppm1      1.999 ppm2      5.180 CV     1
 OR {  975}
   (( segid "ATXH" and resid 48   and name HA  ))
   (( segid "ATXH" and resid 5    and name HB2 ))
 ASSI {  977}
   (( segid "ATXH" and resid 11   and name HB  ))
   (( segid "ATXH" and resid 44   and name HA  ))
      4.400     2.400     1.600 peak   977 spectrum    1 weight  0.10000E+01 volume  0.32046E-03 ppm1      5.493 ppm2      1.768 CV     1
 OR {  977}
   (( segid "ATXH" and resid 45   and name HB  ))
   (( segid "ATXH" and resid 44   and name HA  ))
 ASSI {  979}
   (( segid "ATXH" and resid 66   and name HG2 ))
   (( segid "ATXH" and resid 26   and name HA  ))
      3.600     1.600     1.600 peak   979 spectrum    1 weight  0.10000E+01 volume  0.31096E-03 ppm1      4.153 ppm2      2.476 CV     1
 OR {  979}
   (( segid "ATXH" and resid 66   and name HG3 ))
   (( segid "ATXH" and resid 26   and name HA  ))
 OR {  979}
   (( segid "ATXH" and resid 29   and name HG2 ))
   (( segid "ATXH" and resid 26   and name HA  ))
 ASSI {  980}
   (( segid "ATXH" and resid 10   and name HB2 ))
   (( segid "ATXH" and resid 44   and name HA  ))
      5.000     3.100     1.000 peak   980 spectrum    1 weight  0.10000E+01 volume  0.30504E-03 ppm1      5.493 ppm2      2.092 CV     1
 OR {  980}
   (( segid "ATXH" and resid 42   and name HB2 ))
   (( segid "ATXH" and resid 44   and name HA  ))
 ASSI {  981}
   (( segid "ATXH" and resid 4    and name HA  ))
   (( segid "ATXH" and resid 5    and name HB3 ))
      4.700     2.800     1.300 peak   981 spectrum    1 weight  0.10000E+01 volume  0.30385E-03 ppm1      1.826 ppm2      5.200 CV     1
 OR {  981}
   (( segid "ATXH" and resid 6    and name HA  ))
   (( segid "ATXH" and resid 5    and name HB3 ))
 ASSI {  985}
   (( segid "ATXH" and resid 58   and name HA  ))
   (  segid "ATXH" and resid 54   and name HG1%)
      4.800     2.800     1.200 peak   985 spectrum    1 weight  0.10000E+01 volume  0.28961E-03 ppm1      1.161 ppm2      4.358 CV     1
 OR {  985}
   (( segid "ATXH" and resid 58   and name HA  ))
   (  segid "ATXH" and resid 62   and name HG1%)
 OR {  985}
   (( segid "ATXH" and resid 34   and name HA  ))
   (  segid "ATXH" and resid 54   and name HG1%)
 ASSI {  995}
   (( segid "ATXH" and resid 63   and name HA  ))
   (  segid "ATXH" and resid 23   and name HD1%)
      5.000     3.100     1.000 peak   995 spectrum    1 weight  0.10000E+01 volume  0.25993E-03 ppm1      0.146 ppm2      3.528 CV     1
 OR {  995}
   (( segid "ATXH" and resid 24   and name HA  ))
   (  segid "ATXH" and resid 23   and name HD1%)
 OR {  995}
   (( segid "ATXH" and resid 20   and name HA  ))
   (  segid "ATXH" and resid 23   and name HD1%)
 ASSI { 1000}
   (( segid "ATXH" and resid 45   and name HB  ))
   (( segid "ATXH" and resid 38   and name HA  ))
      5.100     3.200     0.900 peak  1000 spectrum    1 weight  0.10000E+01 volume  0.22907E-03 ppm1      4.302 ppm2      1.739 CV     1
 OR { 1000}
   (( segid "ATXH" and resid 37   and name HB2 ))
   (( segid "ATXH" and resid 38   and name HA  ))
 ASSI { 1004}
   (( segid "ATXH" and resid 4    and name HB3 ))
   (( segid "ATXH" and resid 50   and name HA  ))
      5.100     3.300     0.900 peak  1004 spectrum    1 weight  0.10000E+01 volume  0.21483E-03 ppm1      5.034 ppm2      1.799 CV     1
 OR { 1004}
   (( segid "ATXH" and resid 5    and name HB3 ))
   (( segid "ATXH" and resid 50   and name HA  ))
 ASSI { 1005}
   (( segid "ATXH" and resid 10   and name HB3 ))
   (( segid "ATXH" and resid 44   and name HB  ))
      4.800     2.900     1.200 peak  1005 spectrum    1 weight  0.10000E+01 volume  0.21364E-03 ppm1      3.956 ppm2      1.917 CV     1
 OR { 1005}
   (( segid "ATXH" and resid 42   and name HB3 ))
   (( segid "ATXH" and resid 44   and name HB  ))
 ASSI { 1007}
   (  segid "ATXH" and resid 59   and name HD1%)
   (( segid "ATXH" and resid 30   and name HA  ))
      4.200     2.200     1.800 peak  1007 spectrum    1 weight  0.10000E+01 volume  0.20770E-03 ppm1      4.179 ppm2      0.725 CV     1
 OR { 1007}
   (  segid "ATXH" and resid 54   and name HG2%)
   (( segid "ATXH" and resid 30   and name HA  ))
 OR { 1007}
   (  segid "ATXH" and resid 63   and name HG2%)
   (( segid "ATXH" and resid 61   and name HA  ))
 OR { 1007}
   (  segid "ATXH" and resid 59   and name HG2%)
   (( segid "ATXH" and resid 30   and name HA  ))
 OR { 1007}
   (  segid "ATXH" and resid 59   and name HG2%)
   (( segid "ATXH" and resid 61   and name HA  ))
 ASSI { 1008}
   (( segid "ATXH" and resid 39   and name HG3 ))
   (( segid "ATXH" and resid 45   and name HA  ))
      4.900     3.000     1.100 peak  1008 spectrum    1 weight  0.10000E+01 volume  0.20296E-03 ppm1      4.464 ppm2      2.067 CV     1
 OR { 1008}
   (( segid "ATXH" and resid 38   and name HB  ))
   (( segid "ATXH" and resid 45   and name HA  ))
 OR { 1008}
   (( segid "ATXH" and resid 39   and name HB3 ))
   (( segid "ATXH" and resid 45   and name HA  ))
 OR { 1008}
   (( segid "ATXH" and resid 46   and name HG3 ))
   (( segid "ATXH" and resid 45   and name HA  ))
 ASSI { 1010}
   (  segid "ATXH" and resid 68   and name HE% )
   (( segid "ATXH" and resid 23   and name HG12))
      4.000     2.000     2.000 peak  1010 spectrum    1 weight  0.10000E+01 volume  0.20059E-03 ppm1      1.625 ppm2      6.876 CV     1
 OR { 1010}
   (  segid "ATXH" and resid 68   and name HE% )
   (( segid "ATXH" and resid 23   and name HG13))
 OR { 1010}
   (( segid "ATXH" and resid 29   and name HN  ))
   (( segid "ATXH" and resid 23   and name HG12))
 ASSI { 1014}
   (( segid "ATXH" and resid 38   and name HB  ))
   (  segid "ATXH" and resid 23   and name HG2%)
      4.600     2.700     1.400 peak  1014 spectrum    1 weight  0.10000E+01 volume  0.18397E-03 ppm1      0.565 ppm2      2.031 CV     1
 OR { 1014}
   (( segid "ATXH" and resid 24   and name HB2 ))
   (  segid "ATXH" and resid 23   and name HG2%)
 ASSI { 1022}
   (( segid "ATXH" and resid 36   and name HB  ))
   (  segid "ATXH" and resid 36   and name HG2%)
      4.500     2.500     1.500 peak  1022 spectrum    1 weight  0.10000E+01 volume  0.14717E-03 ppm1      0.872 ppm2      1.896 CV     1
 OR { 1022}
   (( segid "ATXH" and resid 28   and name HB2 ))
   (  segid "ATXH" and resid 36   and name HG2%)
 ASSI { 1024}
   (( segid "ATXH" and resid 49   and name HB  ))
   (  segid "ATXH" and resid 54   and name HG2%)
      4.600     2.700     1.400 peak  1024 spectrum    1 weight  0.10000E+01 volume  0.14243E-03 ppm1      0.726 ppm2      1.557 CV     1
 OR { 1024}
   (( segid "ATXH" and resid 59   and name HG12))
   (  segid "ATXH" and resid 54   and name HG2%)
 ASSI { 1029}
   (( segid "ATXH" and resid 49   and name HB  ))
   (( segid "ATXH" and resid 51   and name HA  ))
      5.300     3.500     0.700 peak  1029 spectrum    1 weight  0.10000E+01 volume  0.12344E-03 ppm1      4.942 ppm2      1.571 CV     1
 OR { 1029}
   (( segid "ATXH" and resid 37   and name HB3 ))
   (( segid "ATXH" and resid 36   and name HA  ))
 ASSI { 1030}
   (( segid "ATXH" and resid 7    and name HB3 ))
   (( segid "ATXH" and resid 6    and name HA  ))
      5.700     4.100     0.300 peak  1030 spectrum    1 weight  0.10000E+01 volume  0.11739E-03 ppm1      5.180 ppm2      1.367 CV     1
 OR { 1030}
   (  segid "ATXH" and resid 3    and name HB% )
   (( segid "ATXH" and resid 4    and name HA  ))
 ASSI { 1033}
   (( segid "ATXH" and resid 53   and name HB  ))
   (  segid "ATXH" and resid 54   and name HG2%)
      5.800     4.200     0.200 peak  1033 spectrum    1 weight  0.10000E+01 volume  0.10575E-03 ppm1      0.725 ppm2      1.995 CV     1
 OR { 1033}
   (( segid "ATXH" and resid 30   and name HB2 ))
   (  segid "ATXH" and resid 54   and name HG2%)
 OR { 1033}
   (( segid "ATXH" and resid 59   and name HB  ))
   (  segid "ATXH" and resid 54   and name HG2%)
 ASSI { 1037}
   (( segid "ATXH" and resid 58   and name HA  ))
   (( segid "ATXH" and resid 57   and name HE2 ))
      5.300     3.500     0.700 peak  1037 spectrum    1 weight  0.10000E+01 volume  0.98277E-04 ppm1      2.943 ppm2      4.397 CV     1
 OR { 1037}
   (( segid "ATXH" and resid 58   and name HA  ))
   (( segid "ATXH" and resid 57   and name HE3 ))
 OR { 1037}
   (( segid "ATXH" and resid 55   and name HB  ))
   (( segid "ATXH" and resid 57   and name HE2 ))
 OR { 1037}
   (( segid "ATXH" and resid 55   and name HB  ))
   (( segid "ATXH" and resid 57   and name HE3 ))
 ASSI { 1039}
   (( segid "ATXH" and resid 34   and name HB2 ))
   (( segid "ATXH" and resid 33   and name HA  ))
      5.800     4.300     0.200 peak  1039 spectrum    1 weight  0.10000E+01 volume  0.94118E-04 ppm1      4.069 ppm2      1.885 CV     1
 OR { 1039}
   (  segid "ATXH" and resid 4    and name HE% )
   (( segid "ATXH" and resid 33   and name HA  ))
 OR { 1039}
   (( segid "ATXH" and resid 47   and name HB  ))
   (( segid "ATXH" and resid 33   and name HA  ))
 ASSI { 1041}
   (( segid "ATXH" and resid 31   and name HB2 ))
   (  segid "ATXH" and resid 53   and name HG1%)
      5.500     3.700     0.500 peak  1041 spectrum    1 weight  0.10000E+01 volume  0.84860E-04 ppm1      0.799 ppm2      2.746 CV     1
 OR { 1041}
   (( segid "ATXH" and resid 2    and name HB3 ))
   (  segid "ATXH" and resid 53   and name HG2%)
 ASSI { 1042}
   (  segid "ATXH" and resid 59   and name HD1%)
   (( segid "ATXH" and resid 27   and name HA  ))
      5.300     3.500     0.700 peak  1042 spectrum    1 weight  0.10000E+01 volume  0.78810E-04 ppm1      3.705 ppm2      0.671 CV     1
 OR { 1042}
   (  segid "ATXH" and resid 33   and name HG2%)
   (( segid "ATXH" and resid 27   and name HA  ))
 ASSI { 1046}
   (  segid "ATXH" and resid 53   and name HG1%)
   (( segid "ATXH" and resid 2    and name HB2 ))
      4.700     2.800     1.300 peak  1046 spectrum    1 weight  0.10000E+01 volume  0.62905E-04 ppm1      2.785 ppm2      0.873 CV     1
 OR { 1046}
   (  segid "ATXH" and resid 53   and name HG1%)
   (( segid "ATXH" and resid 2    and name HB3 ))
 OR { 1046}
   (( segid "ATXH" and resid 49   and name HG12))
   (( segid "ATXH" and resid 2    and name HB2 ))
 OR { 1046}
   (( segid "ATXH" and resid 49   and name HG12))
   (( segid "ATXH" and resid 2    and name HB3 ))
 OR { 1046}
   (  segid "ATXH" and resid 33   and name HG1%)
   (( segid "ATXH" and resid 2    and name HB3 ))
 ASSI { 1047}
   (( segid "ATXH" and resid 49   and name HB  ))
   (( segid "ATXH" and resid 51   and name HA  ))
      5.700     4.000     0.300 peak  1047 spectrum    1 weight  0.10000E+01 volume  0.58158E-04 ppm1      4.898 ppm2      1.545 CV     1
 OR { 1047}
   (( segid "ATXH" and resid 23   and name HG12))
   (( segid "ATXH" and resid 36   and name HA  ))
assign (resid   3 and name C   and segid ATXH) (resid   4 and name N   and segid ATXH)
       (resid   4 and name CA  and segid ATXH) (resid   4 and name C   and segid ATXH) 1.0  -97.0   72.0 2
assign (resid   4 and name C   and segid ATXH) (resid   5 and name N   and segid ATXH)
       (resid   5 and name CA  and segid ATXH) (resid   5 and name C   and segid ATXH) 1.0  -135.0   51.0 2
assign (resid   5 and name C   and segid ATXH) (resid   6 and name N   and segid ATXH)
       (resid   6 and name CA  and segid ATXH) (resid   6 and name C   and segid ATXH) 1.0  -109.0   42.0 2
assign (resid   6 and name C   and segid ATXH) (resid   7 and name N   and segid ATXH)
       (resid   7 and name CA  and segid ATXH) (resid   7 and name C   and segid ATXH) 1.0  -109.0   60.0 2
assign (resid   7 and name C   and segid ATXH) (resid   8 and name N   and segid ATXH)
       (resid   8 and name CA  and segid ATXH) (resid   8 and name C   and segid ATXH) 1.0  -108.0   30.0 2
assign (resid   8 and name C   and segid ATXH) (resid   9 and name N   and segid ATXH)
       (resid   9 and name CA  and segid ATXH) (resid   9 and name C   and segid ATXH) 1.0  -104.0   45.0 2
assign (resid   9 and name C   and segid ATXH) (resid  10 and name N   and segid ATXH)
       (resid  10 and name CA  and segid ATXH) (resid  10 and name C   and segid ATXH) 1.0  -98.0   51.0 2
assign (resid  10 and name C   and segid ATXH) (resid  11 and name N   and segid ATXH)
       (resid  11 and name CA  and segid ATXH) (resid  11 and name C   and segid ATXH) 1.0  -116.0   30.0 2
assign (resid  11 and name C   and segid ATXH) (resid  12 and name N   and segid ATXH)
       (resid  12 and name CA  and segid ATXH) (resid  12 and name C   and segid ATXH) 1.0  -109.0   60.0 2
assign (resid  17 and name C   and segid ATXH) (resid  18 and name N   and segid ATXH)
       (resid  18 and name CA  and segid ATXH) (resid  18 and name C   and segid ATXH) 1.0  -58.0   21.0 2
assign (resid  18 and name C   and segid ATXH) (resid  19 and name N   and segid ATXH)
       (resid  19 and name CA  and segid ATXH) (resid  19 and name C   and segid ATXH) 1.0  -60.0   12.0 2
assign (resid  19 and name C   and segid ATXH) (resid  20 and name N   and segid ATXH)
       (resid  20 and name CA  and segid ATXH) (resid  20 and name C   and segid ATXH) 1.0  -62.0   18.0 2
assign (resid  20 and name C   and segid ATXH) (resid  21 and name N   and segid ATXH)
       (resid  21 and name CA  and segid ATXH) (resid  21 and name C   and segid ATXH) 1.0  -64.0   18.0 2
assign (resid  21 and name C   and segid ATXH) (resid  22 and name N   and segid ATXH)
       (resid  22 and name CA  and segid ATXH) (resid  22 and name C   and segid ATXH) 1.0  -70.0   39.0 2
assign (resid  22 and name C   and segid ATXH) (resid  23 and name N   and segid ATXH)
       (resid  23 and name CA  and segid ATXH) (resid  23 and name C   and segid ATXH) 1.0  -64.0   21.0 2
assign (resid  23 and name C   and segid ATXH) (resid  24 and name N   and segid ATXH)
       (resid  24 and name CA  and segid ATXH) (resid  24 and name C   and segid ATXH) 1.0  -59.0   15.0 2
assign (resid  24 and name C   and segid ATXH) (resid  25 and name N   and segid ATXH)
       (resid  25 and name CA  and segid ATXH) (resid  25 and name C   and segid ATXH) 1.0  -60.0   12.0 2
assign (resid  25 and name C   and segid ATXH) (resid  26 and name N   and segid ATXH)
       (resid  26 and name CA  and segid ATXH) (resid  26 and name C   and segid ATXH) 1.0  -66.0   12.0 2
assign (resid  26 and name C   and segid ATXH) (resid  27 and name N   and segid ATXH)
       (resid  27 and name CA  and segid ATXH) (resid  27 and name C   and segid ATXH) 1.0  -64.0   18.0 2
assign (resid  27 and name C   and segid ATXH) (resid  28 and name N   and segid ATXH)
       (resid  28 and name CA  and segid ATXH) (resid  28 and name C   and segid ATXH) 1.0  -67.0   36.0 2
assign (resid  28 and name C   and segid ATXH) (resid  29 and name N   and segid ATXH)
       (resid  29 and name CA  and segid ATXH) (resid  29 and name C   and segid ATXH) 1.0  -91.0   48.0 2
assign (resid  32 and name C   and segid ATXH) (resid  33 and name N   and segid ATXH)
       (resid  33 and name CA  and segid ATXH) (resid  33 and name C   and segid ATXH) 1.0  -78.0   48.0 2
assign (resid  33 and name C   and segid ATXH) (resid  34 and name N   and segid ATXH)
       (resid  34 and name CA  and segid ATXH) (resid  34 and name C   and segid ATXH) 1.0  -92.0   33.0 2
assign (resid  34 and name C   and segid ATXH) (resid  35 and name N   and segid ATXH)
       (resid  35 and name CA  and segid ATXH) (resid  35 and name C   and segid ATXH) 1.0  -157.0   36.0 2
assign (resid  35 and name C   and segid ATXH) (resid  36 and name N   and segid ATXH)
       (resid  36 and name CA  and segid ATXH) (resid  36 and name C   and segid ATXH) 1.0  -133.0   33.0 2
assign (resid  36 and name C   and segid ATXH) (resid  37 and name N   and segid ATXH)
       (resid  37 and name CA  and segid ATXH) (resid  37 and name C   and segid ATXH) 1.0  -111.0   48.0 2
assign (resid  37 and name C   and segid ATXH) (resid  38 and name N   and segid ATXH)
       (resid  38 and name CA  and segid ATXH) (resid  38 and name C   and segid ATXH) 1.0  -97.0   33.0 2
assign (resid  38 and name C   and segid ATXH) (resid  39 and name N   and segid ATXH)
       (resid  39 and name CA  and segid ATXH) (resid  39 and name C   and segid ATXH) 1.0  -92.0   36.0 2
assign (resid  39 and name C   and segid ATXH) (resid  40 and name N   and segid ATXH)
       (resid  40 and name CA  and segid ATXH) (resid  40 and name C   and segid ATXH) 1.0  -60.0   21.0 2
assign (resid  40 and name C   and segid ATXH) (resid  41 and name N   and segid ATXH)
       (resid  41 and name CA  and segid ATXH) (resid  41 and name C   and segid ATXH) 1.0  -68.0   30.0 2
assign (resid  41 and name C   and segid ATXH) (resid  42 and name N   and segid ATXH)
       (resid  42 and name CA  and segid ATXH) (resid  42 and name C   and segid ATXH) 1.0  -93.0   42.0 2
assign (resid  42 and name C   and segid ATXH) (resid  43 and name N   and segid ATXH)
       (resid  43 and name CA  and segid ATXH) (resid  43 and name C   and segid ATXH) 1.0   67.0   24.0 2
assign (resid  43 and name C   and segid ATXH) (resid  44 and name N   and segid ATXH)
       (resid  44 and name CA  and segid ATXH) (resid  44 and name C   and segid ATXH) 1.0  -129.0   45.0 2
assign (resid  44 and name C   and segid ATXH) (resid  45 and name N   and segid ATXH)
       (resid  45 and name CA  and segid ATXH) (resid  45 and name C   and segid ATXH) 1.0  -127.0   66.0 2
assign (resid  45 and name C   and segid ATXH) (resid  46 and name N   and segid ATXH)
       (resid  46 and name CA  and segid ATXH) (resid  46 and name C   and segid ATXH) 1.0  -120.0   36.0 2
assign (resid  46 and name C   and segid ATXH) (resid  47 and name N   and segid ATXH)
       (resid  47 and name CA  and segid ATXH) (resid  47 and name C   and segid ATXH) 1.0  -129.0   39.0 2
assign (resid  47 and name C   and segid ATXH) (resid  48 and name N   and segid ATXH)
       (resid  48 and name CA  and segid ATXH) (resid  48 and name C   and segid ATXH) 1.0  -101.0   54.0 2
assign (resid  48 and name C   and segid ATXH) (resid  49 and name N   and segid ATXH)
       (resid  49 and name CA  and segid ATXH) (resid  49 and name C   and segid ATXH) 1.0  -137.0   21.0 2
assign (resid  49 and name C   and segid ATXH) (resid  50 and name N   and segid ATXH)
       (resid  50 and name CA  and segid ATXH) (resid  50 and name C   and segid ATXH) 1.0  -98.0   90.0 2
assign (resid  50 and name C   and segid ATXH) (resid  51 and name N   and segid ATXH)
       (resid  51 and name CA  and segid ATXH) (resid  51 and name C   and segid ATXH) 1.0  -67.0   51.0 2
assign (resid  51 and name C   and segid ATXH) (resid  52 and name N   and segid ATXH)
       (resid  52 and name CA  and segid ATXH) (resid  52 and name C   and segid ATXH) 1.0  -74.0   24.0 2
assign (resid  53 and name C   and segid ATXH) (resid  54 and name N   and segid ATXH)
       (resid  54 and name CA  and segid ATXH) (resid  54 and name C   and segid ATXH) 1.0  -134.0   42.0 2
assign (resid  54 and name C   and segid ATXH) (resid  55 and name N   and segid ATXH)
       (resid  55 and name CA  and segid ATXH) (resid  55 and name C   and segid ATXH) 1.0  -105.0   54.0 2
assign (resid  55 and name C   and segid ATXH) (resid  56 and name N   and segid ATXH)
       (resid  56 and name CA  and segid ATXH) (resid  56 and name C   and segid ATXH) 1.0  -60.0   15.0 2
assign (resid  56 and name C   and segid ATXH) (resid  57 and name N   and segid ATXH)
       (resid  57 and name CA  and segid ATXH) (resid  57 and name C   and segid ATXH) 1.0  -60.0   18.0 2
assign (resid  58 and name C   and segid ATXH) (resid  59 and name N   and segid ATXH)
       (resid  59 and name CA  and segid ATXH) (resid  59 and name C   and segid ATXH) 1.0  -64.0   21.0 2
assign (resid  59 and name C   and segid ATXH) (resid  60 and name N   and segid ATXH)
       (resid  60 and name CA  and segid ATXH) (resid  60 and name C   and segid ATXH) 1.0  -59.0   15.0 2
assign (resid  60 and name C   and segid ATXH) (resid  61 and name N   and segid ATXH)
       (resid  61 and name CA  and segid ATXH) (resid  61 and name C   and segid ATXH) 1.0  -61.0    9.0 2
assign (resid  61 and name C   and segid ATXH) (resid  62 and name N   and segid ATXH)
       (resid  62 and name CA  and segid ATXH) (resid  62 and name C   and segid ATXH) 1.0  -68.0   27.0 2
assign (resid  62 and name C   and segid ATXH) (resid  63 and name N   and segid ATXH)
       (resid  63 and name CA  and segid ATXH) (resid  63 and name C   and segid ATXH) 1.0  -61.0    9.0 2
assign (resid  63 and name C   and segid ATXH) (resid  64 and name N   and segid ATXH)
       (resid  64 and name CA  and segid ATXH) (resid  64 and name C   and segid ATXH) 1.0  -61.0   12.0 2
assign (resid  65 and name C   and segid ATXH) (resid  66 and name N   and segid ATXH)
       (resid  66 and name CA  and segid ATXH) (resid  66 and name C   and segid ATXH) 1.0  -92.0   33.0 2
assign (resid  66 and name C   and segid ATXH) (resid  67 and name N   and segid ATXH)
       (resid  67 and name CA  and segid ATXH) (resid  67 and name C   and segid ATXH) 1.0   86.0   33.0 2
assign (resid  69 and name C   and segid ATXH) (resid  70 and name N   and segid ATXH)
       (resid  70 and name CA  and segid ATXH) (resid  70 and name C   and segid ATXH) 1.0  -104.0   69.6 2
assign (resid   4 and name N   and segid ATXH) (resid   4 and name CA  and segid ATXH)
       (resid   4 and name C   and segid ATXH) (resid   5 and name N   and segid ATXH) 1.0  143.0   48.0 2
assign (resid   5 and name N   and segid ATXH) (resid   5 and name CA  and segid ATXH)
       (resid   5 and name C   and segid ATXH) (resid   6 and name N   and segid ATXH) 1.0  147.0   39.0 2
assign (resid   6 and name N   and segid ATXH) (resid   6 and name CA  and segid ATXH)
       (resid   6 and name C   and segid ATXH) (resid   7 and name N   and segid ATXH) 1.0  126.0   30.0 2
assign (resid   7 and name N   and segid ATXH) (resid   7 and name CA  and segid ATXH)
       (resid   7 and name C   and segid ATXH) (resid   8 and name N   and segid ATXH) 1.0  128.0   45.0 2
assign (resid   8 and name N   and segid ATXH) (resid   8 and name CA  and segid ATXH)
       (resid   8 and name C   and segid ATXH) (resid   9 and name N   and segid ATXH) 1.0  126.0   21.0 2
assign (resid   9 and name N   and segid ATXH) (resid   9 and name CA  and segid ATXH)
       (resid   9 and name C   and segid ATXH) (resid  10 and name N   and segid ATXH) 1.0  135.0   33.0 2
assign (resid  10 and name N   and segid ATXH) (resid  10 and name CA  and segid ATXH)
       (resid  10 and name C   and segid ATXH) (resid  11 and name N   and segid ATXH) 1.0  125.0   21.0 2
assign (resid  11 and name N   and segid ATXH) (resid  11 and name CA  and segid ATXH)
       (resid  11 and name C   and segid ATXH) (resid  12 and name N   and segid ATXH) 1.0  125.0   24.0 2
assign (resid  12 and name N   and segid ATXH) (resid  12 and name CA  and segid ATXH)
       (resid  12 and name C   and segid ATXH) (resid  13 and name N   and segid ATXH) 1.0  152.0   48.0 2
assign (resid  18 and name N   and segid ATXH) (resid  18 and name CA  and segid ATXH)
       (resid  18 and name C   and segid ATXH) (resid  19 and name N   and segid ATXH) 1.0  -38.0   33.0 2
assign (resid  19 and name N   and segid ATXH) (resid  19 and name CA  and segid ATXH)
       (resid  19 and name C   and segid ATXH) (resid  20 and name N   and segid ATXH) 1.0  -45.0   21.0 2
assign (resid  20 and name N   and segid ATXH) (resid  20 and name CA  and segid ATXH)
       (resid  20 and name C   and segid ATXH) (resid  21 and name N   and segid ATXH) 1.0  -43.0   21.0 2
assign (resid  21 and name N   and segid ATXH) (resid  21 and name CA  and segid ATXH)
       (resid  21 and name C   and segid ATXH) (resid  22 and name N   and segid ATXH) 1.0  -36.0   24.0 2
assign (resid  22 and name N   and segid ATXH) (resid  22 and name CA  and segid ATXH)
       (resid  22 and name C   and segid ATXH) (resid  23 and name N   and segid ATXH) 1.0  -37.0   45.0 2
assign (resid  23 and name N   and segid ATXH) (resid  23 and name CA  and segid ATXH)
       (resid  23 and name C   and segid ATXH) (resid  24 and name N   and segid ATXH) 1.0  -44.0    9.0 2
assign (resid  24 and name N   and segid ATXH) (resid  24 and name CA  and segid ATXH)
       (resid  24 and name C   and segid ATXH) (resid  25 and name N   and segid ATXH) 1.0  -42.0   18.0 2
assign (resid  25 and name N   and segid ATXH) (resid  25 and name CA  and segid ATXH)
       (resid  25 and name C   and segid ATXH) (resid  26 and name N   and segid ATXH) 1.0  -43.0   12.0 2
assign (resid  26 and name N   and segid ATXH) (resid  26 and name CA  and segid ATXH)
       (resid  26 and name C   and segid ATXH) (resid  27 and name N   and segid ATXH) 1.0  -38.0   15.0 2
assign (resid  27 and name N   and segid ATXH) (resid  27 and name CA  and segid ATXH)
       (resid  27 and name C   and segid ATXH) (resid  28 and name N   and segid ATXH) 1.0  -43.0   18.0 2
assign (resid  28 and name N   and segid ATXH) (resid  28 and name CA  and segid ATXH)
       (resid  28 and name C   and segid ATXH) (resid  29 and name N   and segid ATXH) 1.0  -31.0   42.0 2
assign (resid  29 and name N   and segid ATXH) (resid  29 and name CA  and segid ATXH)
       (resid  29 and name C   and segid ATXH) (resid  30 and name N   and segid ATXH) 1.0  -19.0   42.0 2
assign (resid  33 and name N   and segid ATXH) (resid  33 and name CA  and segid ATXH)
       (resid  33 and name C   and segid ATXH) (resid  34 and name N   and segid ATXH) 1.0  130.0   60.0 2
assign (resid  34 and name N   and segid ATXH) (resid  34 and name CA  and segid ATXH)
       (resid  34 and name C   and segid ATXH) (resid  35 and name N   and segid ATXH) 1.0  -40.0   27.0 2
assign (resid  35 and name N   and segid ATXH) (resid  35 and name CA  and segid ATXH)
       (resid  35 and name C   and segid ATXH) (resid  36 and name N   and segid ATXH) 1.0  154.0   24.0 2
assign (resid  36 and name N   and segid ATXH) (resid  36 and name CA  and segid ATXH)
       (resid  36 and name C   and segid ATXH) (resid  37 and name N   and segid ATXH) 1.0  138.0   51.0 2
assign (resid  37 and name N   and segid ATXH) (resid  37 and name CA  and segid ATXH)
       (resid  37 and name C   and segid ATXH) (resid  38 and name N   and segid ATXH) 1.0  125.0   30.0 2
assign (resid  38 and name N   and segid ATXH) (resid  38 and name CA  and segid ATXH)
       (resid  38 and name C   and segid ATXH) (resid  39 and name N   and segid ATXH) 1.0  121.0   21.0 2
assign (resid  39 and name N   and segid ATXH) (resid  39 and name CA  and segid ATXH)
       (resid  39 and name C   and segid ATXH) (resid  40 and name N   and segid ATXH) 1.0  117.0  102.0 2
assign (resid  40 and name N   and segid ATXH) (resid  40 and name CA  and segid ATXH)
       (resid  40 and name C   and segid ATXH) (resid  41 and name N   and segid ATXH) 1.0  -32.0   39.0 2
assign (resid  41 and name N   and segid ATXH) (resid  41 and name CA  and segid ATXH)
       (resid  41 and name C   and segid ATXH) (resid  42 and name N   and segid ATXH) 1.0  -28.0   39.0 2
assign (resid  42 and name N   and segid ATXH) (resid  42 and name CA  and segid ATXH)
       (resid  42 and name C   and segid ATXH) (resid  43 and name N   and segid ATXH) 1.0   -9.0   33.0 2
assign (resid  43 and name N   and segid ATXH) (resid  43 and name CA  and segid ATXH)
       (resid  43 and name C   and segid ATXH) (resid  44 and name N   and segid ATXH) 1.0   40.0   39.0 2
assign (resid  44 and name N   and segid ATXH) (resid  44 and name CA  and segid ATXH)
       (resid  44 and name C   and segid ATXH) (resid  45 and name N   and segid ATXH) 1.0  166.0   30.0 2
assign (resid  45 and name N   and segid ATXH) (resid  45 and name CA  and segid ATXH)
       (resid  45 and name C   and segid ATXH) (resid  46 and name N   and segid ATXH) 1.0  125.0   39.0 2
assign (resid  46 and name N   and segid ATXH) (resid  46 and name CA  and segid ATXH)
       (resid  46 and name C   and segid ATXH) (resid  47 and name N   and segid ATXH) 1.0  134.0   48.0 2
assign (resid  47 and name N   and segid ATXH) (resid  47 and name CA  and segid ATXH)
       (resid  47 and name C   and segid ATXH) (resid  48 and name N   and segid ATXH) 1.0  134.0   36.0 2
assign (resid  48 and name N   and segid ATXH) (resid  48 and name CA  and segid ATXH)
       (resid  48 and name C   and segid ATXH) (resid  49 and name N   and segid ATXH) 1.0  132.0   42.0 2
assign (resid  49 and name N   and segid ATXH) (resid  49 and name CA  and segid ATXH)
       (resid  49 and name C   and segid ATXH) (resid  50 and name N   and segid ATXH) 1.0  164.0   30.0 2
assign (resid  50 and name N   and segid ATXH) (resid  50 and name CA  and segid ATXH)
       (resid  50 and name C   and segid ATXH) (resid  51 and name N   and segid ATXH) 1.0  132.0   63.0 2
assign (resid  51 and name N   and segid ATXH) (resid  51 and name CA  and segid ATXH)
       (resid  51 and name C   and segid ATXH) (resid  52 and name N   and segid ATXH) 1.0  -19.0   54.0 2
assign (resid  52 and name N   and segid ATXH) (resid  52 and name CA  and segid ATXH)
       (resid  52 and name C   and segid ATXH) (resid  53 and name N   and segid ATXH) 1.0  -31.0   51.0 2
assign (resid  54 and name N   and segid ATXH) (resid  54 and name CA  and segid ATXH)
       (resid  54 and name C   and segid ATXH) (resid  55 and name N   and segid ATXH) 1.0  158.0   21.0 2
assign (resid  55 and name N   and segid ATXH) (resid  55 and name CA  and segid ATXH)
       (resid  55 and name C   and segid ATXH) (resid  56 and name N   and segid ATXH) 1.0  166.0   18.0 2
assign (resid  56 and name N   and segid ATXH) (resid  56 and name CA  and segid ATXH)
       (resid  56 and name C   and segid ATXH) (resid  57 and name N   and segid ATXH) 1.0  -40.0    9.0 2
assign (resid  57 and name N   and segid ATXH) (resid  57 and name CA  and segid ATXH)
       (resid  57 and name C   and segid ATXH) (resid  58 and name N   and segid ATXH) 1.0  -41.0    9.0 2
assign (resid  59 and name N   and segid ATXH) (resid  59 and name CA  and segid ATXH)
       (resid  59 and name C   and segid ATXH) (resid  60 and name N   and segid ATXH) 1.0  -42.0   30.0 2
assign (resid  60 and name N   and segid ATXH) (resid  60 and name CA  and segid ATXH)
       (resid  60 and name C   and segid ATXH) (resid  61 and name N   and segid ATXH) 1.0  -44.0   12.0 2
assign (resid  61 and name N   and segid ATXH) (resid  61 and name CA  and segid ATXH)
       (resid  61 and name C   and segid ATXH) (resid  62 and name N   and segid ATXH) 1.0  -39.0   42.0 2
assign (resid  62 and name N   and segid ATXH) (resid  62 and name CA  and segid ATXH)
       (resid  62 and name C   and segid ATXH) (resid  63 and name N   and segid ATXH) 1.0  -42.0   15.0 2
assign (resid  63 and name N   and segid ATXH) (resid  63 and name CA  and segid ATXH)
       (resid  63 and name C   and segid ATXH) (resid  64 and name N   and segid ATXH) 1.0  -41.0   15.0 2
assign (resid  64 and name N   and segid ATXH) (resid  64 and name CA  and segid ATXH)
       (resid  64 and name C   and segid ATXH) (resid  65 and name N   and segid ATXH) 1.0  -41.0   15.0 2
assign (resid  66 and name N   and segid ATXH) (resid  66 and name CA  and segid ATXH)
       (resid  66 and name C   and segid ATXH) (resid  67 and name N   and segid ATXH) 1.0   -1.0   39.0 2
assign (resid  67 and name N   and segid ATXH) (resid  67 and name CA  and segid ATXH)
       (resid  67 and name C   and segid ATXH) (resid  68 and name N   and segid ATXH) 1.0   14.0   30.0 2
assign (resid  70 and name N   and segid ATXH) (resid  70 and name CA  and segid ATXH)
       (resid  70 and name C   and segid ATXH) (resid  71 and name N   and segid ATXH) 1.0  134.8   84.7 2
assign (resid  18 and name O and segid ATXH) (resid  22 and name HN and segid ATXH) 1.90 0.20 0.20
assign (resid  18 and name O and segid ATXH) (resid  22 and name N  and segid ATXH) 2.90 0.20 0.20
assign (resid  19 and name O and segid ATXH) (resid  23 and name HN and segid ATXH) 1.90 0.20 0.20
assign (resid  19 and name O and segid ATXH) (resid  23 and name N  and segid ATXH) 2.90 0.20 0.20
assign (resid  20 and name O and segid ATXH) (resid  24 and name HN and segid ATXH) 1.90 0.20 0.20
assign (resid  20 and name O and segid ATXH) (resid  24 and name N  and segid ATXH) 2.90 0.20 0.20
assign (resid  21 and name O and segid ATXH) (resid  25 and name HN and segid ATXH) 1.90 0.20 0.20
assign (resid  21 and name O and segid ATXH) (resid  25 and name N  and segid ATXH) 2.90 0.20 0.20
assign (resid  22 and name O and segid ATXH) (resid  26 and name HN and segid ATXH) 1.90 0.20 0.20
assign (resid  22 and name O and segid ATXH) (resid  26 and name N  and segid ATXH) 2.90 0.20 0.20
assign (resid  23 and name O and segid ATXH) (resid  27 and name HN and segid ATXH) 1.90 0.20 0.20
assign (resid  23 and name O and segid ATXH) (resid  27 and name N  and segid ATXH) 2.90 0.20 0.20
assign (resid  24 and name O and segid ATXH) (resid  28 and name HN and segid ATXH) 1.90 0.20 0.20
assign (resid  24 and name O and segid ATXH) (resid  28 and name N  and segid ATXH) 2.90 0.20 0.20
assign (resid  56 and name O and segid ATXH) (resid  60 and name HN and segid ATXH) 1.90 0.20 0.20
assign (resid  56 and name O and segid ATXH) (resid  60 and name N  and segid ATXH) 2.90 0.20 0.20
assign (resid  57 and name O and segid ATXH) (resid  61 and name HN and segid ATXH) 1.90 0.20 0.20
assign (resid  57 and name O and segid ATXH) (resid  61 and name N  and segid ATXH) 2.90 0.20 0.20
assign (resid  58 and name O and segid ATXH) (resid  62 and name HN and segid ATXH) 1.90 0.20 0.20
assign (resid  58 and name O and segid ATXH) (resid  62 and name N  and segid ATXH) 2.90 0.20 0.20
assign (resid  59 and name O and segid ATXH) (resid  63 and name HN and segid ATXH) 1.90 0.20 0.20
assign (resid  59 and name O and segid ATXH) (resid  63 and name N  and segid ATXH) 2.90 0.20 0.20
assign (resid  60 and name O and segid ATXH) (resid  64 and name HN and segid ATXH) 1.90 0.20 0.20
assign (resid  60 and name O and segid ATXH) (resid  64 and name N  and segid ATXH) 2.90 0.20 0.20

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   SER   1           H1       SER   1  13.919  -5.038  -5.984
    2    H2   SER   1           H2       SER   1  15.029  -6.224  -5.509
    3    H3   SER   1           H3       SER   1  15.577  -4.684  -5.956
    4    HA   SER   1           HA       SER   1  14.422  -3.710  -4.070
    5    HB2  SER   1           HB2      SER   1  13.841  -6.603  -3.374
    6    HB3  SER   1           HB3      SER   1  13.498  -5.216  -2.342
    7    HG   SER   1           HG       SER   1  11.982  -6.259  -4.275
    8    H    ASN   2           H        ASN   2  16.160  -2.951  -3.088
    9    HA   ASN   2           HA       ASN   2  18.434  -4.635  -2.488
   10    HB2  ASN   2           HB2      ASN   2  18.724  -2.286  -3.213
   11    HB3  ASN   2           HB3      ASN   2  17.899  -1.747  -1.756
   12   HD21  ASN   2          1HD2      ASN   2  20.809  -3.084  -3.076
   13   HD22  ASN   2          2HD2      ASN   2  21.799  -2.852  -1.667
   14    H    ALA   3           H        ALA   3  16.131  -2.692  -0.577
   15    HA   ALA   3           HA       ALA   3  16.512  -4.597   1.634
   16    HB1  ALA   3           HB1      ALA   3  16.410  -1.597   1.947
   17    HB2  ALA   3           HB2      ALA   3  16.504  -2.776   3.254
   18    HB3  ALA   3           HB3      ALA   3  17.849  -2.602   2.126
   19    H    MET   4           H        MET   4  14.558  -5.604   1.406
   20    HA   MET   4           HA       MET   4  12.189  -3.935   1.066
   21    HB2  MET   4           HB2      MET   4  11.004  -6.092   0.672
   22    HB3  MET   4           HB3      MET   4  12.273  -5.729  -0.484
   23    HG2  MET   4           HG2      MET   4  13.719  -7.337   0.463
   24    HG3  MET   4           HG3      MET   4  12.687  -7.534   1.880
   25    HE1  MET   4           HE1      MET   4  11.081  -7.086  -1.604
   26    HE2  MET   4           HE2      MET   4  12.609  -7.826  -2.085
   27    HE3  MET   4           HE3      MET   4  11.097  -8.715  -2.281
   28    H    GLU   5           H        GLU   5  10.924  -3.417   2.621
   29    HA   GLU   5           HA       GLU   5  10.927  -4.974   5.120
   30    HB2  GLU   5           HB2      GLU   5  10.176  -2.097   4.568
   31    HB3  GLU   5           HB3      GLU   5   9.911  -2.896   6.110
   32    HG2  GLU   5           HG2      GLU   5  12.606  -2.560   4.816
   33    HG3  GLU   5           HG3      GLU   5  11.938  -1.471   6.032
   34    H    GLN   6           H        GLN   6   9.053  -5.910   5.802
   35    HA   GLN   6           HA       GLN   6   6.761  -5.735   4.006
   36    HB2  GLN   6           HB2      GLN   6   7.328  -7.554   6.354
   37    HB3  GLN   6           HB3      GLN   6   5.848  -7.597   5.412
   38    HG2  GLN   6           HG2      GLN   6   7.122  -9.332   4.554
   39    HG3  GLN   6           HG3      GLN   6   7.338  -8.026   3.395
   40   HE21  GLN   6          1HE2      GLN   6   8.821  -9.893   5.926
   41   HE22  GLN   6          2HE2      GLN   6  10.464  -9.466   5.556
   42    H    LEU   7           H        LEU   7   5.466  -4.064   4.385
   43    HA   LEU   7           HA       LEU   7   4.937  -3.291   7.181
   44    HB2  LEU   7           HB2      LEU   7   4.791  -1.616   4.674
   45    HB3  LEU   7           HB3      LEU   7   4.408  -1.054   6.289
   46    HG   LEU   7           HG       LEU   7   7.128  -2.017   5.406
   47   HD11  LEU   7          2HD1      LEU   7   6.485   0.078   4.313
   48   HD12  LEU   7          1HD1      LEU   7   7.781   0.316   5.484
   49   HD13  LEU   7          3HD1      LEU   7   6.131   0.782   5.891
   50   HD21  LEU   7          3HD2      LEU   7   6.740  -2.377   7.773
   51   HD22  LEU   7          2HD2      LEU   7   6.198  -0.708   7.957
   52   HD23  LEU   7          1HD2      LEU   7   7.876  -1.049   7.533
   53    H    THR   8           H        THR   8   2.875  -3.221   7.901
   54    HA   THR   8           HA       THR   8   0.777  -3.883   5.934
   55    HB   THR   8           HB       THR   8   0.640  -4.396   8.904
   56    HG1  THR   8           HG1      THR   8   2.378  -5.586   7.877
   57   HG21  THR   8          3HG2      THR   8  -1.126  -5.973   8.246
   58   HG22  THR   8          1HG2      THR   8  -0.911  -5.508   6.560
   59   HG23  THR   8          2HG2      THR   8  -1.505  -4.330   7.731
   60    H    LEU   9           H        LEU   9  -0.456  -2.210   5.465
   61    HA   LEU   9           HA       LEU   9  -0.722  -0.006   7.386
   62    HB2  LEU   9           HB2      LEU   9  -1.320  -0.216   4.436
   63    HB3  LEU   9           HB3      LEU   9  -1.722   1.187   5.399
   64    HG   LEU   9           HG       LEU   9   0.711   1.513   5.857
   65   HD11  LEU   9          2HD1      LEU   9   1.480  -0.784   5.498
   66   HD12  LEU   9          1HD1      LEU   9   2.340   0.350   4.455
   67   HD13  LEU   9          3HD1      LEU   9   1.057  -0.660   3.789
   68   HD21  LEU   9          3HD2      LEU   9  -0.377   2.783   4.132
   69   HD22  LEU   9          2HD2      LEU   9  -0.198   1.450   2.988
   70   HD23  LEU   9          1HD2      LEU   9   1.229   2.312   3.571
   71    H    GLN  10           H        GLN  10  -2.591   0.230   8.513
   72    HA   GLN  10           HA       GLN  10  -4.936  -1.259   7.721
   73    HB2  GLN  10           HB2      GLN  10  -6.042  -0.232   9.646
   74    HB3  GLN  10           HB3      GLN  10  -4.497  -0.934  10.097
   75    HG2  GLN  10           HG2      GLN  10  -3.470   1.266  10.062
   76    HG3  GLN  10           HG3      GLN  10  -5.020   1.986   9.633
   77   HE21  GLN  10          1HE2      GLN  10  -4.657  -0.677  11.867
   78   HE22  GLN  10          2HE2      GLN  10  -5.103   0.199  13.294
   79    H    VAL  11           H        VAL  11  -6.729  -0.507   6.726
   80    HA   VAL  11           HA       VAL  11  -6.398   2.128   5.439
   81    HB   VAL  11           HB       VAL  11  -7.594  -0.309   4.127
   82   HG11  VAL  11          2HG1      VAL  11  -8.257   1.816   3.158
   83   HG12  VAL  11          1HG1      VAL  11  -7.182   0.950   2.060
   84   HG13  VAL  11          3HG1      VAL  11  -6.566   2.298   3.014
   85   HG21  VAL  11          3HG2      VAL  11  -4.749   0.675   3.984
   86   HG22  VAL  11          2HG2      VAL  11  -5.452  -0.538   2.913
   87   HG23  VAL  11          1HG2      VAL  11  -5.307  -0.868   4.643
   88    H    GLU  12           H        GLU  12  -7.991   3.440   5.995
   89    HA   GLU  12           HA       GLU  12 -10.705   2.358   6.328
   90    HB2  GLU  12           HB2      GLU  12  -9.456   4.985   7.158
   91    HB3  GLU  12           HB3      GLU  12 -11.181   4.665   7.263
   92    HG2  GLU  12           HG2      GLU  12  -9.086   3.009   8.640
   93    HG3  GLU  12           HG3      GLU  12  -9.923   4.370   9.390
   94    H    GLY  13           H        GLY  13 -11.756   2.330   4.413
   95    HA2  GLY  13           HA1      GLY  13 -12.853   4.347   3.109
   96    HA3  GLY  13           HA2      GLY  13 -11.217   4.467   2.478
   97    H    MET  14           H        MET  14 -11.527   1.269   2.944
   98    HA   MET  14           HA       MET  14 -12.317   0.891   0.157
   99    HB2  MET  14           HB2      MET  14 -11.053  -1.066   2.083
  100    HB3  MET  14           HB3      MET  14 -11.435  -1.400   0.397
  101    HG2  MET  14           HG2      MET  14  -9.905   0.521  -0.191
  102    HG3  MET  14           HG3      MET  14  -9.392   0.510   1.494
  103    HE1  MET  14           HE1      MET  14  -8.195  -1.675   2.646
  104    HE2  MET  14           HE2      MET  14  -9.565  -2.646   2.101
  105    HE3  MET  14           HE3      MET  14  -7.918  -3.172   1.752
  106    H    SER  15           H        SER  15 -14.520   1.103   0.304
  107    HA   SER  15           HA       SER  15 -15.938  -0.844   1.969
  108    HB2  SER  15           HB2      SER  15 -17.068   1.465   0.372
  109    HB3  SER  15           HB3      SER  15 -17.914   0.503   1.585
  110    HG   SER  15           HG       SER  15 -15.800   1.374   2.812
  111    H    CYS  16           H        CYS  16 -14.862  -0.396  -1.211
  112    HA   CYS  16           HA       CYS  16 -16.870  -2.294  -2.204
  113    HB2  CYS  16           HB2      CYS  16 -15.653  -0.006  -3.754
  114    HB3  CYS  16           HB3      CYS  16 -16.833  -1.161  -4.367
  115    HG   CYS  16           HG       CYS  16 -18.742  -0.313  -2.331
  116    H    GLY  17           H        GLY  17 -16.197  -3.505  -4.137
  117    HA2  GLY  17           HA1      GLY  17 -13.702  -4.784  -3.630
  118    HA3  GLY  17           HA2      GLY  17 -14.801  -5.129  -4.955
  119    H    HIS  18           H        HIS  18 -14.747  -2.416  -6.049
  120    HA   HIS  18           HA       HIS  18 -12.489  -2.692  -7.724
  121    HB2  HIS  18           HB2      HIS  18 -13.166  -0.697  -8.816
  122    HB3  HIS  18           HB3      HIS  18 -14.646  -1.497  -8.307
  123    HD1  HIS  18           HD1      HIS  18 -12.719   1.631  -7.961
  124    HD2  HIS  18           HD2      HIS  18 -15.996  -0.184  -6.146
  125    HE1  HIS  18           HE1      HIS  18 -13.858   3.444  -6.641
  126    HE2  HIS  18           HE2      HIS  18 -15.947   2.370  -5.714
  127    H    CYS  19           H        CYS  19 -12.907  -1.181  -4.673
  128    HA   CYS  19           HA       CYS  19 -10.779   0.664  -4.740
  129    HB2  CYS  19           HB2      CYS  19 -11.868  -0.854  -2.361
  130    HB3  CYS  19           HB3      CYS  19 -10.906   0.618  -2.299
  131    HG   CYS  19           HG       CYS  19 -12.821   2.291  -3.298
  132    H    VAL  20           H        VAL  20 -10.964  -2.766  -3.988
  133    HA   VAL  20           HA       VAL  20  -8.467  -3.319  -2.990
  134    HB   VAL  20           HB       VAL  20 -10.062  -4.943  -4.984
  135   HG11  VAL  20          2HG1      VAL  20  -7.818  -5.799  -3.164
  136   HG12  VAL  20          1HG1      VAL  20  -7.773  -5.731  -4.926
  137   HG13  VAL  20          3HG1      VAL  20  -8.834  -6.882  -4.116
  138   HG21  VAL  20          3HG2      VAL  20 -11.310  -4.446  -2.960
  139   HG22  VAL  20          2HG2      VAL  20  -9.976  -5.039  -1.973
  140   HG23  VAL  20          1HG2      VAL  20 -10.866  -6.153  -3.012
  141    H    ASN  21           H        ASN  21  -9.353  -3.485  -6.435
  142    HA   ASN  21           HA       ASN  21  -6.747  -3.854  -7.397
  143    HB2  ASN  21           HB2      ASN  21  -8.682  -4.387  -8.763
  144    HB3  ASN  21           HB3      ASN  21  -9.181  -2.701  -8.774
  145   HD21  ASN  21          1HD2      ASN  21  -8.172  -1.262 -10.139
  146   HD22  ASN  21          2HD2      ASN  21  -7.070  -1.762 -11.373
  147    H    ALA  22           H        ALA  22  -8.651  -0.939  -6.875
  148    HA   ALA  22           HA       ALA  22  -6.963   0.892  -8.147
  149    HB1  ALA  22           HB1      ALA  22  -9.238   1.433  -7.450
  150    HB2  ALA  22           HB2      ALA  22  -8.742   1.358  -5.759
  151    HB3  ALA  22           HB3      ALA  22  -8.077   2.601  -6.819
  152    H    ILE  23           H        ILE  23  -7.163   0.148  -4.641
  153    HA   ILE  23           HA       ILE  23  -4.958   1.827  -4.037
  154    HB   ILE  23           HB       ILE  23  -6.670   1.312  -2.363
  155   HG12  ILE  23          2HG1      ILE  23  -3.897   0.403  -1.566
  156   HG13  ILE  23          3HG1      ILE  23  -4.437   2.075  -1.668
  157   HG21  ILE  23          2HG2      ILE  23  -6.636  -0.852  -1.185
  158   HG22  ILE  23          1HG2      ILE  23  -5.482  -1.457  -2.374
  159   HG23  ILE  23          3HG2      ILE  23  -7.110  -1.005  -2.875
  160   HD11  ILE  23          3HD1      ILE  23  -6.057   1.645   0.117
  161   HD12  ILE  23          2HD1      ILE  23  -4.400   1.324   0.627
  162   HD13  ILE  23          1HD1      ILE  23  -5.476  -0.017   0.231
  163    H    GLU  24           H        GLU  24  -5.216  -1.666  -4.645
  164    HA   GLU  24           HA       GLU  24  -2.649  -2.317  -3.717
  165    HB2  GLU  24           HB2      GLU  24  -2.836  -4.396  -4.871
  166    HB3  GLU  24           HB3      GLU  24  -4.424  -3.992  -4.248
  167    HG2  GLU  24           HG2      GLU  24  -5.140  -3.285  -6.453
  168    HG3  GLU  24           HG3      GLU  24  -3.527  -3.605  -7.092
  169    H    SER  25           H        SER  25  -3.776  -1.313  -6.933
  170    HA   SER  25           HA       SER  25  -1.150  -1.373  -8.049
  171    HB2  SER  25           HB2      SER  25  -3.556   0.182  -9.007
  172    HB3  SER  25           HB3      SER  25  -2.074  -0.142  -9.918
  173    HG   SER  25           HG       SER  25  -4.136  -1.919  -9.146
  174    H    SER  26           H        SER  26  -3.079   1.092  -6.422
  175    HA   SER  26           HA       SER  26  -1.600   3.345  -7.069
  176    HB2  SER  26           HB2      SER  26  -2.904   2.690  -4.413
  177    HB3  SER  26           HB3      SER  26  -2.394   4.297  -4.925
  178    HG   SER  26           HG       SER  26  -4.307   2.677  -6.280
  179    H    VAL  27           H        VAL  27  -0.980   0.858  -4.651
  180    HA   VAL  27           HA       VAL  27   1.532   2.046  -3.855
  181    HB   VAL  27           HB       VAL  27   0.595  -0.773  -3.326
  182   HG11  VAL  27          2HG1      VAL  27   2.057  -0.585  -1.355
  183   HG12  VAL  27          1HG1      VAL  27   2.563   1.013  -1.906
  184   HG13  VAL  27          3HG1      VAL  27   2.938  -0.413  -2.873
  185   HG21  VAL  27          3HG2      VAL  27  -1.131   0.753  -2.574
  186   HG22  VAL  27          2HG2      VAL  27   0.064   1.707  -1.696
  187   HG23  VAL  27          1HG2      VAL  27  -0.288   0.053  -1.193
  188    H    LYS  28           H        LYS  28   0.474  -0.757  -5.763
  189    HA   LYS  28           HA       LYS  28   2.967  -1.901  -6.242
  190    HB2  LYS  28           HB2      LYS  28   0.315  -2.393  -6.945
  191    HB3  LYS  28           HB3      LYS  28   1.163  -2.243  -8.475
  192    HG2  LYS  28           HG2      LYS  28   1.864  -4.117  -6.232
  193    HG3  LYS  28           HG3      LYS  28   1.084  -4.548  -7.755
  194    HD2  LYS  28           HD2      LYS  28   3.129  -3.617  -8.915
  195    HD3  LYS  28           HD3      LYS  28   3.890  -3.558  -7.322
  196    HE2  LYS  28           HE2      LYS  28   3.506  -5.958  -7.056
  197    HE3  LYS  28           HE3      LYS  28   2.750  -6.008  -8.648
  198    HZ1  LYS  28           HZ1      LYS  28   4.954  -6.728  -8.939
  199    HZ2  LYS  28           HZ2      LYS  28   5.589  -5.483  -7.990
  200    HZ3  LYS  28           HZ3      LYS  28   4.942  -5.131  -9.514
  201    H    GLU  29           H        GLU  29   1.233   0.540  -8.140
  202    HA   GLU  29           HA       GLU  29   2.912   0.484 -10.404
  203    HB2  GLU  29           HB2      GLU  29   1.199   2.712  -9.297
  204    HB3  GLU  29           HB3      GLU  29   1.970   2.745 -10.876
  205    HG2  GLU  29           HG2      GLU  29   0.696   0.709 -11.481
  206    HG3  GLU  29           HG3      GLU  29  -0.137   0.814  -9.933
  207    H    LEU  30           H        LEU  30   3.243   1.906  -7.300
  208    HA   LEU  30           HA       LEU  30   5.206   3.855  -7.983
  209    HB2  LEU  30           HB2      LEU  30   4.886   2.470  -5.320
  210    HB3  LEU  30           HB3      LEU  30   5.678   4.006  -5.616
  211    HG   LEU  30           HG       LEU  30   2.729   3.410  -5.776
  212   HD11  LEU  30          2HD1      LEU  30   2.589   5.095  -4.006
  213   HD12  LEU  30          1HD1      LEU  30   4.348   5.228  -4.005
  214   HD13  LEU  30          3HD1      LEU  30   3.579   3.714  -3.529
  215   HD21  LEU  30          3HD2      LEU  30   2.429   5.775  -6.349
  216   HD22  LEU  30          2HD2      LEU  30   3.319   4.907  -7.600
  217   HD23  LEU  30          1HD2      LEU  30   4.178   5.965  -6.478
  218    H    ASN  31           H        ASN  31   7.222   3.500  -8.655
  219    HA   ASN  31           HA       ASN  31   8.435   0.978  -8.789
  220    HB2  ASN  31           HB2      ASN  31   9.108   2.843 -10.239
  221    HB3  ASN  31           HB3      ASN  31   9.756   3.701  -8.839
  222   HD21  ASN  31          1HD2      ASN  31  10.178   0.972 -10.982
  223   HD22  ASN  31          2HD2      ASN  31  11.834   0.662 -10.573
  224    H    GLY  32           H        GLY  32   9.466  -0.224  -7.346
  225    HA2  GLY  32           HA1      GLY  32  11.197  -0.281  -5.584
  226    HA3  GLY  32           HA2      GLY  32  10.362   1.084  -4.853
  227    H    VAL  33           H        VAL  33   7.759  -0.175  -5.657
  228    HA   VAL  33           HA       VAL  33   7.404  -1.780  -3.294
  229    HB   VAL  33           HB       VAL  33   5.493  -0.981  -5.491
  230   HG11  VAL  33          2HG1      VAL  33   3.708  -1.838  -4.062
  231   HG12  VAL  33          1HG1      VAL  33   4.908  -2.439  -2.918
  232   HG13  VAL  33          3HG1      VAL  33   4.815  -3.125  -4.541
  233   HG21  VAL  33          3HG2      VAL  33   5.785  -0.077  -2.632
  234   HG22  VAL  33          2HG2      VAL  33   4.560   0.482  -3.770
  235   HG23  VAL  33          1HG2      VAL  33   6.262   0.838  -4.062
  236    H    GLU  34           H        GLU  34   7.325  -3.922  -3.166
  237    HA   GLU  34           HA       GLU  34   8.088  -5.416  -5.546
  238    HB2  GLU  34           HB2      GLU  34   9.288  -5.604  -3.335
  239    HB3  GLU  34           HB3      GLU  34   7.847  -6.374  -2.693
  240    HG2  GLU  34           HG2      GLU  34   9.427  -8.050  -3.260
  241    HG3  GLU  34           HG3      GLU  34   8.083  -8.143  -4.396
  242    H    GLN  35           H        GLN  35   5.964  -6.150  -2.803
  243    HA   GLN  35           HA       GLN  35   3.882  -7.055  -4.648
  244    HB2  GLN  35           HB2      GLN  35   5.141  -8.615  -2.405
  245    HB3  GLN  35           HB3      GLN  35   3.530  -8.989  -3.001
  246    HG2  GLN  35           HG2      GLN  35   5.948  -8.872  -4.773
  247    HG3  GLN  35           HG3      GLN  35   5.414 -10.348  -3.967
  248   HE21  GLN  35          1HE2      GLN  35   3.527 -11.343  -4.629
  249   HE22  GLN  35          2HE2      GLN  35   2.738 -10.952  -6.121
  250    H    VAL  36           H        VAL  36   1.771  -7.003  -3.806
  251    HA   VAL  36           HA       VAL  36   1.490  -5.570  -1.256
  252    HB   VAL  36           HB       VAL  36  -0.364  -4.262  -2.174
  253   HG11  VAL  36          2HG1      VAL  36   0.916  -2.768  -3.643
  254   HG12  VAL  36          1HG1      VAL  36   2.168  -4.003  -3.787
  255   HG13  VAL  36          3HG1      VAL  36   1.836  -3.262  -2.222
  256   HG21  VAL  36          3HG2      VAL  36  -1.158  -5.766  -3.892
  257   HG22  VAL  36          2HG2      VAL  36   0.335  -5.554  -4.810
  258   HG23  VAL  36          1HG2      VAL  36  -0.772  -4.198  -4.603
  259    H    LYS  37           H        LYS  37   0.087  -6.467   0.111
  260    HA   LYS  37           HA       LYS  37  -1.858  -8.395  -0.978
  261    HB2  LYS  37           HB2      LYS  37  -0.857  -8.230   1.869
  262    HB3  LYS  37           HB3      LYS  37  -1.846  -9.497   1.160
  263    HG2  LYS  37           HG2      LYS  37  -0.028 -10.269  -0.180
  264    HG3  LYS  37           HG3      LYS  37   0.973  -8.896   0.306
  265    HD2  LYS  37           HD2      LYS  37   0.813  -9.694   2.656
  266    HD3  LYS  37           HD3      LYS  37  -0.035 -11.125   2.069
  267    HE2  LYS  37           HE2      LYS  37   1.891 -11.780   0.767
  268    HE3  LYS  37           HE3      LYS  37   2.732 -10.295   1.210
  269    HZ1  LYS  37           HZ1      LYS  37   1.941 -12.490   3.049
  270    HZ2  LYS  37           HZ2      LYS  37   2.647 -11.026   3.542
  271    HZ3  LYS  37           HZ3      LYS  37   3.517 -12.102   2.557
  272    H    VAL  38           H        VAL  38  -3.497  -6.923  -1.397
  273    HA   VAL  38           HA       VAL  38  -4.363  -5.171   0.750
  274    HB   VAL  38           HB       VAL  38  -4.446  -4.154  -1.401
  275   HG11  VAL  38          2HG1      VAL  38  -6.077  -6.526  -2.275
  276   HG12  VAL  38          1HG1      VAL  38  -4.492  -6.028  -2.871
  277   HG13  VAL  38          3HG1      VAL  38  -5.912  -5.043  -3.215
  278   HG21  VAL  38          3HG2      VAL  38  -6.830  -3.561  -1.611
  279   HG22  VAL  38          2HG2      VAL  38  -6.261  -3.526   0.058
  280   HG23  VAL  38          1HG2      VAL  38  -7.232  -4.883  -0.514
  281    H    GLN  39           H        GLN  39  -5.546  -5.961   2.301
  282    HA   GLN  39           HA       GLN  39  -7.293  -8.245   1.743
  283    HB2  GLN  39           HB2      GLN  39  -6.449  -7.156   4.436
  284    HB3  GLN  39           HB3      GLN  39  -7.215  -8.709   4.111
  285    HG2  GLN  39           HG2      GLN  39  -5.247  -9.464   2.917
  286    HG3  GLN  39           HG3      GLN  39  -4.482  -7.895   3.140
  287   HE21  GLN  39          1HE2      GLN  39  -6.360  -9.547   5.591
  288   HE22  GLN  39          2HE2      GLN  39  -5.036  -9.869   6.660
  289    H    LEU  40           H        LEU  40  -9.114  -7.373   0.938
  290    HA   LEU  40           HA       LEU  40 -10.192  -4.865   1.544
  291    HB2  LEU  40           HB2      LEU  40 -10.670  -6.291  -0.461
  292    HB3  LEU  40           HB3      LEU  40 -11.681  -7.298   0.551
  293    HG   LEU  40           HG       LEU  40 -12.844  -5.584  -0.941
  294   HD11  LEU  40          2HD1      LEU  40 -13.440  -5.539   2.012
  295   HD12  LEU  40          1HD1      LEU  40 -14.013  -6.738   0.852
  296   HD13  LEU  40          3HD1      LEU  40 -14.548  -5.063   0.725
  297   HD21  LEU  40          3HD2      LEU  40 -13.020  -3.316  -0.066
  298   HD22  LEU  40          2HD2      LEU  40 -11.356  -3.705  -0.504
  299   HD23  LEU  40          1HD2      LEU  40 -11.846  -3.703   1.192
  300    H    ALA  41           H        ALA  41 -11.063  -8.071   2.777
  301    HA   ALA  41           HA       ALA  41 -13.258  -7.131   4.319
  302    HB1  ALA  41           HB1      ALA  41 -13.120  -9.414   3.475
  303    HB2  ALA  41           HB2      ALA  41 -11.738  -9.717   4.529
  304    HB3  ALA  41           HB3      ALA  41 -13.321  -9.383   5.228
  305    H    GLU  42           H        GLU  42  -9.861  -7.333   4.916
  306    HA   GLU  42           HA       GLU  42 -10.251  -7.320   7.803
  307    HB2  GLU  42           HB2      GLU  42  -7.673  -7.315   6.237
  308    HB3  GLU  42           HB3      GLU  42  -7.840  -7.571   7.964
  309    HG2  GLU  42           HG2      GLU  42  -8.560  -9.385   5.707
  310    HG3  GLU  42           HG3      GLU  42  -7.566  -9.710   7.124
  311    H    GLY  43           H        GLY  43  -9.506  -5.156   5.210
  312    HA2  GLY  43           HA1      GLY  43  -9.418  -2.835   5.278
  313    HA3  GLY  43           HA2      GLY  43  -9.567  -2.915   7.028
  314    H    THR  44           H        THR  44  -7.133  -4.777   5.375
  315    HA   THR  44           HA       THR  44  -5.122  -2.742   6.050
  316    HB   THR  44           HB       THR  44  -3.608  -4.628   6.824
  317    HG1  THR  44           HG1      THR  44  -4.768  -6.511   7.585
  318   HG21  THR  44          3HG2      THR  44  -4.541  -4.693   9.086
  319   HG22  THR  44          1HG2      THR  44  -6.082  -4.092   8.471
  320   HG23  THR  44          2HG2      THR  44  -4.645  -3.071   8.402
  321    H    VAL  45           H        VAL  45  -3.277  -2.730   4.797
  322    HA   VAL  45           HA       VAL  45  -3.175  -4.648   2.559
  323    HB   VAL  45           HB       VAL  45  -2.330  -1.733   2.447
  324   HG11  VAL  45          2HG1      VAL  45  -0.927  -3.151   1.060
  325   HG12  VAL  45          1HG1      VAL  45  -1.991  -2.170   0.051
  326   HG13  VAL  45          3HG1      VAL  45  -2.353  -3.876   0.318
  327   HG21  VAL  45          3HG2      VAL  45  -4.673  -3.146   1.169
  328   HG22  VAL  45          2HG2      VAL  45  -4.186  -1.480   0.850
  329   HG23  VAL  45          1HG2      VAL  45  -4.749  -1.943   2.455
  330    H    GLU  46           H        GLU  46  -1.537  -5.955   2.870
  331    HA   GLU  46           HA       GLU  46   0.795  -5.081   4.402
  332    HB2  GLU  46           HB2      GLU  46  -0.374  -7.253   4.894
  333    HB3  GLU  46           HB3      GLU  46   0.142  -7.831   3.317
  334    HG2  GLU  46           HG2      GLU  46   2.477  -7.582   3.995
  335    HG3  GLU  46           HG3      GLU  46   1.952  -7.014   5.581
  336    H    VAL  47           H        VAL  47   2.389  -4.151   3.261
  337    HA   VAL  47           HA       VAL  47   2.789  -5.032   0.467
  338    HB   VAL  47           HB       VAL  47   3.387  -2.291   1.588
  339   HG11  VAL  47          2HG1      VAL  47   3.620  -1.645  -0.756
  340   HG12  VAL  47          1HG1      VAL  47   3.303  -3.309  -1.249
  341   HG13  VAL  47          3HG1      VAL  47   4.756  -2.924  -0.326
  342   HG21  VAL  47          3HG2      VAL  47   0.985  -2.670   1.610
  343   HG22  VAL  47          2HG2      VAL  47   1.034  -3.177  -0.079
  344   HG23  VAL  47          1HG2      VAL  47   1.421  -1.511   0.354
  345    H    THR  48           H        THR  48   4.757  -5.705  -0.109
  346    HA   THR  48           HA       THR  48   6.994  -5.361   1.757
  347    HB   THR  48           HB       THR  48   7.043  -6.927  -0.837
  348    HG1  THR  48           HG1      THR  48   5.693  -7.479   1.471
  349   HG21  THR  48          3HG2      THR  48   8.837  -8.162   0.320
  350   HG22  THR  48          1HG2      THR  48   8.664  -7.087   1.708
  351   HG23  THR  48          2HG2      THR  48   9.207  -6.446   0.157
  352    H    ILE  49           H        ILE  49   8.114  -3.503   1.476
  353    HA   ILE  49           HA       ILE  49   8.335  -2.452  -1.277
  354    HB   ILE  49           HB       ILE  49   8.583  -0.207  -0.321
  355   HG12  ILE  49          2HG1      ILE  49   7.704  -1.245   2.354
  356   HG13  ILE  49          3HG1      ILE  49   9.414  -1.256   1.937
  357   HG21  ILE  49          2HG2      ILE  49   6.385  -0.930  -1.002
  358   HG22  ILE  49          1HG2      ILE  49   6.262   0.096   0.430
  359   HG23  ILE  49          3HG2      ILE  49   6.104  -1.655   0.581
  360   HD11  ILE  49          3HD1      ILE  49   7.645   1.179   1.947
  361   HD12  ILE  49          2HD1      ILE  49   9.378   1.142   1.615
  362   HD13  ILE  49          1HD1      ILE  49   8.778   0.723   3.221
  363    H    ASP  50           H        ASP  50  10.285  -1.746  -2.019
  364    HA   ASP  50           HA       ASP  50  12.639  -2.305  -0.408
  365    HB2  ASP  50           HB2      ASP  50  12.615  -2.788  -2.867
  366    HB3  ASP  50           HB3      ASP  50  12.465  -1.061  -3.162
  367    H    SER  51           H        SER  51  12.930  -0.867   1.160
  368    HA   SER  51           HA       SER  51  12.033   1.845   0.909
  369    HB2  SER  51           HB2      SER  51  11.871   0.683   3.051
  370    HB3  SER  51           HB3      SER  51  13.618   0.489   3.102
  371    HG   SER  51           HG       SER  51  13.328   3.016   2.774
  372    H    SER  52           H        SER  52  14.647   0.322  -0.318
  373    HA   SER  52           HA       SER  52  16.480   2.570  -0.034
  374    HB2  SER  52           HB2      SER  52  17.358   0.247   0.016
  375    HB3  SER  52           HB3      SER  52  16.774   0.010  -1.628
  376    HG   SER  52           HG       SER  52  18.142   1.947  -2.101
  377    H    VAL  53           H        VAL  53  13.791   1.981  -1.746
  378    HA   VAL  53           HA       VAL  53  14.685   3.687  -3.971
  379    HB   VAL  53           HB       VAL  53  12.765   1.361  -4.206
  380   HG11  VAL  53          2HG1      VAL  53  12.729   1.906  -6.596
  381   HG12  VAL  53          1HG1      VAL  53  13.726   3.326  -6.279
  382   HG13  VAL  53          3HG1      VAL  53  12.097   3.224  -5.610
  383   HG21  VAL  53          3HG2      VAL  53  15.101   0.647  -4.068
  384   HG22  VAL  53          2HG2      VAL  53  15.517   1.747  -5.382
  385   HG23  VAL  53          1HG2      VAL  53  14.446   0.380  -5.684
  386    H    VAL  54           H        VAL  54  11.692   2.304  -2.606
  387    HA   VAL  54           HA       VAL  54  10.421   4.926  -2.943
  388    HB   VAL  54           HB       VAL  54   9.319   2.911  -3.963
  389   HG11  VAL  54          2HG1      VAL  54   9.805   1.278  -2.230
  390   HG12  VAL  54          1HG1      VAL  54   8.067   1.394  -2.521
  391   HG13  VAL  54          3HG1      VAL  54   8.777   2.157  -1.098
  392   HG21  VAL  54          3HG2      VAL  54   8.051   4.928  -3.520
  393   HG22  VAL  54          2HG2      VAL  54   7.736   4.395  -1.869
  394   HG23  VAL  54          1HG2      VAL  54   7.054   3.502  -3.230
  395    H    THR  55           H        THR  55   9.334   5.914  -1.182
  396    HA   THR  55           HA       THR  55  10.423   5.090   1.405
  397    HB   THR  55           HB       THR  55   9.981   7.295   2.199
  398    HG1  THR  55           HG1      THR  55   8.782   8.114  -0.228
  399   HG21  THR  55          3HG2      THR  55  10.943   7.478  -0.659
  400   HG22  THR  55          1HG2      THR  55  11.940   7.123   0.752
  401   HG23  THR  55          2HG2      THR  55  11.179   8.706   0.585
  402    H    LEU  56           H        LEU  56   8.945   5.502   3.318
  403    HA   LEU  56           HA       LEU  56   6.555   3.977   3.013
  404    HB2  LEU  56           HB2      LEU  56   7.638   5.601   5.325
  405    HB3  LEU  56           HB3      LEU  56   6.156   4.672   5.420
  406    HG   LEU  56           HG       LEU  56   7.551   2.622   4.880
  407   HD11  LEU  56          2HD1      LEU  56   9.516   3.739   3.968
  408   HD12  LEU  56          1HD1      LEU  56   9.942   2.751   5.366
  409   HD13  LEU  56          3HD1      LEU  56   9.815   4.501   5.530
  410   HD21  LEU  56          3HD2      LEU  56   6.724   3.132   7.118
  411   HD22  LEU  56          2HD2      LEU  56   8.150   4.124   7.424
  412   HD23  LEU  56          1HD2      LEU  56   8.320   2.385   7.180
  413    H    LYS  57           H        LYS  57   7.352   7.376   3.325
  414    HA   LYS  57           HA       LYS  57   4.736   8.366   3.673
  415    HB2  LYS  57           HB2      LYS  57   7.161   9.493   3.802
  416    HB3  LYS  57           HB3      LYS  57   6.703  10.019   2.188
  417    HG2  LYS  57           HG2      LYS  57   5.034  10.452   4.650
  418    HG3  LYS  57           HG3      LYS  57   6.149  11.645   3.982
  419    HD2  LYS  57           HD2      LYS  57   4.864  11.668   1.898
  420    HD3  LYS  57           HD3      LYS  57   3.761  10.462   2.565
  421    HE2  LYS  57           HE2      LYS  57   2.782  12.665   2.741
  422    HE3  LYS  57           HE3      LYS  57   3.144  12.036   4.347
  423    HZ1  LYS  57           HZ1      LYS  57   5.084  13.413   4.460
  424    HZ2  LYS  57           HZ2      LYS  57   3.760  14.385   4.049
  425    HZ3  LYS  57           HZ3      LYS  57   4.881  13.931   2.860
  426    H    ASP  58           H        ASP  58   6.706   7.817   0.762
  427    HA   ASP  58           HA       ASP  58   5.000   8.846  -1.169
  428    HB2  ASP  58           HB2      ASP  58   7.011   6.636  -1.169
  429    HB3  ASP  58           HB3      ASP  58   5.947   6.797  -2.562
  430    H    ILE  59           H        ILE  59   5.049   5.597   0.222
  431    HA   ILE  59           HA       ILE  59   2.933   4.468  -1.183
  432    HB   ILE  59           HB       ILE  59   3.636   3.963   1.714
  433   HG12  ILE  59          2HG1      ILE  59   5.620   3.732   0.331
  434   HG13  ILE  59          3HG1      ILE  59   5.068   2.142   0.844
  435   HG21  ILE  59          2HG2      ILE  59   1.496   2.999   1.065
  436   HG22  ILE  59          1HG2      ILE  59   2.701   1.743   1.349
  437   HG23  ILE  59          3HG2      ILE  59   2.264   2.190  -0.301
  438   HD11  ILE  59          3HD1      ILE  59   4.655   3.390  -1.864
  439   HD12  ILE  59          2HD1      ILE  59   4.028   1.821  -1.357
  440   HD13  ILE  59          1HD1      ILE  59   5.768   2.083  -1.458
  441    H    VAL  60           H        VAL  60   2.865   6.050   2.000
  442    HA   VAL  60           HA       VAL  60   0.097   5.887   2.403
  443    HB   VAL  60           HB       VAL  60   2.074   7.892   3.503
  444   HG11  VAL  60          2HG1      VAL  60  -0.207   8.711   3.735
  445   HG12  VAL  60          1HG1      VAL  60   0.456   8.248   5.302
  446   HG13  VAL  60          3HG1      VAL  60  -0.689   7.187   4.482
  447   HG21  VAL  60          3HG2      VAL  60   2.617   5.551   3.991
  448   HG22  VAL  60          2HG2      VAL  60   1.010   5.329   4.684
  449   HG23  VAL  60          1HG2      VAL  60   2.155   6.436   5.445
  450    H    ALA  61           H        ALA  61   2.063   8.559   1.120
  451    HA   ALA  61           HA       ALA  61   0.080  10.491   0.910
  452    HB1  ALA  61           HB1      ALA  61   2.465  10.101  -0.892
  453    HB2  ALA  61           HB2      ALA  61   1.531  11.586  -0.718
  454    HB3  ALA  61           HB3      ALA  61   2.459  10.963   0.646
  455    H    VAL  62           H        VAL  62   1.121   8.124  -1.540
  456    HA   VAL  62           HA       VAL  62  -0.702   9.008  -3.521
  457    HB   VAL  62           HB       VAL  62   0.652   6.321  -3.219
  458   HG11  VAL  62          2HG1      VAL  62  -0.740   7.508  -5.620
  459   HG12  VAL  62          1HG1      VAL  62  -1.328   6.161  -4.646
  460   HG13  VAL  62          3HG1      VAL  62   0.153   5.987  -5.588
  461   HG21  VAL  62          3HG2      VAL  62   2.211   8.188  -3.446
  462   HG22  VAL  62          2HG2      VAL  62   1.365   8.726  -4.897
  463   HG23  VAL  62          1HG2      VAL  62   2.212   7.179  -4.892
  464    H    ILE  63           H        ILE  63  -0.860   6.405  -1.109
  465    HA   ILE  63           HA       ILE  63  -3.277   5.263  -1.927
  466    HB   ILE  63           HB       ILE  63  -2.023   5.419   0.810
  467   HG12  ILE  63          2HG1      ILE  63  -2.216   3.187  -1.225
  468   HG13  ILE  63          3HG1      ILE  63  -0.777   4.139  -0.873
  469   HG21  ILE  63          2HG2      ILE  63  -3.566   3.605   1.459
  470   HG22  ILE  63          1HG2      ILE  63  -4.431   3.829  -0.063
  471   HG23  ILE  63          3HG2      ILE  63  -4.389   5.128   1.130
  472   HD11  ILE  63          3HD1      ILE  63  -2.182   2.289   1.036
  473   HD12  ILE  63          2HD1      ILE  63  -0.753   3.253   1.402
  474   HD13  ILE  63          1HD1      ILE  63  -0.666   1.971   0.194
  475    H    GLU  64           H        GLU  64  -2.694   7.850   0.456
  476    HA   GLU  64           HA       GLU  64  -5.438   8.128   1.117
  477    HB2  GLU  64           HB2      GLU  64  -3.220  10.144   1.449
  478    HB3  GLU  64           HB3      GLU  64  -4.798  10.214   2.216
  479    HG2  GLU  64           HG2      GLU  64  -4.201   7.965   3.274
  480    HG3  GLU  64           HG3      GLU  64  -2.552   8.305   2.739
  481    H    ASP  65           H        ASP  65  -3.372   9.609  -1.291
  482    HA   ASP  65           HA       ASP  65  -5.096  11.688  -2.098
  483    HB2  ASP  65           HB2      ASP  65  -2.724  11.539  -2.785
  484    HB3  ASP  65           HB3      ASP  65  -3.105  10.133  -3.771
  485    H    GLN  66           H        GLN  66  -4.982   8.287  -2.824
  486    HA   GLN  66           HA       GLN  66  -6.871   8.346  -4.970
  487    HB2  GLN  66           HB2      GLN  66  -5.921   6.076  -3.215
  488    HB3  GLN  66           HB3      GLN  66  -6.903   5.881  -4.661
  489    HG2  GLN  66           HG2      GLN  66  -4.176   7.151  -4.639
  490    HG3  GLN  66           HG3      GLN  66  -4.472   5.445  -4.974
  491   HE21  GLN  66          1HE2      GLN  66  -5.315   4.841  -6.915
  492   HE22  GLN  66          2HE2      GLN  66  -5.521   5.924  -8.250
  493    H    GLY  67           H        GLY  67  -7.176   8.737  -1.645
  494    HA2  GLY  67           HA1      GLY  67  -9.311   9.492  -0.832
  495    HA3  GLY  67           HA2      GLY  67 -10.081   8.341  -1.912
  496    H    TYR  68           H        TYR  68  -7.365   7.645   0.240
  497    HA   TYR  68           HA       TYR  68  -9.193   6.062   1.913
  498    HB2  TYR  68           HB2      TYR  68  -6.402   5.201   1.130
  499    HB3  TYR  68           HB3      TYR  68  -7.568   4.281   2.076
  500    HD1  TYR  68           HD1      TYR  68  -9.803   3.681   0.894
  501    HD2  TYR  68           HD2      TYR  68  -6.284   4.867  -1.183
  502    HE1  TYR  68           HE1      TYR  68 -10.676   2.652  -1.159
  503    HE2  TYR  68           HE2      TYR  68  -7.146   3.836  -3.243
  504    HH   TYR  68           HH       TYR  68 -10.353   2.921  -3.633
  505    H    ASP  69           H        ASP  69  -8.685   5.939   4.091
  506    HA   ASP  69           HA       ASP  69  -6.613   7.819   4.995
  507    HB2  ASP  69           HB2      ASP  69  -8.974   8.177   5.788
  508    HB3  ASP  69           HB3      ASP  69  -8.874   6.623   6.613
  509    H    VAL  70           H        VAL  70  -4.758   6.885   5.527
  510    HA   VAL  70           HA       VAL  70  -4.857   4.173   6.658
  511    HB   VAL  70           HB       VAL  70  -2.667   3.735   5.487
  512   HG11  VAL  70          2HG1      VAL  70  -4.858   2.870   4.713
  513   HG12  VAL  70          1HG1      VAL  70  -3.724   3.146   3.389
  514   HG13  VAL  70          3HG1      VAL  70  -5.026   4.302   3.692
  515   HG21  VAL  70          3HG2      VAL  70  -2.045   5.078   3.605
  516   HG22  VAL  70          2HG2      VAL  70  -2.175   6.141   5.008
  517   HG23  VAL  70          1HG2      VAL  70  -3.468   6.103   3.800
  518    H    GLN  71           H        GLN  71  -3.387   3.661   8.244
  519    HA   GLN  71           HA       GLN  71  -2.109   5.999   9.491
  520    HB2  GLN  71           HB2      GLN  71  -3.245   3.494  10.740
  521    HB3  GLN  71           HB3      GLN  71  -2.357   4.726  11.627
  522    HG2  GLN  71           HG2      GLN  71  -4.888   5.254  10.092
  523    HG3  GLN  71           HG3      GLN  71  -4.827   4.889  11.816
  524   HE21  GLN  71          1HE2      GLN  71  -4.076   7.237   9.349
  525   HE22  GLN  71          2HE2      GLN  71  -3.809   8.564  10.425
  Start of MODEL    2
    1    H1   SER   1           H1       SER   1  16.570  -5.851  -5.887
    2    H2   SER   1           H2       SER   1  15.140  -6.733  -5.673
    3    H3   SER   1           H3       SER   1  16.580  -7.274  -4.970
    4    HA   SER   1           HA       SER   1  15.335  -4.685  -4.303
    5    HB2  SER   1           HB2      SER   1  15.047  -7.329  -2.854
    6    HB3  SER   1           HB3      SER   1  14.429  -5.773  -2.292
    7    HG   SER   1           HG       SER   1  13.322  -5.794  -4.482
    8    H    ASN   2           H        ASN   2  16.204  -3.775  -2.373
    9    HA   ASN   2           HA       ASN   2  18.925  -4.748  -1.772
   10    HB2  ASN   2           HB2      ASN   2  18.663  -2.517  -2.997
   11    HB3  ASN   2           HB3      ASN   2  17.952  -1.897  -1.512
   12   HD21  ASN   2          1HD2      ASN   2  20.360  -1.083  -2.891
   13   HD22  ASN   2          2HD2      ASN   2  21.665  -1.266  -1.765
   14    H    ALA   3           H        ALA   3  16.223  -2.864  -0.432
   15    HA   ALA   3           HA       ALA   3  16.509  -4.331   2.085
   16    HB1  ALA   3           HB1      ALA   3  16.333  -1.320   1.962
   17    HB2  ALA   3           HB2      ALA   3  16.341  -2.305   3.424
   18    HB3  ALA   3           HB3      ALA   3  17.772  -2.244   2.394
   19    H    MET   4           H        MET   4  14.618  -5.422   1.684
   20    HA   MET   4           HA       MET   4  12.297  -3.879   0.866
   21    HB2  MET   4           HB2      MET   4  11.212  -6.035   0.489
   22    HB3  MET   4           HB3      MET   4  12.749  -5.922  -0.351
   23    HG2  MET   4           HG2      MET   4  13.710  -7.176   1.673
   24    HG3  MET   4           HG3      MET   4  12.030  -7.561   2.045
   25    HE1  MET   4           HE1      MET   4  10.389  -8.584   0.003
   26    HE2  MET   4           HE2      MET   4  11.111  -7.498  -1.187
   27    HE3  MET   4           HE3      MET   4  11.064  -9.234  -1.493
   28    H    GLU   5           H        GLU   5  10.708  -3.305   2.069
   29    HA   GLU   5           HA       GLU   5  10.579  -4.209   4.868
   30    HB2  GLU   5           HB2      GLU   5   9.965  -1.607   3.508
   31    HB3  GLU   5           HB3      GLU   5   9.226  -1.983   5.051
   32    HG2  GLU   5           HG2      GLU   5  12.162  -1.759   4.448
   33    HG3  GLU   5           HG3      GLU   5  11.183  -0.650   5.402
   34    H    GLN   6           H        GLN   6   8.532  -4.670   5.777
   35    HA   GLN   6           HA       GLN   6   6.337  -4.961   3.826
   36    HB2  GLN   6           HB2      GLN   6   7.118  -6.850   6.051
   37    HB3  GLN   6           HB3      GLN   6   5.612  -6.961   5.151
   38    HG2  GLN   6           HG2      GLN   6   6.863  -7.317   3.090
   39    HG3  GLN   6           HG3      GLN   6   8.378  -7.190   3.983
   40   HE21  GLN   6          1HE2      GLN   6   7.246  -9.402   2.408
   41   HE22  GLN   6          2HE2      GLN   6   7.199 -10.755   3.482
   42    H    LEU   7           H        LEU   7   5.137  -3.241   4.340
   43    HA   LEU   7           HA       LEU   7   4.602  -2.679   7.169
   44    HB2  LEU   7           HB2      LEU   7   5.464  -0.838   5.758
   45    HB3  LEU   7           HB3      LEU   7   4.058  -0.990   4.726
   46    HG   LEU   7           HG       LEU   7   2.618  -0.371   6.649
   47   HD11  LEU   7          2HD1      LEU   7   5.251   0.108   8.037
   48   HD12  LEU   7          1HD1      LEU   7   4.046  -1.105   8.468
   49   HD13  LEU   7          3HD1      LEU   7   3.672   0.610   8.639
   50   HD21  LEU   7          3HD2      LEU   7   3.250   2.001   6.677
   51   HD22  LEU   7          2HD2      LEU   7   3.321   1.316   5.052
   52   HD23  LEU   7          1HD2      LEU   7   4.808   1.582   5.963
   53    H    THR   8           H        THR   8   2.689  -3.124   8.029
   54    HA   THR   8           HA       THR   8   0.430  -3.724   6.238
   55    HB   THR   8           HB       THR   8   0.552  -4.423   9.164
   56    HG1  THR   8           HG1      THR   8   1.219  -6.436   7.366
   57   HG21  THR   8          3HG2      THR   8  -0.975  -6.223   8.472
   58   HG22  THR   8          1HG2      THR   8  -0.878  -5.658   6.804
   59   HG23  THR   8          2HG2      THR   8  -1.610  -4.634   8.041
   60    H    LEU   9           H        LEU   9  -0.737  -1.896   5.985
   61    HA   LEU   9           HA       LEU   9  -1.109  -0.168   8.335
   62    HB2  LEU   9           HB2      LEU   9  -1.816   1.543   6.526
   63    HB3  LEU   9           HB3      LEU   9  -0.118   1.239   6.805
   64    HG   LEU   9           HG       LEU   9  -1.600  -0.166   4.594
   65   HD11  LEU   9          2HD1      LEU   9  -0.876   1.621   3.095
   66   HD12  LEU   9          1HD1      LEU   9  -0.257   2.530   4.473
   67   HD13  LEU   9          3HD1      LEU   9  -1.989   2.230   4.321
   68   HD21  LEU   9          3HD2      LEU   9   1.292   0.621   4.980
   69   HD22  LEU   9          2HD2      LEU   9   0.634  -0.239   3.588
   70   HD23  LEU   9          1HD2      LEU   9   0.629  -1.001   5.179
   71    H    GLN  10           H        GLN  10  -3.108   0.534   8.933
   72    HA   GLN  10           HA       GLN  10  -5.325  -1.130   8.094
   73    HB2  GLN  10           HB2      GLN  10  -5.212   1.137  10.091
   74    HB3  GLN  10           HB3      GLN  10  -6.571   0.042   9.871
   75    HG2  GLN  10           HG2      GLN  10  -5.136  -1.829  10.546
   76    HG3  GLN  10           HG3      GLN  10  -3.809  -0.696  10.793
   77   HE21  GLN  10          1HE2      GLN  10  -3.877   0.720  12.525
   78   HE22  GLN  10          2HE2      GLN  10  -4.939   0.478  13.875
   79    H    VAL  11           H        VAL  11  -7.132  -0.482   6.974
   80    HA   VAL  11           HA       VAL  11  -6.829   2.093   5.571
   81    HB   VAL  11           HB       VAL  11  -8.132  -0.441   4.568
   82   HG11  VAL  11          2HG1      VAL  11  -7.555   2.161   3.155
   83   HG12  VAL  11          1HG1      VAL  11  -9.146   1.563   3.624
   84   HG13  VAL  11          3HG1      VAL  11  -8.204   0.703   2.407
   85   HG21  VAL  11          3HG2      VAL  11  -6.206  -0.581   3.060
   86   HG22  VAL  11          2HG2      VAL  11  -5.726  -0.690   4.754
   87   HG23  VAL  11          1HG2      VAL  11  -5.487   0.814   3.863
   88    H    GLU  12           H        GLU  12  -8.261   3.544   6.232
   89    HA   GLU  12           HA       GLU  12 -10.943   2.686   7.005
   90    HB2  GLU  12           HB2      GLU  12  -9.670   4.287   8.439
   91    HB3  GLU  12           HB3      GLU  12  -9.682   5.436   7.107
   92    HG2  GLU  12           HG2      GLU  12 -12.159   5.384   7.178
   93    HG3  GLU  12           HG3      GLU  12 -12.048   4.394   8.634
   94    H    GLY  13           H        GLY  13 -12.289   2.439   5.346
   95    HA2  GLY  13           HA1      GLY  13 -13.418   4.312   3.798
   96    HA3  GLY  13           HA2      GLY  13 -11.946   3.974   2.899
   97    H    MET  14           H        MET  14 -11.918   2.292   1.553
   98    HA   MET  14           HA       MET  14 -12.545   0.529   0.319
   99    HB2  MET  14           HB2      MET  14 -13.784  -0.304   2.936
  100    HB3  MET  14           HB3      MET  14 -13.733  -1.318   1.510
  101    HG2  MET  14           HG2      MET  14 -11.322  -0.219   2.916
  102    HG3  MET  14           HG3      MET  14 -11.967  -1.845   3.128
  103    HE1  MET  14           HE1      MET  14  -8.972  -1.550   2.462
  104    HE2  MET  14           HE2      MET  14  -9.802  -3.107   2.523
  105    HE3  MET  14           HE3      MET  14  -8.773  -2.709   1.146
  106    H    SER  15           H        SER  15 -14.564  -0.862  -0.298
  107    HA   SER  15           HA       SER  15 -17.162   0.134   0.100
  108    HB2  SER  15           HB2      SER  15 -16.250   1.997  -1.334
  109    HB3  SER  15           HB3      SER  15 -16.005   0.814  -2.618
  110    HG   SER  15           HG       SER  15 -18.032   1.027  -3.103
  111    H    CYS  16           H        CYS  16 -15.108  -1.283  -2.436
  112    HA   CYS  16           HA       CYS  16 -16.531  -3.806  -2.215
  113    HB2  CYS  16           HB2      CYS  16 -16.323  -2.279  -4.827
  114    HB3  CYS  16           HB3      CYS  16 -16.866  -3.947  -4.679
  115    HG   CYS  16           HG       CYS  16 -18.652  -2.096  -2.658
  116    H    GLY  17           H        GLY  17 -15.393  -5.165  -4.306
  117    HA2  GLY  17           HA1      GLY  17 -12.647  -5.366  -3.469
  118    HA3  GLY  17           HA2      GLY  17 -13.432  -6.321  -4.719
  119    H    HIS  18           H        HIS  18 -14.285  -3.493  -5.720
  120    HA   HIS  18           HA       HIS  18 -12.449  -3.366  -7.849
  121    HB2  HIS  18           HB2      HIS  18 -14.916  -2.503  -7.629
  122    HB3  HIS  18           HB3      HIS  18 -14.148  -1.024  -7.060
  123    HD1  HIS  18           HD1      HIS  18 -13.120   0.500  -8.794
  124    HD2  HIS  18           HD2      HIS  18 -14.289  -3.186 -10.329
  125    HE1  HIS  18           HE1      HIS  18 -12.919   0.706 -11.294
  126    HE2  HIS  18           HE2      HIS  18 -13.830  -1.468 -12.202
  127    H    CYS  19           H        CYS  19 -12.936  -1.236  -5.034
  128    HA   CYS  19           HA       CYS  19 -10.809   0.511  -5.634
  129    HB2  CYS  19           HB2      CYS  19 -11.031   1.256  -3.280
  130    HB3  CYS  19           HB3      CYS  19 -12.572   1.195  -4.124
  131    HG   CYS  19           HG       CYS  19 -11.439  -0.895  -1.672
  132    H    VAL  20           H        VAL  20 -10.916  -2.609  -4.177
  133    HA   VAL  20           HA       VAL  20  -8.474  -2.572  -2.759
  134    HB   VAL  20           HB       VAL  20  -9.948  -4.885  -4.030
  135   HG11  VAL  20          2HG1      VAL  20  -7.619  -5.486  -3.681
  136   HG12  VAL  20          1HG1      VAL  20  -8.650  -6.325  -2.522
  137   HG13  VAL  20          3HG1      VAL  20  -7.705  -4.925  -2.012
  138   HG21  VAL  20          3HG2      VAL  20  -9.906  -3.866  -1.192
  139   HG22  VAL  20          2HG2      VAL  20 -10.759  -5.301  -1.762
  140   HG23  VAL  20          1HG2      VAL  20 -11.238  -3.706  -2.338
  141    H    ASN  21           H        ASN  21  -9.275  -3.692  -6.046
  142    HA   ASN  21           HA       ASN  21  -6.583  -4.307  -6.719
  143    HB2  ASN  21           HB2      ASN  21  -8.999  -3.790  -8.462
  144    HB3  ASN  21           HB3      ASN  21  -7.442  -4.338  -9.078
  145   HD21  ASN  21          1HD2      ASN  21 -10.022  -5.667  -9.187
  146   HD22  ASN  21          2HD2      ASN  21  -9.826  -7.183  -8.375
  147    H    ALA  22           H        ALA  22  -8.577  -1.440  -6.989
  148    HA   ALA  22           HA       ALA  22  -6.879   0.142  -8.560
  149    HB1  ALA  22           HB1      ALA  22  -8.720   1.003  -6.325
  150    HB2  ALA  22           HB2      ALA  22  -8.012   2.068  -7.540
  151    HB3  ALA  22           HB3      ALA  22  -9.159   0.817  -8.023
  152    H    ILE  23           H        ILE  23  -7.148   0.027  -4.990
  153    HA   ILE  23           HA       ILE  23  -4.921   1.701  -4.552
  154    HB   ILE  23           HB       ILE  23  -6.617   1.386  -2.823
  155   HG12  ILE  23          2HG1      ILE  23  -3.876   0.458  -1.944
  156   HG13  ILE  23          3HG1      ILE  23  -4.371   2.131  -2.175
  157   HG21  ILE  23          2HG2      ILE  23  -7.118  -0.967  -3.143
  158   HG22  ILE  23          1HG2      ILE  23  -6.691  -0.649  -1.462
  159   HG23  ILE  23          3HG2      ILE  23  -5.519  -1.407  -2.542
  160   HD11  ILE  23          3HD1      ILE  23  -5.592   0.248  -0.175
  161   HD12  ILE  23          2HD1      ILE  23  -5.930   1.968  -0.353
  162   HD13  ILE  23          1HD1      ILE  23  -4.337   1.433   0.188
  163    H    GLU  24           H        GLU  24  -5.216  -1.803  -4.878
  164    HA   GLU  24           HA       GLU  24  -2.692  -2.623  -4.109
  165    HB2  GLU  24           HB2      GLU  24  -4.361  -4.240  -4.823
  166    HB3  GLU  24           HB3      GLU  24  -4.330  -3.597  -6.463
  167    HG2  GLU  24           HG2      GLU  24  -1.834  -4.232  -6.429
  168    HG3  GLU  24           HG3      GLU  24  -2.262  -5.221  -5.035
  169    H    SER  25           H        SER  25  -3.693  -1.514  -7.353
  170    HA   SER  25           HA       SER  25  -1.021  -1.506  -8.326
  171    HB2  SER  25           HB2      SER  25  -3.409  -0.049  -9.454
  172    HB3  SER  25           HB3      SER  25  -1.879  -0.388 -10.276
  173    HG   SER  25           HG       SER  25  -4.032  -2.060  -9.735
  174    H    SER  26           H        SER  26  -3.057   0.921  -6.790
  175    HA   SER  26           HA       SER  26  -1.661   3.220  -7.460
  176    HB2  SER  26           HB2      SER  26  -2.940   2.545  -4.798
  177    HB3  SER  26           HB3      SER  26  -2.523   4.167  -5.352
  178    HG   SER  26           HG       SER  26  -3.995   2.922  -7.223
  179    H    VAL  27           H        VAL  27  -0.975   0.808  -4.978
  180    HA   VAL  27           HA       VAL  27   1.508   2.089  -4.233
  181    HB   VAL  27           HB       VAL  27   0.644  -0.731  -3.593
  182   HG11  VAL  27          2HG1      VAL  27   2.554   1.155  -2.226
  183   HG12  VAL  27          1HG1      VAL  27   2.991  -0.252  -3.196
  184   HG13  VAL  27          3HG1      VAL  27   2.129  -0.465  -1.672
  185   HG21  VAL  27          3HG2      VAL  27  -1.106   0.812  -2.892
  186   HG22  VAL  27          2HG2      VAL  27   0.086   1.789  -2.035
  187   HG23  VAL  27          1HG2      VAL  27  -0.257   0.144  -1.498
  188    H    LYS  28           H        LYS  28   0.503  -0.779  -6.059
  189    HA   LYS  28           HA       LYS  28   3.021  -1.902  -6.464
  190    HB2  LYS  28           HB2      LYS  28   0.893  -3.080  -6.793
  191    HB3  LYS  28           HB3      LYS  28   0.579  -2.105  -8.217
  192    HG2  LYS  28           HG2      LYS  28   1.363  -4.305  -8.829
  193    HG3  LYS  28           HG3      LYS  28   2.515  -3.064  -9.325
  194    HD2  LYS  28           HD2      LYS  28   3.945  -3.575  -7.461
  195    HD3  LYS  28           HD3      LYS  28   2.752  -4.698  -6.802
  196    HE2  LYS  28           HE2      LYS  28   4.522  -5.912  -7.939
  197    HE3  LYS  28           HE3      LYS  28   2.986  -6.099  -8.787
  198    HZ1  LYS  28           HZ1      LYS  28   3.674  -4.697 -10.498
  199    HZ2  LYS  28           HZ2      LYS  28   5.052  -5.634 -10.171
  200    HZ3  LYS  28           HZ3      LYS  28   4.952  -4.044  -9.599
  201    H    GLU  29           H        GLU  29   1.313   0.514  -8.416
  202    HA   GLU  29           HA       GLU  29   2.969   0.367 -10.697
  203    HB2  GLU  29           HB2      GLU  29   1.317   2.640  -9.595
  204    HB3  GLU  29           HB3      GLU  29   2.134   2.698 -11.149
  205    HG2  GLU  29           HG2      GLU  29   0.816   0.751 -11.882
  206    HG3  GLU  29           HG3      GLU  29  -0.036   0.776 -10.339
  207    H    LEU  30           H        LEU  30   3.388   1.790  -7.620
  208    HA   LEU  30           HA       LEU  30   5.245   3.827  -8.297
  209    HB2  LEU  30           HB2      LEU  30   4.980   2.361  -5.673
  210    HB3  LEU  30           HB3      LEU  30   5.780   3.901  -5.916
  211    HG   LEU  30           HG       LEU  30   2.830   3.324  -6.114
  212   HD11  LEU  30          2HD1      LEU  30   4.445   5.084  -4.282
  213   HD12  LEU  30          1HD1      LEU  30   3.677   3.555  -3.856
  214   HD13  LEU  30          3HD1      LEU  30   2.687   4.949  -4.290
  215   HD21  LEU  30          3HD2      LEU  30   2.568   5.725  -6.606
  216   HD22  LEU  30          2HD2      LEU  30   3.410   4.858  -7.891
  217   HD23  LEU  30          1HD2      LEU  30   4.319   5.866  -6.763
  218    H    ASN  31           H        ASN  31   7.437   3.870  -8.372
  219    HA   ASN  31           HA       ASN  31   8.826   1.471  -8.999
  220    HB2  ASN  31           HB2      ASN  31   9.461   3.585 -10.026
  221    HB3  ASN  31           HB3      ASN  31   9.857   4.264  -8.450
  222   HD21  ASN  31          1HD2      ASN  31  11.957   4.710  -9.082
  223   HD22  ASN  31          2HD2      ASN  31  13.148   3.467  -9.270
  224    H    GLY  32           H        GLY  32   9.791   0.071  -7.690
  225    HA2  GLY  32           HA1      GLY  32  11.386  -0.337  -5.920
  226    HA3  GLY  32           HA2      GLY  32  10.672   1.009  -5.042
  227    H    VAL  33           H        VAL  33   7.992  -0.187  -6.106
  228    HA   VAL  33           HA       VAL  33   7.517  -1.701  -3.704
  229    HB   VAL  33           HB       VAL  33   5.669  -0.932  -5.964
  230   HG11  VAL  33          2HG1      VAL  33   5.019  -2.230  -3.318
  231   HG12  VAL  33          1HG1      VAL  33   4.909  -2.995  -4.903
  232   HG13  VAL  33          3HG1      VAL  33   3.845  -1.648  -4.499
  233   HG21  VAL  33          3HG2      VAL  33   6.422   0.965  -4.683
  234   HG22  VAL  33          2HG2      VAL  33   6.055   0.134  -3.171
  235   HG23  VAL  33          1HG2      VAL  33   4.748   0.613  -4.254
  236    H    GLU  34           H        GLU  34   7.526  -3.794  -3.501
  237    HA   GLU  34           HA       GLU  34   8.120  -5.435  -5.825
  238    HB2  GLU  34           HB2      GLU  34   9.555  -5.756  -3.930
  239    HB3  GLU  34           HB3      GLU  34   8.184  -5.950  -2.850
  240    HG2  GLU  34           HG2      GLU  34   9.126  -8.090  -3.201
  241    HG3  GLU  34           HG3      GLU  34   7.601  -8.035  -4.076
  242    H    GLN  35           H        GLN  35   6.001  -5.854  -2.974
  243    HA   GLN  35           HA       GLN  35   3.971  -7.015  -4.751
  244    HB2  GLN  35           HB2      GLN  35   4.911  -8.253  -2.158
  245    HB3  GLN  35           HB3      GLN  35   3.567  -8.828  -3.134
  246    HG2  GLN  35           HG2      GLN  35   5.111  -9.301  -4.971
  247    HG3  GLN  35           HG3      GLN  35   6.454  -8.739  -3.978
  248   HE21  GLN  35          1HE2      GLN  35   6.055 -11.330  -5.183
  249   HE22  GLN  35          2HE2      GLN  35   6.053 -12.480  -3.882
  250    H    VAL  36           H        VAL  36   1.853  -6.759  -4.090
  251    HA   VAL  36           HA       VAL  36   1.413  -5.198  -1.634
  252    HB   VAL  36           HB       VAL  36  -0.060  -4.735  -4.235
  253   HG11  VAL  36          2HG1      VAL  36  -0.111  -3.269  -1.602
  254   HG12  VAL  36          1HG1      VAL  36  -1.409  -4.243  -2.292
  255   HG13  VAL  36          3HG1      VAL  36  -0.926  -2.737  -3.072
  256   HG21  VAL  36          3HG2      VAL  36   2.102  -3.069  -2.948
  257   HG22  VAL  36          2HG2      VAL  36   1.131  -2.584  -4.338
  258   HG23  VAL  36          1HG2      VAL  36   2.229  -3.958  -4.466
  259    H    LYS  37           H        LYS  37   0.042  -6.204  -0.319
  260    HA   LYS  37           HA       LYS  37  -2.024  -7.913  -1.519
  261    HB2  LYS  37           HB2      LYS  37  -1.835  -9.196   0.732
  262    HB3  LYS  37           HB3      LYS  37  -0.637  -9.488  -0.522
  263    HG2  LYS  37           HG2      LYS  37   0.893  -7.931   0.601
  264    HG3  LYS  37           HG3      LYS  37  -0.300  -7.706   1.878
  265    HD2  LYS  37           HD2      LYS  37   0.950 -10.348   1.144
  266    HD3  LYS  37           HD3      LYS  37   1.500  -9.310   2.461
  267    HE2  LYS  37           HE2      LYS  37  -0.910  -9.455   3.321
  268    HE3  LYS  37           HE3      LYS  37  -1.087 -10.806   2.201
  269    HZ1  LYS  37           HZ1      LYS  37   0.807 -11.881   3.294
  270    HZ2  LYS  37           HZ2      LYS  37  -0.471 -11.604   4.374
  271    HZ3  LYS  37           HZ3      LYS  37   0.895 -10.598   4.405
  272    H    VAL  38           H        VAL  38  -3.644  -6.467  -1.482
  273    HA   VAL  38           HA       VAL  38  -4.271  -4.980   0.943
  274    HB   VAL  38           HB       VAL  38  -5.767  -5.106  -1.684
  275   HG11  VAL  38          2HG1      VAL  38  -5.985  -3.192   0.635
  276   HG12  VAL  38          1HG1      VAL  38  -7.196  -4.367   0.120
  277   HG13  VAL  38          3HG1      VAL  38  -6.796  -2.998  -0.919
  278   HG21  VAL  38          3HG2      VAL  38  -3.529  -4.250  -2.014
  279   HG22  VAL  38          2HG2      VAL  38  -3.752  -3.103  -0.693
  280   HG23  VAL  38          1HG2      VAL  38  -4.709  -2.947  -2.167
  281    H    GLN  39           H        GLN  39  -5.766  -5.592   2.402
  282    HA   GLN  39           HA       GLN  39  -7.362  -7.956   1.737
  283    HB2  GLN  39           HB2      GLN  39  -6.629  -6.921   4.484
  284    HB3  GLN  39           HB3      GLN  39  -7.465  -8.427   4.127
  285    HG2  GLN  39           HG2      GLN  39  -4.635  -7.748   3.360
  286    HG3  GLN  39           HG3      GLN  39  -5.133  -8.821   4.666
  287   HE21  GLN  39          1HE2      GLN  39  -3.528  -9.274   2.225
  288   HE22  GLN  39          2HE2      GLN  39  -4.279 -10.611   1.426
  289    H    LEU  40           H        LEU  40  -9.458  -7.730   1.535
  290    HA   LEU  40           HA       LEU  40 -10.683  -5.150   1.983
  291    HB2  LEU  40           HB2      LEU  40 -11.034  -7.080   0.122
  292    HB3  LEU  40           HB3      LEU  40 -12.328  -7.491   1.228
  293    HG   LEU  40           HG       LEU  40 -11.961  -4.857  -0.197
  294   HD11  LEU  40          2HD1      LEU  40 -14.039  -7.015  -0.492
  295   HD12  LEU  40          1HD1      LEU  40 -12.714  -6.693  -1.611
  296   HD13  LEU  40          3HD1      LEU  40 -13.984  -5.490  -1.379
  297   HD21  LEU  40          3HD2      LEU  40 -12.918  -4.522   2.033
  298   HD22  LEU  40          2HD2      LEU  40 -14.164  -5.719   1.675
  299   HD23  LEU  40          1HD2      LEU  40 -14.103  -4.211   0.762
  300    H    ALA  41           H        ALA  41 -11.033  -8.455   3.192
  301    HA   ALA  41           HA       ALA  41 -13.248  -8.061   4.847
  302    HB1  ALA  41           HB1      ALA  41 -12.563 -10.109   5.973
  303    HB2  ALA  41           HB2      ALA  41 -12.394 -10.270   4.225
  304    HB3  ALA  41           HB3      ALA  41 -10.969  -9.998   5.229
  305    H    GLU  42           H        GLU  42  -9.808  -8.113   5.727
  306    HA   GLU  42           HA       GLU  42 -10.288  -7.174   8.373
  307    HB2  GLU  42           HB2      GLU  42  -7.795  -7.505   6.715
  308    HB3  GLU  42           HB3      GLU  42  -7.750  -6.831   8.335
  309    HG2  GLU  42           HG2      GLU  42  -7.186  -9.207   8.307
  310    HG3  GLU  42           HG3      GLU  42  -8.633  -8.884   9.256
  311    H    GLY  43           H        GLY  43  -9.618  -5.660   5.303
  312    HA2  GLY  43           HA1      GLY  43  -9.721  -3.437   4.701
  313    HA3  GLY  43           HA2      GLY  43 -10.188  -3.054   6.353
  314    H    THR  44           H        THR  44  -7.322  -4.748   5.221
  315    HA   THR  44           HA       THR  44  -5.656  -2.496   6.091
  316    HB   THR  44           HB       THR  44  -4.037  -4.245   7.012
  317    HG1  THR  44           HG1      THR  44  -5.226  -6.192   7.739
  318   HG21  THR  44          3HG2      THR  44  -5.191  -4.401   9.182
  319   HG22  THR  44          1HG2      THR  44  -6.689  -3.876   8.414
  320   HG23  THR  44          2HG2      THR  44  -5.309  -2.782   8.493
  321    H    VAL  45           H        VAL  45  -3.710  -2.288   4.989
  322    HA   VAL  45           HA       VAL  45  -3.415  -4.040   2.638
  323    HB   VAL  45           HB       VAL  45  -2.665  -1.118   2.916
  324   HG11  VAL  45          2HG1      VAL  45  -2.300  -2.987   0.571
  325   HG12  VAL  45          1HG1      VAL  45  -1.013  -2.332   1.584
  326   HG13  VAL  45          3HG1      VAL  45  -1.974  -1.253   0.573
  327   HG21  VAL  45          3HG2      VAL  45  -5.041  -1.452   2.576
  328   HG22  VAL  45          2HG2      VAL  45  -4.719  -2.508   1.200
  329   HG23  VAL  45          1HG2      VAL  45  -4.305  -0.796   1.114
  330    H    GLU  46           H        GLU  46  -1.702  -5.305   2.732
  331    HA   GLU  46           HA       GLU  46   0.616  -4.396   4.300
  332    HB2  GLU  46           HB2      GLU  46  -0.476  -6.588   4.896
  333    HB3  GLU  46           HB3      GLU  46   0.027  -7.194   3.325
  334    HG2  GLU  46           HG2      GLU  46   2.313  -7.063   3.898
  335    HG3  GLU  46           HG3      GLU  46   1.967  -6.111   5.344
  336    H    VAL  47           H        VAL  47   2.403  -3.800   3.227
  337    HA   VAL  47           HA       VAL  47   2.584  -4.533   0.376
  338    HB   VAL  47           HB       VAL  47   3.305  -1.833   1.529
  339   HG11  VAL  47          2HG1      VAL  47   3.559  -1.168  -0.813
  340   HG12  VAL  47          1HG1      VAL  47   3.217  -2.823  -1.319
  341   HG13  VAL  47          3HG1      VAL  47   4.669  -2.469  -0.381
  342   HG21  VAL  47          3HG2      VAL  47   0.934  -2.640  -0.150
  343   HG22  VAL  47          2HG2      VAL  47   1.374  -0.984   0.269
  344   HG23  VAL  47          1HG2      VAL  47   0.896  -2.117   1.534
  345    H    THR  48           H        THR  48   4.499  -5.206  -0.331
  346    HA   THR  48           HA       THR  48   6.807  -5.028   1.485
  347    HB   THR  48           HB       THR  48   6.529  -6.790  -0.962
  348    HG1  THR  48           HG1      THR  48   5.203  -7.006   1.301
  349   HG21  THR  48          3HG2      THR  48   8.394  -6.888   1.415
  350   HG22  THR  48          1HG2      THR  48   8.825  -6.393  -0.220
  351   HG23  THR  48          2HG2      THR  48   8.347  -8.061   0.098
  352    H    ILE  49           H        ILE  49   8.124  -3.376   1.033
  353    HA   ILE  49           HA       ILE  49   8.373  -2.517  -1.787
  354    HB   ILE  49           HB       ILE  49   8.742  -0.231  -0.997
  355   HG12  ILE  49          2HG1      ILE  49   7.884  -1.115   1.761
  356   HG13  ILE  49          3HG1      ILE  49   9.582  -1.029   1.307
  357   HG21  ILE  49          2HG2      ILE  49   6.443   0.251  -0.253
  358   HG22  ILE  49          1HG2      ILE  49   6.191  -1.477   0.001
  359   HG23  ILE  49          3HG2      ILE  49   6.504  -0.861  -1.621
  360   HD11  ILE  49          3HD1      ILE  49   7.630   1.260   1.260
  361   HD12  ILE  49          2HD1      ILE  49   9.338   1.343   0.826
  362   HD13  ILE  49          1HD1      ILE  49   8.869   0.968   2.484
  363    H    ASP  50           H        ASP  50  10.405  -1.774  -2.479
  364    HA   ASP  50           HA       ASP  50  12.682  -2.507  -0.820
  365    HB2  ASP  50           HB2      ASP  50  12.682  -2.951  -3.289
  366    HB3  ASP  50           HB3      ASP  50  12.652  -1.211  -3.556
  367    H    SER  51           H        SER  51  12.964  -1.098   0.808
  368    HA   SER  51           HA       SER  51  12.106   1.633   0.531
  369    HB2  SER  51           HB2      SER  51  13.445   0.296   2.886
  370    HB3  SER  51           HB3      SER  51  12.537   1.806   2.906
  371    HG   SER  51           HG       SER  51  11.032  -0.073   1.793
  372    H    SER  52           H        SER  52  14.853   0.147  -0.405
  373    HA   SER  52           HA       SER  52  16.702   2.259   0.226
  374    HB2  SER  52           HB2      SER  52  16.910   0.075  -1.860
  375    HB3  SER  52           HB3      SER  52  18.230   1.086  -1.269
  376    HG   SER  52           HG       SER  52  17.863   0.178   0.820
  377    H    VAL  53           H        VAL  53  14.139   1.863  -1.878
  378    HA   VAL  53           HA       VAL  53  15.140   4.007  -3.633
  379    HB   VAL  53           HB       VAL  53  13.196   1.804  -4.355
  380   HG11  VAL  53          2HG1      VAL  53  13.295   2.724  -6.612
  381   HG12  VAL  53          1HG1      VAL  53  14.349   4.019  -6.046
  382   HG13  VAL  53          3HG1      VAL  53  12.684   3.922  -5.468
  383   HG21  VAL  53          3HG2      VAL  53  15.533   1.050  -4.158
  384   HG22  VAL  53          2HG2      VAL  53  16.017   2.297  -5.307
  385   HG23  VAL  53          1HG2      VAL  53  14.949   0.990  -5.824
  386    H    VAL  54           H        VAL  54  12.026   2.509  -2.706
  387    HA   VAL  54           HA       VAL  54  10.881   5.208  -2.600
  388    HB   VAL  54           HB       VAL  54   9.761   3.561  -4.086
  389   HG11  VAL  54          2HG1      VAL  54   9.115   2.121  -1.521
  390   HG12  VAL  54          1HG1      VAL  54  10.128   1.526  -2.837
  391   HG13  VAL  54          3HG1      VAL  54   8.400   1.774  -3.096
  392   HG21  VAL  54          3HG2      VAL  54   8.511   5.441  -3.183
  393   HG22  VAL  54          2HG2      VAL  54   8.091   4.491  -1.758
  394   HG23  VAL  54          1HG2      VAL  54   7.478   4.020  -3.344
  395    H    THR  55           H        THR  55   9.856   5.960  -0.720
  396    HA   THR  55           HA       THR  55  10.621   4.473   1.682
  397    HB   THR  55           HB       THR  55  10.351   6.513   2.927
  398    HG1  THR  55           HG1      THR  55   9.338   7.647   0.497
  399   HG21  THR  55          3HG2      THR  55  12.451   6.286   1.702
  400   HG22  THR  55          1HG2      THR  55  11.967   7.978   1.811
  401   HG23  THR  55          2HG2      THR  55  11.733   7.089   0.306
  402    H    LEU  56           H        LEU  56   9.033   4.855   3.588
  403    HA   LEU  56           HA       LEU  56   6.594   3.549   2.883
  404    HB2  LEU  56           HB2      LEU  56   7.606   4.726   5.471
  405    HB3  LEU  56           HB3      LEU  56   6.035   3.967   5.333
  406    HG   LEU  56           HG       LEU  56   7.525   2.377   6.293
  407   HD11  LEU  56          2HD1      LEU  56   7.105   1.717   3.386
  408   HD12  LEU  56          1HD1      LEU  56   5.940   1.481   4.689
  409   HD13  LEU  56          3HD1      LEU  56   7.442   0.557   4.670
  410   HD21  LEU  56          3HD2      LEU  56   9.574   1.623   5.157
  411   HD22  LEU  56          2HD2      LEU  56   9.652   3.319   5.635
  412   HD23  LEU  56          1HD2      LEU  56   9.352   2.892   3.951
  413    H    LYS  57           H        LYS  57   7.562   6.831   3.542
  414    HA   LYS  57           HA       LYS  57   5.002   7.951   3.950
  415    HB2  LYS  57           HB2      LYS  57   7.501   8.930   4.145
  416    HB3  LYS  57           HB3      LYS  57   7.041   9.614   2.591
  417    HG2  LYS  57           HG2      LYS  57   5.492   9.922   5.151
  418    HG3  LYS  57           HG3      LYS  57   6.577  11.134   4.467
  419    HD2  LYS  57           HD2      LYS  57   5.146  11.266   2.477
  420    HD3  LYS  57           HD3      LYS  57   4.066  10.056   3.173
  421    HE2  LYS  57           HE2      LYS  57   4.631  12.825   4.226
  422    HE3  LYS  57           HE3      LYS  57   3.123  12.237   3.527
  423    HZ1  LYS  57           HZ1      LYS  57   4.333  11.545   6.134
  424    HZ2  LYS  57           HZ2      LYS  57   3.146  10.565   5.425
  425    HZ3  LYS  57           HZ3      LYS  57   2.787  12.175   5.823
  426    H    ASP  58           H        ASP  58   6.972   7.476   1.040
  427    HA   ASP  58           HA       ASP  58   5.334   8.751  -0.824
  428    HB2  ASP  58           HB2      ASP  58   7.121   6.330  -1.120
  429    HB3  ASP  58           HB3      ASP  58   6.300   7.082  -2.481
  430    H    ILE  59           H        ILE  59   5.299   5.432   0.350
  431    HA   ILE  59           HA       ILE  59   3.234   4.433  -1.238
  432    HB   ILE  59           HB       ILE  59   3.938   3.649   1.596
  433   HG12  ILE  59          2HG1      ILE  59   5.894   3.514   0.167
  434   HG13  ILE  59          3HG1      ILE  59   5.316   1.888   0.518
  435   HG21  ILE  59          2HG2      ILE  59   1.763   2.787   0.894
  436   HG22  ILE  59          1HG2      ILE  59   2.948   1.493   1.064
  437   HG23  ILE  59          3HG2      ILE  59   2.505   2.077  -0.541
  438   HD11  ILE  59          3HD1      ILE  59   4.853   3.422  -2.030
  439   HD12  ILE  59          2HD1      ILE  59   4.261   1.797  -1.684
  440   HD13  ILE  59          1HD1      ILE  59   5.995   2.096  -1.799
  441    H    VAL  60           H        VAL  60   3.081   5.704   2.089
  442    HA   VAL  60           HA       VAL  60   0.303   5.560   2.383
  443    HB   VAL  60           HB       VAL  60   2.252   7.460   3.703
  444   HG11  VAL  60          2HG1      VAL  60  -0.025   8.298   3.898
  445   HG12  VAL  60          1HG1      VAL  60   0.563   7.710   5.454
  446   HG13  VAL  60          3HG1      VAL  60  -0.559   6.732   4.507
  447   HG21  VAL  60          3HG2      VAL  60   2.790   5.121   4.091
  448   HG22  VAL  60          2HG2      VAL  60   1.132   4.810   4.606
  449   HG23  VAL  60          1HG2      VAL  60   2.170   5.865   5.565
  450    H    ALA  61           H        ALA  61   2.344   8.207   1.207
  451    HA   ALA  61           HA       ALA  61   0.385  10.193   1.051
  452    HB1  ALA  61           HB1      ALA  61   2.824   9.842  -0.686
  453    HB2  ALA  61           HB2      ALA  61   1.896  11.329  -0.491
  454    HB3  ALA  61           HB3      ALA  61   2.776  10.651   0.880
  455    H    VAL  62           H        VAL  62   1.361   7.753  -1.328
  456    HA   VAL  62           HA       VAL  62  -0.411   8.751  -3.344
  457    HB   VAL  62           HB       VAL  62   0.995   6.078  -3.149
  458   HG11  VAL  62          2HG1      VAL  62  -0.939   5.951  -4.633
  459   HG12  VAL  62          1HG1      VAL  62   0.564   5.885  -5.555
  460   HG13  VAL  62          3HG1      VAL  62  -0.376   7.377  -5.504
  461   HG21  VAL  62          3HG2      VAL  62   2.542   7.958  -3.246
  462   HG22  VAL  62          2HG2      VAL  62   1.707   8.587  -4.666
  463   HG23  VAL  62          1HG2      VAL  62   2.571   7.052  -4.759
  464    H    ILE  63           H        ILE  63  -0.584   6.296  -0.835
  465    HA   ILE  63           HA       ILE  63  -2.962   5.057  -1.737
  466    HB   ILE  63           HB       ILE  63  -1.680   5.172   0.987
  467   HG12  ILE  63          2HG1      ILE  63  -1.962   2.959  -1.059
  468   HG13  ILE  63          3HG1      ILE  63  -0.504   3.902  -0.764
  469   HG21  ILE  63          2HG2      ILE  63  -4.110   3.589   0.157
  470   HG22  ILE  63          1HG2      ILE  63  -4.080   4.926   1.305
  471   HG23  ILE  63          3HG2      ILE  63  -3.246   3.420   1.686
  472   HD11  ILE  63          3HD1      ILE  63  -0.354   2.999   1.479
  473   HD12  ILE  63          2HD1      ILE  63  -0.400   1.706   0.281
  474   HD13  ILE  63          1HD1      ILE  63  -1.841   2.086   1.226
  475    H    GLU  64           H        GLU  64  -2.421   7.608   0.717
  476    HA   GLU  64           HA       GLU  64  -5.178   7.882   1.316
  477    HB2  GLU  64           HB2      GLU  64  -2.961   9.906   1.682
  478    HB3  GLU  64           HB3      GLU  64  -4.558   9.991   2.415
  479    HG2  GLU  64           HG2      GLU  64  -3.985   7.698   3.427
  480    HG3  GLU  64           HG3      GLU  64  -2.321   8.095   2.997
  481    H    ASP  65           H        ASP  65  -3.141   9.138  -1.169
  482    HA   ASP  65           HA       ASP  65  -4.718  11.283  -2.073
  483    HB2  ASP  65           HB2      ASP  65  -2.396  10.904  -2.798
  484    HB3  ASP  65           HB3      ASP  65  -2.899   9.454  -3.658
  485    H    GLN  66           H        GLN  66  -5.087   7.861  -2.362
  486    HA   GLN  66           HA       GLN  66  -6.879   7.958  -4.622
  487    HB2  GLN  66           HB2      GLN  66  -6.420   5.668  -2.707
  488    HB3  GLN  66           HB3      GLN  66  -7.113   5.580  -4.320
  489    HG2  GLN  66           HG2      GLN  66  -4.280   6.352  -3.666
  490    HG3  GLN  66           HG3      GLN  66  -4.810   4.780  -4.261
  491   HE21  GLN  66          1HE2      GLN  66  -2.962   6.779  -5.375
  492   HE22  GLN  66          2HE2      GLN  66  -3.550   7.121  -6.964
  493    H    GLY  67           H        GLY  67  -7.209   8.843  -1.471
  494    HA2  GLY  67           HA1      GLY  67  -9.267   9.707  -0.657
  495    HA3  GLY  67           HA2      GLY  67 -10.120   8.522  -1.635
  496    H    TYR  68           H        TYR  68  -7.384   7.572   0.302
  497    HA   TYR  68           HA       TYR  68  -9.246   6.231   2.154
  498    HB2  TYR  68           HB2      TYR  68  -6.435   5.337   1.469
  499    HB3  TYR  68           HB3      TYR  68  -7.601   4.486   2.473
  500    HD1  TYR  68           HD1      TYR  68  -9.841   3.815   1.314
  501    HD2  TYR  68           HD2      TYR  68  -6.261   4.776  -0.778
  502    HE1  TYR  68           HE1      TYR  68 -10.659   2.578  -0.648
  503    HE2  TYR  68           HE2      TYR  68  -7.071   3.541  -2.740
  504    HH   TYR  68           HH       TYR  68  -8.666   1.717  -3.234
  505    H    ASP  69           H        ASP  69  -8.782   6.247   4.332
  506    HA   ASP  69           HA       ASP  69  -6.544   7.974   5.149
  507    HB2  ASP  69           HB2      ASP  69  -9.142   7.341   6.567
  508    HB3  ASP  69           HB3      ASP  69  -7.799   8.193   7.325
  509    H    VAL  70           H        VAL  70  -4.863   6.673   5.503
  510    HA   VAL  70           HA       VAL  70  -5.437   4.037   6.654
  511    HB   VAL  70           HB       VAL  70  -3.237   3.337   5.652
  512   HG11  VAL  70          2HG1      VAL  70  -4.162   3.043   3.422
  513   HG12  VAL  70          1HG1      VAL  70  -5.349   4.310   3.732
  514   HG13  VAL  70          3HG1      VAL  70  -5.412   2.801   4.643
  515   HG21  VAL  70          3HG2      VAL  70  -2.344   5.643   5.372
  516   HG22  VAL  70          2HG2      VAL  70  -3.522   5.894   4.079
  517   HG23  VAL  70          1HG2      VAL  70  -2.263   4.667   3.905
  518    H    GLN  71           H        GLN  71  -4.110   3.137   8.179
  519    HA   GLN  71           HA       GLN  71  -2.192   4.912   9.509
  520    HB2  GLN  71           HB2      GLN  71  -4.362   3.266  10.826
  521    HB3  GLN  71           HB3      GLN  71  -3.005   3.968  11.697
  522    HG2  GLN  71           HG2      GLN  71  -3.726   6.196  11.068
  523    HG3  GLN  71           HG3      GLN  71  -5.056   5.519  10.132
  524   HE21  GLN  71          1HE2      GLN  71  -6.556   6.674  11.375
  525   HE22  GLN  71          2HE2      GLN  71  -6.965   6.186  12.990
  Start of MODEL    3
    1    H1   SER   1           H1       SER   1  21.940  -1.039  -2.501
    2    H2   SER   1           H2       SER   1  23.263  -2.055  -2.207
    3    H3   SER   1           H3       SER   1  22.304  -1.516  -0.916
    4    HA   SER   1           HA       SER   1  21.402  -3.272  -3.113
    5    HB2  SER   1           HB2      SER   1  21.219  -4.944  -1.185
    6    HB3  SER   1           HB3      SER   1  22.849  -4.560  -1.739
    7    HG   SER   1           HG       SER   1  23.228  -4.030   0.248
    8    H    ASN   2           H        ASN   2  19.413  -4.555  -1.949
    9    HA   ASN   2           HA       ASN   2  17.502  -2.364  -1.596
   10    HB2  ASN   2           HB2      ASN   2  16.935  -5.264  -2.254
   11    HB3  ASN   2           HB3      ASN   2  15.807  -3.917  -2.347
   12   HD21  ASN   2          1HD2      ASN   2  16.068  -2.368  -4.013
   13   HD22  ASN   2          2HD2      ASN   2  16.921  -2.783  -5.471
   14    H    ALA   3           H        ALA   3  15.809  -2.533  -0.056
   15    HA   ALA   3           HA       ALA   3  16.267  -4.426   2.149
   16    HB1  ALA   3           HB1      ALA   3  15.939  -2.652   3.798
   17    HB2  ALA   3           HB2      ALA   3  17.341  -2.317   2.782
   18    HB3  ALA   3           HB3      ALA   3  15.825  -1.460   2.503
   19    H    MET   4           H        MET   4  14.468  -5.625   1.761
   20    HA   MET   4           HA       MET   4  11.997  -4.335   1.001
   21    HB2  MET   4           HB2      MET   4  12.837  -7.196   1.287
   22    HB3  MET   4           HB3      MET   4  11.153  -6.757   1.038
   23    HG2  MET   4           HG2      MET   4  11.781  -5.595  -1.028
   24    HG3  MET   4           HG3      MET   4  13.452  -6.101  -0.784
   25    HE1  MET   4           HE1      MET   4  13.194  -6.952  -3.329
   26    HE2  MET   4           HE2      MET   4  12.044  -8.193  -3.828
   27    HE3  MET   4           HE3      MET   4  11.466  -6.595  -3.351
   28    H    GLU   5           H        GLU   5  10.842  -3.400   2.479
   29    HA   GLU   5           HA       GLU   5  10.454  -4.720   5.076
   30    HB2  GLU   5           HB2      GLU   5   9.865  -1.878   4.215
   31    HB3  GLU   5           HB3      GLU   5   9.552  -2.528   5.817
   32    HG2  GLU   5           HG2      GLU   5  12.247  -2.231   4.510
   33    HG3  GLU   5           HG3      GLU   5  11.587  -1.216   5.793
   34    H    GLN   6           H        GLN   6   8.413  -5.264   5.774
   35    HA   GLN   6           HA       GLN   6   6.287  -5.066   3.747
   36    HB2  GLN   6           HB2      GLN   6   6.594  -7.053   6.004
   37    HB3  GLN   6           HB3      GLN   6   5.251  -7.001   4.870
   38    HG2  GLN   6           HG2      GLN   6   6.697  -7.545   3.043
   39    HG3  GLN   6           HG3      GLN   6   8.117  -7.422   4.076
   40   HE21  GLN   6          1HE2      GLN   6   5.105  -8.941   5.078
   41   HE22  GLN   6          2HE2      GLN   6   5.739 -10.548   5.135
   42    H    LEU   7           H        LEU   7   5.322  -3.175   4.257
   43    HA   LEU   7           HA       LEU   7   4.685  -2.606   7.049
   44    HB2  LEU   7           HB2      LEU   7   4.437  -0.948   4.540
   45    HB3  LEU   7           HB3      LEU   7   3.834  -0.419   6.097
   46    HG   LEU   7           HG       LEU   7   5.896   0.658   5.844
   47   HD11  LEU   7          2HD1      LEU   7   6.402  -1.803   7.500
   48   HD12  LEU   7          1HD1      LEU   7   5.645  -0.307   8.045
   49   HD13  LEU   7          3HD1      LEU   7   7.342  -0.311   7.562
   50   HD21  LEU   7          3HD2      LEU   7   7.969  -0.462   5.203
   51   HD22  LEU   7          2HD2      LEU   7   6.737  -0.605   3.950
   52   HD23  LEU   7          1HD2      LEU   7   7.089  -1.976   5.003
   53    H    THR   8           H        THR   8   2.771  -3.010   7.894
   54    HA   THR   8           HA       THR   8   0.507  -3.504   6.071
   55    HB   THR   8           HB       THR   8   0.737  -4.476   8.923
   56    HG1  THR   8           HG1      THR   8   2.030  -5.345   6.703
   57   HG21  THR   8          3HG2      THR   8  -0.997  -6.064   8.212
   58   HG22  THR   8          1HG2      THR   8  -0.997  -5.343   6.602
   59   HG23  THR   8          2HG2      THR   8  -1.529  -4.397   7.992
   60    H    LEU   9           H        LEU   9  -0.634  -1.669   5.951
   61    HA   LEU   9           HA       LEU   9  -0.931  -0.040   8.373
   62    HB2  LEU   9           HB2      LEU   9  -1.812   1.638   6.564
   63    HB3  LEU   9           HB3      LEU   9  -0.096   1.423   6.835
   64    HG   LEU   9           HG       LEU   9  -0.348  -0.325   4.875
   65   HD11  LEU   9          2HD1      LEU   9  -2.671   1.538   4.428
   66   HD12  LEU   9          1HD1      LEU   9  -2.751  -0.203   4.691
   67   HD13  LEU   9          3HD1      LEU   9  -2.005   0.437   3.224
   68   HD21  LEU   9          3HD2      LEU   9   0.203   1.455   3.284
   69   HD22  LEU   9          2HD2      LEU   9   1.067   1.652   4.809
   70   HD23  LEU   9          1HD2      LEU   9  -0.336   2.660   4.454
   71    H    GLN  10           H        GLN  10  -2.893   0.654   9.109
   72    HA   GLN  10           HA       GLN  10  -5.215  -0.889   8.424
   73    HB2  GLN  10           HB2      GLN  10  -4.879   1.527  10.211
   74    HB3  GLN  10           HB3      GLN  10  -6.368   0.605  10.060
   75    HG2  GLN  10           HG2      GLN  10  -5.215  -1.366  10.927
   76    HG3  GLN  10           HG3      GLN  10  -3.735  -0.420  11.076
   77   HE21  GLN  10          1HE2      GLN  10  -5.134   1.974  11.934
   78   HE22  GLN  10          2HE2      GLN  10  -5.632   1.698  13.569
   79    H    VAL  11           H        VAL  11  -6.859  -0.340   7.078
   80    HA   VAL  11           HA       VAL  11  -6.544   2.222   5.653
   81    HB   VAL  11           HB       VAL  11  -7.795  -0.303   4.576
   82   HG11  VAL  11          2HG1      VAL  11  -8.591   1.735   3.514
   83   HG12  VAL  11          1HG1      VAL  11  -7.571   0.817   2.407
   84   HG13  VAL  11          3HG1      VAL  11  -6.929   2.247   3.215
   85   HG21  VAL  11          3HG2      VAL  11  -5.727  -0.547   3.253
   86   HG22  VAL  11          2HG2      VAL  11  -5.456  -0.725   4.989
   87   HG23  VAL  11          1HG2      VAL  11  -5.011   0.777   4.173
   88    H    GLU  12           H        GLU  12  -8.010   3.580   6.492
   89    HA   GLU  12           HA       GLU  12 -10.728   2.680   7.003
   90    HB2  GLU  12           HB2      GLU  12  -9.451   5.414   7.225
   91    HB3  GLU  12           HB3      GLU  12 -11.104   5.039   7.687
   92    HG2  GLU  12           HG2      GLU  12  -8.615   3.886   8.926
   93    HG3  GLU  12           HG3      GLU  12  -9.649   5.132   9.623
   94    H    GLY  13           H        GLY  13 -12.171   2.597   5.429
   95    HA2  GLY  13           HA1      GLY  13 -13.388   4.101   3.833
   96    HA3  GLY  13           HA2      GLY  13 -11.812   4.414   3.122
   97    H    MET  14           H        MET  14 -12.588   1.228   4.254
   98    HA   MET  14           HA       MET  14 -12.270   0.117   1.633
   99    HB2  MET  14           HB2      MET  14 -13.016  -1.052   4.307
  100    HB3  MET  14           HB3      MET  14 -13.010  -2.022   2.841
  101    HG2  MET  14           HG2      MET  14 -10.632  -0.513   3.904
  102    HG3  MET  14           HG3      MET  14 -10.945  -2.227   4.178
  103    HE1  MET  14           HE1      MET  14  -8.723  -3.067   3.225
  104    HE2  MET  14           HE2      MET  14  -8.020  -2.530   1.699
  105    HE3  MET  14           HE3      MET  14  -8.194  -1.395   3.036
  106    H    SER  15           H        SER  15 -13.788   0.238   0.136
  107    HA   SER  15           HA       SER  15 -16.585   0.399   0.979
  108    HB2  SER  15           HB2      SER  15 -15.826   2.276  -0.360
  109    HB3  SER  15           HB3      SER  15 -15.258   1.186  -1.622
  110    HG   SER  15           HG       SER  15 -17.475   2.278  -1.743
  111    H    CYS  16           H        CYS  16 -15.086  -0.806  -2.036
  112    HA   CYS  16           HA       CYS  16 -16.532  -3.323  -1.685
  113    HB2  CYS  16           HB2      CYS  16 -16.845  -1.535  -4.106
  114    HB3  CYS  16           HB3      CYS  16 -17.505  -3.158  -3.947
  115    HG   CYS  16           HG       CYS  16 -18.518  -1.442  -1.366
  116    H    GLY  17           H        GLY  17 -16.124  -4.596  -3.955
  117    HA2  GLY  17           HA1      GLY  17 -13.512  -5.506  -3.757
  118    HA3  GLY  17           HA2      GLY  17 -14.585  -5.839  -5.101
  119    H    HIS  18           H        HIS  18 -14.810  -3.183  -6.123
  120    HA   HIS  18           HA       HIS  18 -12.555  -3.171  -7.794
  121    HB2  HIS  18           HB2      HIS  18 -13.407  -1.148  -8.767
  122    HB3  HIS  18           HB3      HIS  18 -14.770  -2.188  -8.390
  123    HD1  HIS  18           HD1      HIS  18 -13.198   1.074  -7.501
  124    HD2  HIS  18           HD2      HIS  18 -16.519  -1.189  -6.421
  125    HE1  HIS  18           HE1      HIS  18 -14.665   2.612  -6.154
  126    HE2  HIS  18           HE2      HIS  18 -16.775   1.298  -5.753
  127    H    CYS  19           H        CYS  19 -13.096  -1.642  -4.734
  128    HA   CYS  19           HA       CYS  19 -11.152   0.398  -4.902
  129    HB2  CYS  19           HB2      CYS  19 -12.027  -1.073  -2.410
  130    HB3  CYS  19           HB3      CYS  19 -11.359   0.554  -2.507
  131    HG   CYS  19           HG       CYS  19 -13.552   1.775  -3.515
  132    H    VAL  20           H        VAL  20 -11.007  -3.011  -4.256
  133    HA   VAL  20           HA       VAL  20  -8.476  -3.244  -3.091
  134    HB   VAL  20           HB       VAL  20  -9.932  -5.129  -4.957
  135   HG11  VAL  20          2HG1      VAL  20  -7.552  -5.640  -4.990
  136   HG12  VAL  20          1HG1      VAL  20  -8.448  -6.888  -4.126
  137   HG13  VAL  20          3HG1      VAL  20  -7.524  -5.685  -3.228
  138   HG21  VAL  20          3HG2      VAL  20 -10.507  -6.332  -2.908
  139   HG22  VAL  20          2HG2      VAL  20 -11.110  -4.675  -2.874
  140   HG23  VAL  20          1HG2      VAL  20  -9.669  -5.110  -1.954
  141    H    ASN  21           H        ASN  21  -9.386  -3.520  -6.526
  142    HA   ASN  21           HA       ASN  21  -6.763  -3.780  -7.487
  143    HB2  ASN  21           HB2      ASN  21  -9.304  -2.864  -8.825
  144    HB3  ASN  21           HB3      ASN  21  -7.781  -3.034  -9.694
  145   HD21  ASN  21          1HD2      ASN  21  -6.917  -5.066 -10.026
  146   HD22  ASN  21          2HD2      ASN  21  -7.861  -6.508  -9.834
  147    H    ALA  22           H        ALA  22  -8.805  -0.939  -7.007
  148    HA   ALA  22           HA       ALA  22  -7.247   0.986  -8.260
  149    HB1  ALA  22           HB1      ALA  22  -8.842   1.322  -5.723
  150    HB2  ALA  22           HB2      ALA  22  -8.318   2.614  -6.805
  151    HB3  ALA  22           HB3      ALA  22  -9.488   1.415  -7.362
  152    H    ILE  23           H        ILE  23  -7.199   0.235  -4.755
  153    HA   ILE  23           HA       ILE  23  -4.892   1.834  -4.317
  154    HB   ILE  23           HB       ILE  23  -6.415   1.464  -2.485
  155   HG12  ILE  23          2HG1      ILE  23  -3.752   0.131  -1.954
  156   HG13  ILE  23          3HG1      ILE  23  -4.052   1.867  -1.948
  157   HG21  ILE  23          2HG2      ILE  23  -7.183  -0.782  -3.088
  158   HG22  ILE  23          1HG2      ILE  23  -6.706  -0.676  -1.393
  159   HG23  ILE  23          3HG2      ILE  23  -5.634  -1.444  -2.564
  160   HD11  ILE  23          3HD1      ILE  23  -5.294  -0.125  -0.068
  161   HD12  ILE  23          2HD1      ILE  23  -5.546   1.618  -0.051
  162   HD13  ILE  23          1HD1      ILE  23  -3.952   0.955   0.308
  163    H    GLU  24           H        GLU  24  -5.380  -1.575  -4.987
  164    HA   GLU  24           HA       GLU  24  -2.952  -2.683  -4.327
  165    HB2  GLU  24           HB2      GLU  24  -4.831  -3.979  -5.220
  166    HB3  GLU  24           HB3      GLU  24  -4.610  -3.233  -6.796
  167    HG2  GLU  24           HG2      GLU  24  -2.342  -4.251  -6.883
  168    HG3  GLU  24           HG3      GLU  24  -2.727  -5.105  -5.388
  169    H    SER  25           H        SER  25  -3.778  -1.351  -7.551
  170    HA   SER  25           HA       SER  25  -1.047  -1.449  -8.350
  171    HB2  SER  25           HB2      SER  25  -3.292   0.065  -9.674
  172    HB3  SER  25           HB3      SER  25  -1.724  -0.353 -10.379
  173    HG   SER  25           HG       SER  25  -3.802  -1.749 -10.674
  174    H    SER  26           H        SER  26  -3.078   1.056  -6.936
  175    HA   SER  26           HA       SER  26  -1.553   3.290  -7.561
  176    HB2  SER  26           HB2      SER  26  -3.024   2.683  -4.985
  177    HB3  SER  26           HB3      SER  26  -2.409   4.273  -5.439
  178    HG   SER  26           HG       SER  26  -4.451   2.749  -6.680
  179    H    VAL  27           H        VAL  27  -1.020   0.819  -5.113
  180    HA   VAL  27           HA       VAL  27   1.458   2.035  -4.253
  181    HB   VAL  27           HB       VAL  27   0.456  -0.759  -3.702
  182   HG11  VAL  27          2HG1      VAL  27   2.821  -0.492  -3.289
  183   HG12  VAL  27          1HG1      VAL  27   1.955  -0.615  -1.757
  184   HG13  VAL  27          3HG1      VAL  27   2.518   0.955  -2.328
  185   HG21  VAL  27          3HG2      VAL  27  -0.385   0.119  -1.585
  186   HG22  VAL  27          2HG2      VAL  27  -1.178   0.894  -2.956
  187   HG23  VAL  27          1HG2      VAL  27   0.085   1.749  -2.069
  188    H    LYS  28           H        LYS  28   0.482  -0.772  -6.205
  189    HA   LYS  28           HA       LYS  28   3.064  -1.845  -6.535
  190    HB2  LYS  28           HB2      LYS  28   0.868  -3.029  -6.856
  191    HB3  LYS  28           HB3      LYS  28   0.727  -2.206  -8.403
  192    HG2  LYS  28           HG2      LYS  28   2.760  -3.290  -9.183
  193    HG3  LYS  28           HG3      LYS  28   2.945  -4.085  -7.617
  194    HD2  LYS  28           HD2      LYS  28   0.686  -5.121  -7.999
  195    HD3  LYS  28           HD3      LYS  28   0.752  -4.489  -9.644
  196    HE2  LYS  28           HE2      LYS  28   2.781  -6.352  -8.417
  197    HE3  LYS  28           HE3      LYS  28   1.464  -6.843  -9.480
  198    HZ1  LYS  28           HZ1      LYS  28   3.706  -6.531 -10.544
  199    HZ2  LYS  28           HZ2      LYS  28   3.512  -4.864 -10.309
  200    HZ3  LYS  28           HZ3      LYS  28   2.422  -5.717 -11.290
  201    H    GLU  29           H        GLU  29   1.334   0.586  -8.369
  202    HA   GLU  29           HA       GLU  29   2.960   0.489 -10.708
  203    HB2  GLU  29           HB2      GLU  29   1.123   2.612  -9.604
  204    HB3  GLU  29           HB3      GLU  29   1.958   2.770 -11.140
  205    HG2  GLU  29           HG2      GLU  29   0.809   0.804 -11.987
  206    HG3  GLU  29           HG3      GLU  29   0.002   0.594 -10.431
  207    H    LEU  30           H        LEU  30   3.539   1.610  -7.607
  208    HA   LEU  30           HA       LEU  30   5.228   3.831  -8.320
  209    HB2  LEU  30           HB2      LEU  30   5.110   2.359  -5.691
  210    HB3  LEU  30           HB3      LEU  30   5.842   3.925  -5.974
  211    HG   LEU  30           HG       LEU  30   2.918   3.229  -5.983
  212   HD11  LEU  30          2HD1      LEU  30   2.824   4.967  -4.248
  213   HD12  LEU  30          1HD1      LEU  30   4.578   5.133  -4.347
  214   HD13  LEU  30          3HD1      LEU  30   3.864   3.614  -3.804
  215   HD21  LEU  30          3HD2      LEU  30   3.323   4.705  -7.874
  216   HD22  LEU  30          2HD2      LEU  30   4.207   5.823  -6.833
  217   HD23  LEU  30          1HD2      LEU  30   2.478   5.567  -6.589
  218    H    ASN  31           H        ASN  31   7.526   3.851  -7.351
  219    HA   ASN  31           HA       ASN  31   9.002   1.705  -8.633
  220    HB2  ASN  31           HB2      ASN  31   9.513   4.292  -8.629
  221    HB3  ASN  31           HB3      ASN  31  10.277   3.940  -7.087
  222   HD21  ASN  31          1HD2      ASN  31  11.500   4.898  -9.501
  223   HD22  ASN  31          2HD2      ASN  31  12.693   3.725  -9.952
  224    H    GLY  32           H        GLY  32  10.605   0.429  -7.509
  225    HA2  GLY  32           HA1      GLY  32  11.509  -0.720  -5.748
  226    HA3  GLY  32           HA2      GLY  32  11.088   0.651  -4.737
  227    H    VAL  33           H        VAL  33   8.481  -0.808  -6.434
  228    HA   VAL  33           HA       VAL  33   7.573  -1.967  -3.914
  229    HB   VAL  33           HB       VAL  33   5.990  -1.100  -6.337
  230   HG11  VAL  33          2HG1      VAL  33   5.063  -2.397  -3.774
  231   HG12  VAL  33          1HG1      VAL  33   4.970  -3.085  -5.395
  232   HG13  VAL  33          3HG1      VAL  33   4.002  -1.670  -4.981
  233   HG21  VAL  33          3HG2      VAL  33   5.023   0.514  -4.741
  234   HG22  VAL  33          2HG2      VAL  33   6.760   0.735  -4.952
  235   HG23  VAL  33          1HG2      VAL  33   6.143  -0.070  -3.510
  236    H    GLU  34           H        GLU  34   7.738  -4.007  -3.707
  237    HA   GLU  34           HA       GLU  34   8.313  -5.679  -6.002
  238    HB2  GLU  34           HB2      GLU  34   9.780  -5.949  -4.166
  239    HB3  GLU  34           HB3      GLU  34   8.456  -6.062  -3.024
  240    HG2  GLU  34           HG2      GLU  34   9.530  -8.218  -3.398
  241    HG3  GLU  34           HG3      GLU  34   7.842  -8.231  -3.909
  242    H    GLN  35           H        GLN  35   6.057  -5.796  -3.225
  243    HA   GLN  35           HA       GLN  35   3.986  -6.832  -4.939
  244    HB2  GLN  35           HB2      GLN  35   3.608  -8.860  -3.527
  245    HB3  GLN  35           HB3      GLN  35   5.076  -8.909  -4.492
  246    HG2  GLN  35           HG2      GLN  35   6.346  -8.195  -2.489
  247    HG3  GLN  35           HG3      GLN  35   4.863  -8.340  -1.549
  248   HE21  GLN  35          1HE2      GLN  35   4.025 -10.374  -1.118
  249   HE22  GLN  35          2HE2      GLN  35   4.937 -11.825  -1.353
  250    H    VAL  36           H        VAL  36   1.916  -6.900  -3.927
  251    HA   VAL  36           HA       VAL  36   1.765  -5.426  -1.386
  252    HB   VAL  36           HB       VAL  36  -0.153  -4.147  -2.247
  253   HG11  VAL  36          2HG1      VAL  36   2.048  -3.130  -2.338
  254   HG12  VAL  36          1HG1      VAL  36   1.072  -2.621  -3.717
  255   HG13  VAL  36          3HG1      VAL  36   2.329  -3.841  -3.926
  256   HG21  VAL  36          3HG2      VAL  36   0.524  -5.422  -4.894
  257   HG22  VAL  36          2HG2      VAL  36  -0.616  -4.096  -4.664
  258   HG23  VAL  36          1HG2      VAL  36  -0.944  -5.674  -3.948
  259    H    LYS  37           H        LYS  37  -0.174  -5.780  -0.200
  260    HA   LYS  37           HA       LYS  37  -2.022  -7.791  -1.234
  261    HB2  LYS  37           HB2      LYS  37  -0.211  -8.870   0.232
  262    HB3  LYS  37           HB3      LYS  37  -0.944  -7.997   1.567
  263    HG2  LYS  37           HG2      LYS  37  -3.073  -9.134   1.132
  264    HG3  LYS  37           HG3      LYS  37  -2.299 -10.051  -0.163
  265    HD2  LYS  37           HD2      LYS  37  -1.583 -10.101   2.766
  266    HD3  LYS  37           HD3      LYS  37  -2.371 -11.388   1.853
  267    HE2  LYS  37           HE2      LYS  37   0.412 -10.332   1.359
  268    HE3  LYS  37           HE3      LYS  37   0.021 -11.825   2.210
  269    HZ1  LYS  37           HZ1      LYS  37  -0.961 -12.699   0.197
  270    HZ2  LYS  37           HZ2      LYS  37   0.639 -12.224  -0.097
  271    HZ3  LYS  37           HZ3      LYS  37  -0.643 -11.251  -0.630
  272    H    VAL  38           H        VAL  38  -3.566  -6.204  -1.407
  273    HA   VAL  38           HA       VAL  38  -4.307  -4.711   0.966
  274    HB   VAL  38           HB       VAL  38  -4.480  -3.406  -1.001
  275   HG11  VAL  38          2HG1      VAL  38  -5.946  -4.065  -2.916
  276   HG12  VAL  38          1HG1      VAL  38  -6.055  -5.673  -2.201
  277   HG13  VAL  38          3HG1      VAL  38  -4.494  -5.044  -2.727
  278   HG21  VAL  38          3HG2      VAL  38  -7.249  -4.317  -0.244
  279   HG22  VAL  38          2HG2      VAL  38  -6.860  -2.829  -1.108
  280   HG23  VAL  38          1HG2      VAL  38  -6.301  -3.058   0.550
  281    H    GLN  39           H        GLN  39  -5.419  -5.709   2.466
  282    HA   GLN  39           HA       GLN  39  -7.063  -8.004   1.762
  283    HB2  GLN  39           HB2      GLN  39  -6.344  -6.905   4.489
  284    HB3  GLN  39           HB3      GLN  39  -7.095  -8.461   4.160
  285    HG2  GLN  39           HG2      GLN  39  -5.090  -9.206   3.002
  286    HG3  GLN  39           HG3      GLN  39  -4.340  -7.634   3.266
  287   HE21  GLN  39          1HE2      GLN  39  -2.623  -8.501   4.406
  288   HE22  GLN  39          2HE2      GLN  39  -2.790  -9.135   6.004
  289    H    LEU  40           H        LEU  40  -9.038  -7.432   1.073
  290    HA   LEU  40           HA       LEU  40 -10.266  -4.961   1.617
  291    HB2  LEU  40           HB2      LEU  40 -10.606  -6.478  -0.377
  292    HB3  LEU  40           HB3      LEU  40 -11.621  -7.473   0.640
  293    HG   LEU  40           HG       LEU  40 -12.797  -5.868  -0.933
  294   HD11  LEU  40          2HD1      LEU  40 -13.435  -5.632   2.000
  295   HD12  LEU  40          1HD1      LEU  40 -13.946  -6.937   0.931
  296   HD13  LEU  40          3HD1      LEU  40 -14.537  -5.297   0.664
  297   HD21  LEU  40          3HD2      LEU  40 -11.379  -3.934  -0.630
  298   HD22  LEU  40          2HD2      LEU  40 -11.810  -3.855   1.079
  299   HD23  LEU  40          1HD2      LEU  40 -13.035  -3.553  -0.155
  300    H    ALA  41           H        ALA  41 -10.895  -8.208   2.913
  301    HA   ALA  41           HA       ALA  41 -13.157  -7.376   4.444
  302    HB1  ALA  41           HB1      ALA  41 -13.094  -9.605   5.399
  303    HB2  ALA  41           HB2      ALA  41 -12.881  -9.678   3.650
  304    HB3  ALA  41           HB3      ALA  41 -11.489  -9.868   4.717
  305    H    GLU  42           H        GLU  42  -9.736  -7.712   5.093
  306    HA   GLU  42           HA       GLU  42 -10.077  -7.430   7.947
  307    HB2  GLU  42           HB2      GLU  42  -7.534  -7.358   6.311
  308    HB3  GLU  42           HB3      GLU  42  -7.648  -7.547   8.055
  309    HG2  GLU  42           HG2      GLU  42  -8.645  -9.493   5.988
  310    HG3  GLU  42           HG3      GLU  42  -7.199  -9.670   6.980
  311    H    GLY  43           H        GLY  43  -9.574  -5.384   5.226
  312    HA2  GLY  43           HA1      GLY  43  -9.584  -3.085   5.077
  313    HA3  GLY  43           HA2      GLY  43  -9.892  -3.026   6.807
  314    H    THR  44           H        THR  44  -7.178  -4.756   5.498
  315    HA   THR  44           HA       THR  44  -5.377  -2.585   6.332
  316    HB   THR  44           HB       THR  44  -3.834  -4.420   7.204
  317    HG1  THR  44           HG1      THR  44  -5.579  -6.180   7.970
  318   HG21  THR  44          3HG2      THR  44  -6.449  -3.985   8.653
  319   HG22  THR  44          1HG2      THR  44  -5.054  -2.905   8.700
  320   HG23  THR  44          2HG2      THR  44  -4.939  -4.526   9.384
  321    H    VAL  45           H        VAL  45  -3.309  -2.611   5.318
  322    HA   VAL  45           HA       VAL  45  -3.144  -4.323   2.929
  323    HB   VAL  45           HB       VAL  45  -2.575  -1.354   3.066
  324   HG11  VAL  45          2HG1      VAL  45  -0.863  -2.437   1.725
  325   HG12  VAL  45          1HG1      VAL  45  -1.974  -1.551   0.679
  326   HG13  VAL  45          3HG1      VAL  45  -2.094  -3.306   0.810
  327   HG21  VAL  45          3HG2      VAL  45  -4.934  -1.913   2.804
  328   HG22  VAL  45          2HG2      VAL  45  -4.549  -2.949   1.429
  329   HG23  VAL  45          1HG2      VAL  45  -4.287  -1.209   1.323
  330    H    GLU  46           H        GLU  46  -1.383  -5.527   3.024
  331    HA   GLU  46           HA       GLU  46   1.014  -4.467   4.344
  332    HB2  GLU  46           HB2      GLU  46   0.457  -6.705   5.069
  333    HB3  GLU  46           HB3      GLU  46   0.336  -7.261   3.403
  334    HG2  GLU  46           HG2      GLU  46   2.742  -6.776   3.109
  335    HG3  GLU  46           HG3      GLU  46   2.834  -6.345   4.813
  336    H    VAL  47           H        VAL  47   2.621  -3.677   3.157
  337    HA   VAL  47           HA       VAL  47   2.756  -4.473   0.324
  338    HB   VAL  47           HB       VAL  47   3.532  -1.766   1.421
  339   HG11  VAL  47          2HG1      VAL  47   3.308  -2.791  -1.405
  340   HG12  VAL  47          1HG1      VAL  47   4.805  -2.454  -0.536
  341   HG13  VAL  47          3HG1      VAL  47   3.702  -1.137  -0.935
  342   HG21  VAL  47          3HG2      VAL  47   1.091  -2.547  -0.171
  343   HG22  VAL  47          2HG2      VAL  47   1.556  -0.903   0.266
  344   HG23  VAL  47          1HG2      VAL  47   1.112  -2.058   1.523
  345    H    THR  48           H        THR  48   4.623  -5.365  -0.275
  346    HA   THR  48           HA       THR  48   6.945  -5.144   1.498
  347    HB   THR  48           HB       THR  48   6.641  -6.877  -0.963
  348    HG1  THR  48           HG1      THR  48   5.426  -7.099   1.412
  349   HG21  THR  48          3HG2      THR  48   8.533  -7.014   1.390
  350   HG22  THR  48          1HG2      THR  48   8.952  -6.508  -0.250
  351   HG23  THR  48          2HG2      THR  48   8.459  -8.173   0.063
  352    H    ILE  49           H        ILE  49   8.019  -3.304   1.089
  353    HA   ILE  49           HA       ILE  49   8.529  -2.610  -1.735
  354    HB   ILE  49           HB       ILE  49   8.864  -0.273  -0.960
  355   HG12  ILE  49          2HG1      ILE  49   7.553  -1.115   1.623
  356   HG13  ILE  49          3HG1      ILE  49   9.303  -1.030   1.454
  357   HG21  ILE  49          2HG2      ILE  49   6.754  -0.941  -1.945
  358   HG22  ILE  49          1HG2      ILE  49   6.494   0.258  -0.677
  359   HG23  ILE  49          3HG2      ILE  49   6.156  -1.445  -0.364
  360   HD11  ILE  49          3HD1      ILE  49   7.396   1.264   1.052
  361   HD12  ILE  49          2HD1      ILE  49   9.156   1.338   0.951
  362   HD13  ILE  49          1HD1      ILE  49   8.376   0.973   2.490
  363    H    ASP  50           H        ASP  50  10.535  -1.567  -2.188
  364    HA   ASP  50           HA       ASP  50  12.709  -2.326  -0.403
  365    HB2  ASP  50           HB2      ASP  50  13.030  -2.639  -2.840
  366    HB3  ASP  50           HB3      ASP  50  12.795  -0.910  -3.076
  367    H    SER  51           H        SER  51  12.987  -1.002   1.261
  368    HA   SER  51           HA       SER  51  12.101   1.721   1.179
  369    HB2  SER  51           HB2      SER  51  12.955   1.787   3.514
  370    HB3  SER  51           HB3      SER  51  11.848   0.450   3.219
  371    HG   SER  51           HG       SER  51  13.530  -0.963   3.222
  372    H    SER  52           H        SER  52  14.767   0.307  -0.075
  373    HA   SER  52           HA       SER  52  16.585   2.511   0.512
  374    HB2  SER  52           HB2      SER  52  17.024   0.050  -1.192
  375    HB3  SER  52           HB3      SER  52  18.261   1.201  -0.684
  376    HG   SER  52           HG       SER  52  16.933  -0.770   0.781
  377    H    VAL  53           H        VAL  53  14.144   1.833  -1.615
  378    HA   VAL  53           HA       VAL  53  15.272   3.681  -3.607
  379    HB   VAL  53           HB       VAL  53  13.498   1.288  -4.091
  380   HG11  VAL  53          2HG1      VAL  53  12.721   3.183  -5.431
  381   HG12  VAL  53          1HG1      VAL  53  13.466   1.941  -6.440
  382   HG13  VAL  53          3HG1      VAL  53  14.357   3.413  -6.052
  383   HG21  VAL  53          3HG2      VAL  53  15.328   0.505  -5.467
  384   HG22  VAL  53          2HG2      VAL  53  15.928   0.879  -3.849
  385   HG23  VAL  53          1HG2      VAL  53  16.221   1.999  -5.181
  386    H    VAL  54           H        VAL  54  12.172   2.373  -2.393
  387    HA   VAL  54           HA       VAL  54  11.033   5.057  -2.813
  388    HB   VAL  54           HB       VAL  54   9.944   3.127  -4.020
  389   HG11  VAL  54          2HG1      VAL  54   8.437   1.669  -2.731
  390   HG12  VAL  54          1HG1      VAL  54   9.125   2.311  -1.237
  391   HG13  VAL  54          3HG1      VAL  54  10.140   1.396  -2.353
  392   HG21  VAL  54          3HG2      VAL  54   8.212   4.609  -2.049
  393   HG22  VAL  54          2HG2      VAL  54   7.659   3.815  -3.525
  394   HG23  VAL  54          1HG2      VAL  54   8.743   5.204  -3.623
  395    H    THR  55           H        THR  55   9.727   5.956  -1.074
  396    HA   THR  55           HA       THR  55  10.496   4.905   1.550
  397    HB   THR  55           HB       THR  55   9.699   6.999   2.495
  398    HG1  THR  55           HG1      THR  55   8.945   7.723  -0.169
  399   HG21  THR  55          3HG2      THR  55  11.968   7.008   1.588
  400   HG22  THR  55          1HG2      THR  55  11.211   8.589   1.395
  401   HG23  THR  55          2HG2      THR  55  11.345   7.501   0.013
  402    H    LEU  56           H        LEU  56   8.855   4.617   3.217
  403    HA   LEU  56           HA       LEU  56   6.507   3.372   2.226
  404    HB2  LEU  56           HB2      LEU  56   5.830   3.177   4.594
  405    HB3  LEU  56           HB3      LEU  56   7.435   2.558   4.273
  406    HG   LEU  56           HG       LEU  56   8.226   4.891   5.130
  407   HD11  LEU  56          2HD1      LEU  56   5.485   4.703   6.370
  408   HD12  LEU  56          1HD1      LEU  56   6.053   5.955   5.264
  409   HD13  LEU  56          3HD1      LEU  56   6.761   5.810   6.873
  410   HD21  LEU  56          3HD2      LEU  56   7.109   2.786   6.973
  411   HD22  LEU  56          2HD2      LEU  56   8.308   4.005   7.404
  412   HD23  LEU  56          1HD2      LEU  56   8.700   2.767   6.210
  413    H    LYS  57           H        LYS  57   7.296   6.582   3.299
  414    HA   LYS  57           HA       LYS  57   4.675   7.551   3.639
  415    HB2  LYS  57           HB2      LYS  57   7.281   8.631   3.710
  416    HB3  LYS  57           HB3      LYS  57   6.337   9.618   2.598
  417    HG2  LYS  57           HG2      LYS  57   5.539   8.903   5.401
  418    HG3  LYS  57           HG3      LYS  57   6.234  10.447   4.900
  419    HD2  LYS  57           HD2      LYS  57   4.299  10.829   3.440
  420    HD3  LYS  57           HD3      LYS  57   3.613   9.281   3.940
  421    HE2  LYS  57           HE2      LYS  57   3.646  10.111   6.288
  422    HE3  LYS  57           HE3      LYS  57   4.149  11.681   5.671
  423    HZ1  LYS  57           HZ1      LYS  57   2.088  11.770   4.378
  424    HZ2  LYS  57           HZ2      LYS  57   1.783  11.642   6.044
  425    HZ3  LYS  57           HZ3      LYS  57   1.603  10.289   5.050
  426    H    ASP  58           H        ASP  58   6.740   7.288   0.757
  427    HA   ASP  58           HA       ASP  58   5.106   8.651  -1.054
  428    HB2  ASP  58           HB2      ASP  58   6.888   6.241  -1.448
  429    HB3  ASP  58           HB3      ASP  58   6.005   6.973  -2.780
  430    H    ILE  59           H        ILE  59   5.064   5.281  -0.049
  431    HA   ILE  59           HA       ILE  59   2.914   4.341  -1.533
  432    HB   ILE  59           HB       ILE  59   3.597   3.568   1.313
  433   HG12  ILE  59          2HG1      ILE  59   5.591   3.449  -0.097
  434   HG13  ILE  59          3HG1      ILE  59   5.036   1.830   0.315
  435   HG21  ILE  59          2HG2      ILE  59   2.220   2.015  -0.872
  436   HG22  ILE  59          1HG2      ILE  59   1.451   2.707   0.556
  437   HG23  ILE  59          3HG2      ILE  59   2.626   1.404   0.732
  438   HD11  ILE  59          3HD1      ILE  59   4.549   3.240  -2.297
  439   HD12  ILE  59          2HD1      ILE  59   4.034   1.606  -1.885
  440   HD13  ILE  59          1HD1      ILE  59   5.752   1.983  -2.005
  441    H    VAL  60           H        VAL  60   2.893   5.603   1.792
  442    HA   VAL  60           HA       VAL  60   0.139   5.562   2.215
  443    HB   VAL  60           HB       VAL  60   2.142   7.510   3.375
  444   HG11  VAL  60          2HG1      VAL  60  -0.561   6.644   4.386
  445   HG12  VAL  60          1HG1      VAL  60  -0.143   8.236   3.753
  446   HG13  VAL  60          3HG1      VAL  60   0.579   7.667   5.258
  447   HG21  VAL  60          3HG2      VAL  60   2.304   5.930   5.241
  448   HG22  VAL  60          2HG2      VAL  60   2.829   5.200   3.724
  449   HG23  VAL  60          1HG2      VAL  60   1.240   4.814   4.384
  450    H    ALA  61           H        ALA  61   2.197   8.146   0.934
  451    HA   ALA  61           HA       ALA  61   0.316  10.196   0.853
  452    HB1  ALA  61           HB1      ALA  61   2.605   9.777  -1.063
  453    HB2  ALA  61           HB2      ALA  61   1.789  11.300  -0.713
  454    HB3  ALA  61           HB3      ALA  61   2.743  10.503   0.539
  455    H    VAL  62           H        VAL  62   1.079   7.719  -1.568
  456    HA   VAL  62           HA       VAL  62  -0.758   8.744  -3.505
  457    HB   VAL  62           HB       VAL  62   0.482   5.989  -3.307
  458   HG11  VAL  62          2HG1      VAL  62  -0.092   5.769  -5.671
  459   HG12  VAL  62          1HG1      VAL  62  -0.888   7.342  -5.631
  460   HG13  VAL  62          3HG1      VAL  62  -1.539   6.001  -4.689
  461   HG21  VAL  62          3HG2      VAL  62   2.041   6.824  -5.014
  462   HG22  VAL  62          2HG2      VAL  62   2.155   7.744  -3.513
  463   HG23  VAL  62          1HG2      VAL  62   1.299   8.421  -4.898
  464    H    ILE  63           H        ILE  63  -0.881   6.154  -1.081
  465    HA   ILE  63           HA       ILE  63  -3.340   5.036  -1.797
  466    HB   ILE  63           HB       ILE  63  -2.022   5.214   0.911
  467   HG12  ILE  63          2HG1      ILE  63  -2.204   2.962  -1.102
  468   HG13  ILE  63          3HG1      ILE  63  -0.777   3.946  -0.789
  469   HG21  ILE  63          2HG2      ILE  63  -4.419   3.593   0.072
  470   HG22  ILE  63          1HG2      ILE  63  -4.387   4.899   1.256
  471   HG23  ILE  63          3HG2      ILE  63  -3.541   3.387   1.587
  472   HD11  ILE  63          3HD1      ILE  63  -0.711   3.083   1.505
  473   HD12  ILE  63          2HD1      ILE  63  -0.590   1.798   0.301
  474   HD13  ILE  63          1HD1      ILE  63  -2.112   2.072   1.151
  475    H    GLU  64           H        GLU  64  -2.671   7.569   0.638
  476    HA   GLU  64           HA       GLU  64  -5.370   7.846   1.410
  477    HB2  GLU  64           HB2      GLU  64  -3.148   9.879   1.625
  478    HB3  GLU  64           HB3      GLU  64  -4.688   9.943   2.473
  479    HG2  GLU  64           HG2      GLU  64  -4.091   7.771   3.560
  480    HG3  GLU  64           HG3      GLU  64  -2.491   7.925   2.832
  481    H    ASP  65           H        ASP  65  -3.441   9.417  -1.060
  482    HA   ASP  65           HA       ASP  65  -5.246  11.456  -1.745
  483    HB2  ASP  65           HB2      ASP  65  -2.967  11.532  -2.538
  484    HB3  ASP  65           HB3      ASP  65  -3.177  10.017  -3.413
  485    H    GLN  66           H        GLN  66  -5.230   8.068  -2.424
  486    HA   GLN  66           HA       GLN  66  -7.057   8.180  -4.633
  487    HB2  GLN  66           HB2      GLN  66  -6.195   5.880  -2.874
  488    HB3  GLN  66           HB3      GLN  66  -7.199   5.714  -4.308
  489    HG2  GLN  66           HG2      GLN  66  -4.361   6.703  -4.211
  490    HG3  GLN  66           HG3      GLN  66  -4.909   5.134  -4.798
  491   HE21  GLN  66          1HE2      GLN  66  -4.631   8.512  -5.479
  492   HE22  GLN  66          2HE2      GLN  66  -5.092   8.425  -7.145
  493    H    GLY  67           H        GLY  67  -7.425   8.583  -1.319
  494    HA2  GLY  67           HA1      GLY  67  -9.604   9.258  -0.519
  495    HA3  GLY  67           HA2      GLY  67 -10.313   8.052  -1.579
  496    H    TYR  68           H        TYR  68  -7.605   7.752   0.685
  497    HA   TYR  68           HA       TYR  68  -9.239   5.976   2.347
  498    HB2  TYR  68           HB2      TYR  68  -6.444   5.299   1.400
  499    HB3  TYR  68           HB3      TYR  68  -7.409   4.355   2.527
  500    HD1  TYR  68           HD2      TYR  68  -9.635   3.401   1.667
  501    HD2  TYR  68           HD1      TYR  68  -6.566   4.857  -0.901
  502    HE1  TYR  68           HE2      TYR  68 -10.586   2.110  -0.194
  503    HE2  TYR  68           HE1      TYR  68  -7.516   3.570  -2.770
  504    HH   TYR  68           HH       TYR  68  -8.947   1.535  -3.071
  505    H    ASP  69           H        ASP  69  -8.623   5.868   4.503
  506    HA   ASP  69           HA       ASP  69  -6.567   7.806   5.335
  507    HB2  ASP  69           HB2      ASP  69  -8.979   6.707   6.777
  508    HB3  ASP  69           HB3      ASP  69  -7.680   7.538   7.625
  509    H    VAL  70           H        VAL  70  -4.703   6.740   5.437
  510    HA   VAL  70           HA       VAL  70  -4.708   4.158   6.838
  511    HB   VAL  70           HB       VAL  70  -2.710   3.530   5.494
  512   HG11  VAL  70          2HG1      VAL  70  -5.167   4.214   3.884
  513   HG12  VAL  70          1HG1      VAL  70  -4.956   2.771   4.879
  514   HG13  VAL  70          3HG1      VAL  70  -3.945   3.016   3.455
  515   HG21  VAL  70          3HG2      VAL  70  -3.417   5.920   3.796
  516   HG22  VAL  70          2HG2      VAL  70  -2.136   4.746   3.496
  517   HG23  VAL  70          1HG2      VAL  70  -2.023   5.838   4.879
  518    H    GLN  71           H        GLN  71  -3.600   4.077   8.638
  519    HA   GLN  71           HA       GLN  71  -1.787   6.308   9.252
  520    HB2  GLN  71           HB2      GLN  71  -3.165   4.456  11.209
  521    HB3  GLN  71           HB3      GLN  71  -2.273   5.922  11.591
  522    HG2  GLN  71           HG2      GLN  71  -4.880   5.751  10.098
  523    HG3  GLN  71           HG3      GLN  71  -4.651   6.300  11.755
  524   HE21  GLN  71          1HE2      GLN  71  -2.181   7.739  11.081
  525   HE22  GLN  71          2HE2      GLN  71  -2.685   9.169  10.253
  Start of MODEL    4
    1    H1   SER   1           H1       SER   1  22.086  -1.262   0.133
    2    H2   SER   1           H2       SER   1  22.075   0.403  -0.178
    3    H3   SER   1           H3       SER   1  23.459  -0.516  -0.523
    4    HA   SER   1           HA       SER   1  22.207   0.038  -2.513
    5    HB2  SER   1           HB2      SER   1  21.992  -2.384  -3.307
    6    HB3  SER   1           HB3      SER   1  23.561  -1.902  -2.662
    7    HG   SER   1           HG       SER   1  23.328  -3.537  -1.369
    8    H    ASN   2           H        ASN   2  20.438  -2.706  -1.109
    9    HA   ASN   2           HA       ASN   2  17.941  -1.209  -1.460
   10    HB2  ASN   2           HB2      ASN   2  16.854  -3.149  -2.499
   11    HB3  ASN   2           HB3      ASN   2  18.202  -2.581  -3.468
   12   HD21  ASN   2          1HD2      ASN   2  18.484  -4.485  -4.543
   13   HD22  ASN   2          2HD2      ASN   2  19.070  -5.930  -3.781
   14    H    ALA   3           H        ALA   3  16.099  -2.197  -0.294
   15    HA   ALA   3           HA       ALA   3  16.734  -4.142   1.760
   16    HB1  ALA   3           HB1      ALA   3  15.978  -1.328   2.549
   17    HB2  ALA   3           HB2      ALA   3  16.139  -2.702   3.645
   18    HB3  ALA   3           HB3      ALA   3  17.553  -2.081   2.792
   19    H    MET   4           H        MET   4  15.071  -5.469   1.399
   20    HA   MET   4           HA       MET   4  12.471  -4.420   0.676
   21    HB2  MET   4           HB2      MET   4  13.361  -7.267   1.140
   22    HB3  MET   4           HB3      MET   4  11.795  -6.781   0.507
   23    HG2  MET   4           HG2      MET   4  14.484  -6.510  -0.794
   24    HG3  MET   4           HG3      MET   4  13.096  -7.454  -1.331
   25    HE1  MET   4           HE1      MET   4  10.771  -6.280  -2.124
   26    HE2  MET   4           HE2      MET   4  10.785  -5.282  -0.668
   27    HE3  MET   4           HE3      MET   4  10.583  -4.531  -2.250
   28    H    GLU   5           H        GLU   5  10.981  -3.854   2.078
   29    HA   GLU   5           HA       GLU   5  10.865  -5.276   4.655
   30    HB2  GLU   5           HB2      GLU   5  10.404  -2.329   4.163
   31    HB3  GLU   5           HB3      GLU   5  10.086  -3.148   5.686
   32    HG2  GLU   5           HG2      GLU   5  12.544  -3.843   5.614
   33    HG3  GLU   5           HG3      GLU   5  12.715  -2.619   4.356
   34    H    GLN   6           H        GLN   6   8.899  -5.938   5.335
   35    HA   GLN   6           HA       GLN   6   6.630  -5.393   3.539
   36    HB2  GLN   6           HB2      GLN   6   7.186  -7.722   5.372
   37    HB3  GLN   6           HB3      GLN   6   5.645  -7.463   4.567
   38    HG2  GLN   6           HG2      GLN   6   6.663  -7.695   2.411
   39    HG3  GLN   6           HG3      GLN   6   8.268  -7.757   3.130
   40   HE21  GLN   6          1HE2      GLN   6   5.491  -9.395   4.512
   41   HE22  GLN   6          2HE2      GLN   6   6.052 -10.998   4.178
   42    H    LEU   7           H        LEU   7   5.360  -3.856   4.308
   43    HA   LEU   7           HA       LEU   7   4.984  -3.681   7.226
   44    HB2  LEU   7           HB2      LEU   7   4.815  -1.524   5.121
   45    HB3  LEU   7           HB3      LEU   7   4.306  -1.301   6.782
   46    HG   LEU   7           HG       LEU   7   6.423  -0.336   6.699
   47   HD11  LEU   7          2HD1      LEU   7   6.852  -3.156   7.666
   48   HD12  LEU   7          1HD1      LEU   7   6.212  -1.807   8.606
   49   HD13  LEU   7          3HD1      LEU   7   7.881  -1.771   8.037
   50   HD21  LEU   7          3HD2      LEU   7   7.099  -1.107   4.506
   51   HD22  LEU   7          2HD2      LEU   7   7.385  -2.729   5.141
   52   HD23  LEU   7          1HD2      LEU   7   8.390  -1.383   5.678
   53    H    THR   8           H        THR   8   2.955  -3.560   8.071
   54    HA   THR   8           HA       THR   8   0.744  -4.131   6.215
   55    HB   THR   8           HB       THR   8   0.796  -4.500   9.220
   56    HG1  THR   8           HG1      THR   8   0.817  -6.855   8.206
   57   HG21  THR   8          3HG2      THR   8  -1.447  -4.297   8.287
   58   HG22  THR   8          1HG2      THR   8  -1.145  -5.956   8.804
   59   HG23  THR   8          2HG2      THR   8  -1.080  -5.541   7.091
   60    H    LEU   9           H        LEU   9  -0.348  -2.354   5.663
   61    HA   LEU   9           HA       LEU   9  -0.462  -0.081   7.498
   62    HB2  LEU   9           HB2      LEU   9  -1.230  -0.397   4.599
   63    HB3  LEU   9           HB3      LEU   9  -1.541   1.062   5.514
   64    HG   LEU   9           HG       LEU   9   0.954   1.232   5.896
   65   HD11  LEU   9          2HD1      LEU   9   2.407   0.043   4.336
   66   HD12  LEU   9          1HD1      LEU   9   1.023  -0.869   3.734
   67   HD13  LEU   9          3HD1      LEU   9   1.560  -1.079   5.401
   68   HD21  LEU   9          3HD2      LEU   9  -0.111   1.343   3.083
   69   HD22  LEU   9          2HD2      LEU   9   1.371   2.123   3.640
   70   HD23  LEU   9          1HD2      LEU   9  -0.189   2.627   4.292
   71    H    GLN  10           H        GLN  10  -2.360   0.789   8.285
   72    HA   GLN  10           HA       GLN  10  -4.745  -0.886   8.047
   73    HB2  GLN  10           HB2      GLN  10  -5.622   0.460   9.942
   74    HB3  GLN  10           HB3      GLN  10  -4.114  -0.355  10.321
   75    HG2  GLN  10           HG2      GLN  10  -2.887   1.699   9.988
   76    HG3  GLN  10           HG3      GLN  10  -4.379   2.541   9.575
   77   HE21  GLN  10          1HE2      GLN  10  -2.480   1.146  12.118
   78   HE22  GLN  10          2HE2      GLN  10  -3.381   1.801  13.443
   79    H    VAL  11           H        VAL  11  -6.490  -0.252   6.908
   80    HA   VAL  11           HA       VAL  11  -6.205   2.341   5.531
   81    HB   VAL  11           HB       VAL  11  -7.538  -0.118   4.412
   82   HG11  VAL  11          2HG1      VAL  11  -6.540   2.414   3.117
   83   HG12  VAL  11          1HG1      VAL  11  -8.225   1.971   3.388
   84   HG13  VAL  11          3HG1      VAL  11  -7.238   1.034   2.266
   85   HG21  VAL  11          3HG2      VAL  11  -4.684   0.794   4.085
   86   HG22  VAL  11          2HG2      VAL  11  -5.467  -0.420   3.070
   87   HG23  VAL  11          1HG2      VAL  11  -5.251  -0.722   4.796
   88    H    GLU  12           H        GLU  12  -7.678   3.714   6.311
   89    HA   GLU  12           HA       GLU  12 -10.323   2.750   7.082
   90    HB2  GLU  12           HB2      GLU  12  -9.064   5.495   7.276
   91    HB3  GLU  12           HB3      GLU  12 -10.656   5.072   7.889
   92    HG2  GLU  12           HG2      GLU  12  -8.102   3.778   8.812
   93    HG3  GLU  12           HG3      GLU  12  -8.856   5.161   9.605
   94    H    GLY  13           H        GLY  13 -12.066   2.948   5.828
   95    HA2  GLY  13           HA1      GLY  13 -13.550   4.072   4.419
   96    HA3  GLY  13           HA2      GLY  13 -12.257   5.165   3.959
   97    H    MET  14           H        MET  14 -13.167   1.729   3.628
   98    HA   MET  14           HA       MET  14 -11.974   1.737   0.947
   99    HB2  MET  14           HB2      MET  14 -12.930  -0.477   2.757
  100    HB3  MET  14           HB3      MET  14 -12.556  -0.760   1.063
  101    HG2  MET  14           HG2      MET  14 -10.268   0.097   1.476
  102    HG3  MET  14           HG3      MET  14 -10.667   0.222   3.190
  103    HE1  MET  14           HE1      MET  14  -8.411  -1.285   3.534
  104    HE2  MET  14           HE2      MET  14  -8.220  -2.890   2.828
  105    HE3  MET  14           HE3      MET  14  -8.224  -1.466   1.789
  106    H    SER  15           H        SER  15 -13.543  -0.179  -0.304
  107    HA   SER  15           HA       SER  15 -16.173   1.126  -0.412
  108    HB2  SER  15           HB2      SER  15 -14.768   1.859  -2.310
  109    HB3  SER  15           HB3      SER  15 -14.560   0.174  -2.792
  110    HG   SER  15           HG       SER  15 -16.990   1.652  -2.689
  111    H    CYS  16           H        CYS  16 -14.872  -1.594  -2.290
  112    HA   CYS  16           HA       CYS  16 -16.181  -3.604  -0.781
  113    HB2  CYS  16           HB2      CYS  16 -18.142  -2.462  -1.871
  114    HB3  CYS  16           HB3      CYS  16 -17.490  -2.960  -3.428
  115    HG   CYS  16           HG       CYS  16 -18.863  -4.887  -0.986
  116    H    GLY  17           H        GLY  17 -15.734  -3.203  -4.331
  117    HA2  GLY  17           HA1      GLY  17 -13.998  -5.593  -4.167
  118    HA3  GLY  17           HA2      GLY  17 -15.191  -5.369  -5.435
  119    H    HIS  18           H        HIS  18 -14.767  -2.842  -6.322
  120    HA   HIS  18           HA       HIS  18 -12.489  -3.288  -7.966
  121    HB2  HIS  18           HB2      HIS  18 -14.363  -0.950  -7.680
  122    HB3  HIS  18           HB3      HIS  18 -12.983  -0.902  -8.771
  123    HD1  HIS  18           HD1      HIS  18 -13.080  -2.383 -10.885
  124    HD2  HIS  18           HD2      HIS  18 -16.500  -2.559  -8.518
  125    HE1  HIS  18           HE1      HIS  18 -14.834  -3.509 -12.301
  126    HE2  HIS  18           HE2      HIS  18 -16.871  -3.684 -10.824
  127    H    CYS  19           H        CYS  19 -12.970  -1.600  -5.010
  128    HA   CYS  19           HA       CYS  19 -10.788   0.166  -5.105
  129    HB2  CYS  19           HB2      CYS  19 -10.955   0.080  -2.586
  130    HB3  CYS  19           HB3      CYS  19 -12.446   0.496  -3.424
  131    HG   CYS  19           HG       CYS  19 -11.683  -2.526  -2.011
  132    H    VAL  20           H        VAL  20 -10.986  -3.254  -4.633
  133    HA   VAL  20           HA       VAL  20  -8.584  -3.754  -3.275
  134    HB   VAL  20           HB       VAL  20 -10.019  -5.440  -5.341
  135   HG11  VAL  20          2HG1      VAL  20  -7.670  -6.102  -5.194
  136   HG12  VAL  20          1HG1      VAL  20  -8.728  -7.333  -4.503
  137   HG13  VAL  20          3HG1      VAL  20  -7.821  -6.253  -3.443
  138   HG21  VAL  20          3HG2      VAL  20 -11.341  -5.009  -3.351
  139   HG22  VAL  20          2HG2      VAL  20 -10.003  -5.532  -2.324
  140   HG23  VAL  20          1HG2      VAL  20 -10.813  -6.691  -3.380
  141    H    ASN  21           H        ASN  21  -9.219  -3.879  -6.779
  142    HA   ASN  21           HA       ASN  21  -6.500  -4.129  -7.513
  143    HB2  ASN  21           HB2      ASN  21  -8.380  -4.781  -8.985
  144    HB3  ASN  21           HB3      ASN  21  -8.821  -3.087  -9.155
  145   HD21  ASN  21          1HD2      ASN  21  -5.525  -4.339  -9.096
  146   HD22  ASN  21          2HD2      ASN  21  -5.151  -3.918 -10.741
  147    H    ALA  22           H        ALA  22  -8.607  -1.377  -6.987
  148    HA   ALA  22           HA       ALA  22  -7.040   0.625  -8.157
  149    HB1  ALA  22           HB1      ALA  22  -8.871   0.857  -5.774
  150    HB2  ALA  22           HB2      ALA  22  -8.287   2.189  -6.770
  151    HB3  ALA  22           HB3      ALA  22  -9.357   0.972  -7.465
  152    H    ILE  23           H        ILE  23  -7.182  -0.321  -4.696
  153    HA   ILE  23           HA       ILE  23  -5.038   1.390  -3.960
  154    HB   ILE  23           HB       ILE  23  -6.616   0.663  -2.266
  155   HG12  ILE  23          2HG1      ILE  23  -4.989  -0.145  -0.528
  156   HG13  ILE  23          3HG1      ILE  23  -3.801  -0.339  -1.815
  157   HG21  ILE  23          2HG2      ILE  23  -6.660  -1.624  -1.417
  158   HG22  ILE  23          1HG2      ILE  23  -5.519  -2.111  -2.671
  159   HG23  ILE  23          3HG2      ILE  23  -7.131  -1.553  -3.116
  160   HD11  ILE  23          3HD1      ILE  23  -3.943   2.046  -2.300
  161   HD12  ILE  23          2HD1      ILE  23  -3.466   1.741  -0.629
  162   HD13  ILE  23          1HD1      ILE  23  -5.118   2.237  -0.998
  163    H    GLU  24           H        GLU  24  -5.230  -2.011  -4.826
  164    HA   GLU  24           HA       GLU  24  -2.693  -2.874  -4.211
  165    HB2  GLU  24           HB2      GLU  24  -4.339  -4.421  -4.975
  166    HB3  GLU  24           HB3      GLU  24  -4.504  -3.585  -6.515
  167    HG2  GLU  24           HG2      GLU  24  -2.199  -4.241  -7.080
  168    HG3  GLU  24           HG3      GLU  24  -2.107  -5.133  -5.561
  169    H    SER  25           H        SER  25  -3.761  -1.465  -7.325
  170    HA   SER  25           HA       SER  25  -1.080  -1.372  -8.266
  171    HB2  SER  25           HB2      SER  25  -2.024   0.092 -10.089
  172    HB3  SER  25           HB3      SER  25  -2.693  -1.545  -9.972
  173    HG   SER  25           HG       SER  25  -4.576  -0.760  -9.319
  174    H    SER  26           H        SER  26  -3.149   0.988  -6.612
  175    HA   SER  26           HA       SER  26  -1.716   3.271  -7.322
  176    HB2  SER  26           HB2      SER  26  -2.592   4.323  -5.273
  177    HB3  SER  26           HB3      SER  26  -3.845   3.430  -6.128
  178    HG   SER  26           HG       SER  26  -2.868   1.695  -4.493
  179    H    VAL  27           H        VAL  27  -1.034   0.830  -4.890
  180    HA   VAL  27           HA       VAL  27   1.398   2.152  -4.045
  181    HB   VAL  27           HB       VAL  27   0.586  -0.720  -3.567
  182   HG11  VAL  27          2HG1      VAL  27   2.087  -0.561  -1.644
  183   HG12  VAL  27          1HG1      VAL  27   2.485   1.098  -2.088
  184   HG13  VAL  27          3HG1      VAL  27   2.944  -0.232  -3.151
  185   HG21  VAL  27          3HG2      VAL  27  -0.297   0.054  -1.412
  186   HG22  VAL  27          2HG2      VAL  27  -1.170   0.764  -2.771
  187   HG23  VAL  27          1HG2      VAL  27   0.020   1.722  -1.889
  188    H    LYS  28           H        LYS  28   0.512  -0.602  -6.088
  189    HA   LYS  28           HA       LYS  28   3.110  -1.552  -6.583
  190    HB2  LYS  28           HB2      LYS  28   1.138  -2.928  -6.883
  191    HB3  LYS  28           HB3      LYS  28   0.574  -1.884  -8.174
  192    HG2  LYS  28           HG2      LYS  28   1.522  -3.929  -9.053
  193    HG3  LYS  28           HG3      LYS  28   2.470  -2.526  -9.549
  194    HD2  LYS  28           HD2      LYS  28   4.108  -3.000  -7.810
  195    HD3  LYS  28           HD3      LYS  28   3.144  -4.374  -7.260
  196    HE2  LYS  28           HE2      LYS  28   3.405  -5.401  -9.477
  197    HE3  LYS  28           HE3      LYS  28   4.438  -4.057  -9.960
  198    HZ1  LYS  28           HZ1      LYS  28   5.646  -6.083  -9.208
  199    HZ2  LYS  28           HZ2      LYS  28   5.033  -5.823  -7.653
  200    HZ3  LYS  28           HZ3      LYS  28   6.060  -4.676  -8.360
  201    H    GLU  29           H        GLU  29   1.214   0.903  -8.234
  202    HA   GLU  29           HA       GLU  29   2.678   1.076 -10.620
  203    HB2  GLU  29           HB2      GLU  29   1.117   3.135  -9.073
  204    HB3  GLU  29           HB3      GLU  29   1.835   3.463 -10.646
  205    HG2  GLU  29           HG2      GLU  29   0.053   1.113 -10.305
  206    HG3  GLU  29           HG3      GLU  29  -0.651   2.722 -10.462
  207    H    LEU  30           H        LEU  30   3.328   2.094  -7.421
  208    HA   LEU  30           HA       LEU  30   5.356   4.028  -8.062
  209    HB2  LEU  30           HB2      LEU  30   4.961   2.552  -5.462
  210    HB3  LEU  30           HB3      LEU  30   5.873   4.030  -5.698
  211    HG   LEU  30           HG       LEU  30   2.887   3.691  -5.893
  212   HD11  LEU  30          2HD1      LEU  30   2.861   5.277  -4.037
  213   HD12  LEU  30          1HD1      LEU  30   4.624   5.285  -4.019
  214   HD13  LEU  30          3HD1      LEU  30   3.745   3.806  -3.630
  215   HD21  LEU  30          3HD2      LEU  30   2.841   6.133  -6.307
  216   HD22  LEU  30          2HD2      LEU  30   3.558   5.212  -7.630
  217   HD23  LEU  30          1HD2      LEU  30   4.593   6.099  -6.511
  218    H    ASN  31           H        ASN  31   7.607   3.817  -7.851
  219    HA   ASN  31           HA       ASN  31   8.578   1.213  -8.664
  220    HB2  ASN  31           HB2      ASN  31   9.387   3.256  -9.786
  221    HB3  ASN  31           HB3      ASN  31  10.063   3.818  -8.260
  222   HD21  ASN  31          1HD2      ASN  31  10.393   1.586 -10.897
  223   HD22  ASN  31          2HD2      ASN  31  11.998   1.066 -10.511
  224    H    GLY  32           H        GLY  32   9.497  -0.235  -7.390
  225    HA2  GLY  32           HA1      GLY  32  11.107  -0.776  -5.662
  226    HA3  GLY  32           HA2      GLY  32  10.559   0.651  -4.791
  227    H    VAL  33           H        VAL  33   7.903  -0.744  -6.117
  228    HA   VAL  33           HA       VAL  33   7.270  -2.125  -3.609
  229    HB   VAL  33           HB       VAL  33   5.456  -0.928  -5.706
  230   HG11  VAL  33          2HG1      VAL  33   3.610  -1.540  -4.222
  231   HG12  VAL  33          1HG1      VAL  33   4.742  -2.379  -3.162
  232   HG13  VAL  33          3HG1      VAL  33   4.470  -2.965  -4.803
  233   HG21  VAL  33          3HG2      VAL  33   4.793   0.550  -3.830
  234   HG22  VAL  33          2HG2      VAL  33   6.486   0.731  -4.293
  235   HG23  VAL  33          1HG2      VAL  33   6.061  -0.189  -2.850
  236    H    GLU  34           H        GLU  34   7.130  -4.231  -3.604
  237    HA   GLU  34           HA       GLU  34   7.270  -5.686  -6.126
  238    HB2  GLU  34           HB2      GLU  34   7.504  -6.630  -3.264
  239    HB3  GLU  34           HB3      GLU  34   7.726  -7.645  -4.680
  240    HG2  GLU  34           HG2      GLU  34   9.386  -5.221  -4.064
  241    HG3  GLU  34           HG3      GLU  34   9.824  -6.869  -3.618
  242    H    GLN  35           H        GLN  35   5.507  -6.209  -3.078
  243    HA   GLN  35           HA       GLN  35   3.238  -7.171  -4.683
  244    HB2  GLN  35           HB2      GLN  35   4.217  -8.322  -2.066
  245    HB3  GLN  35           HB3      GLN  35   2.825  -8.880  -2.981
  246    HG2  GLN  35           HG2      GLN  35   4.358  -9.467  -4.846
  247    HG3  GLN  35           HG3      GLN  35   5.715  -9.027  -3.809
  248   HE21  GLN  35          1HE2      GLN  35   2.796 -10.598  -2.689
  249   HE22  GLN  35          2HE2      GLN  35   3.538 -12.112  -2.278
  250    H    VAL  36           H        VAL  36   1.232  -6.592  -4.019
  251    HA   VAL  36           HA       VAL  36   1.028  -4.972  -1.563
  252    HB   VAL  36           HB       VAL  36  -0.594  -4.494  -4.067
  253   HG11  VAL  36          2HG1      VAL  36  -1.122  -2.347  -2.967
  254   HG12  VAL  36          1HG1      VAL  36  -0.235  -2.887  -1.541
  255   HG13  VAL  36          3HG1      VAL  36  -1.685  -3.749  -2.056
  256   HG21  VAL  36          3HG2      VAL  36   0.789  -2.541  -4.500
  257   HG22  VAL  36          2HG2      VAL  36   1.765  -4.009  -4.523
  258   HG23  VAL  36          1HG2      VAL  36   1.814  -2.939  -3.120
  259    H    LYS  37           H        LYS  37   0.101  -6.490  -0.251
  260    HA   LYS  37           HA       LYS  37  -2.140  -8.054  -1.297
  261    HB2  LYS  37           HB2      LYS  37  -0.739  -8.259   1.375
  262    HB3  LYS  37           HB3      LYS  37  -1.947  -9.371   0.752
  263    HG2  LYS  37           HG2      LYS  37  -0.427 -10.021  -1.047
  264    HG3  LYS  37           HG3      LYS  37   0.786  -8.904  -0.420
  265    HD2  LYS  37           HD2      LYS  37  -0.349 -11.313   1.000
  266    HD3  LYS  37           HD3      LYS  37   1.278 -11.155   0.335
  267    HE2  LYS  37           HE2      LYS  37   1.767  -9.373   1.908
  268    HE3  LYS  37           HE3      LYS  37   0.123  -9.450   2.536
  269    HZ1  LYS  37           HZ1      LYS  37   1.504 -10.623   4.024
  270    HZ2  LYS  37           HZ2      LYS  37   2.254 -11.498   2.780
  271    HZ3  LYS  37           HZ3      LYS  37   0.631 -11.804   3.170
  272    H    VAL  38           H        VAL  38  -3.771  -6.528  -1.371
  273    HA   VAL  38           HA       VAL  38  -4.489  -5.117   1.046
  274    HB   VAL  38           HB       VAL  38  -4.892  -3.915  -0.975
  275   HG11  VAL  38          2HG1      VAL  38  -6.599  -6.230  -1.878
  276   HG12  VAL  38          1HG1      VAL  38  -5.020  -5.784  -2.526
  277   HG13  VAL  38          3HG1      VAL  38  -6.396  -4.700  -2.733
  278   HG21  VAL  38          3HG2      VAL  38  -6.553  -3.570   0.761
  279   HG22  VAL  38          2HG2      VAL  38  -7.517  -4.906   0.131
  280   HG23  VAL  38          1HG2      VAL  38  -7.298  -3.446  -0.833
  281    H    GLN  39           H        GLN  39  -5.544  -6.042   2.634
  282    HA   GLN  39           HA       GLN  39  -7.208  -8.379   2.079
  283    HB2  GLN  39           HB2      GLN  39  -6.371  -7.217   4.743
  284    HB3  GLN  39           HB3      GLN  39  -7.174  -8.759   4.484
  285    HG2  GLN  39           HG2      GLN  39  -4.420  -8.038   3.503
  286    HG3  GLN  39           HG3      GLN  39  -4.782  -9.015   4.924
  287   HE21  GLN  39          1HE2      GLN  39  -6.978 -10.446   3.732
  288   HE22  GLN  39          2HE2      GLN  39  -6.287 -11.545   2.583
  289    H    LEU  40           H        LEU  40  -9.073  -7.570   1.273
  290    HA   LEU  40           HA       LEU  40 -10.229  -5.109   1.991
  291    HB2  LEU  40           HB2      LEU  40 -10.532  -6.752  -0.081
  292    HB3  LEU  40           HB3      LEU  40 -11.894  -7.314   0.861
  293    HG   LEU  40           HG       LEU  40 -12.532  -5.655  -0.845
  294   HD11  LEU  40          2HD1      LEU  40 -13.902  -5.867   1.147
  295   HD12  LEU  40          1HD1      LEU  40 -13.857  -4.194   0.593
  296   HD13  LEU  40          3HD1      LEU  40 -12.895  -4.687   1.986
  297   HD21  LEU  40          3HD2      LEU  40 -10.815  -3.768   0.759
  298   HD22  LEU  40          2HD2      LEU  40 -11.888  -3.313  -0.565
  299   HD23  LEU  40          1HD2      LEU  40 -10.491  -4.344  -0.877
  300    H    ALA  41           H        ALA  41 -10.700  -8.385   3.145
  301    HA   ALA  41           HA       ALA  41 -13.140  -7.914   4.529
  302    HB1  ALA  41           HB1      ALA  41 -12.458 -10.136   3.790
  303    HB2  ALA  41           HB2      ALA  41 -11.097 -10.095   4.910
  304    HB3  ALA  41           HB3      ALA  41 -12.748 -10.105   5.530
  305    H    GLU  42           H        GLU  42  -9.951  -7.029   5.252
  306    HA   GLU  42           HA       GLU  42 -10.585  -6.839   8.126
  307    HB2  GLU  42           HB2      GLU  42  -7.887  -7.017   6.775
  308    HB3  GLU  42           HB3      GLU  42  -8.131  -6.782   8.499
  309    HG2  GLU  42           HG2      GLU  42  -9.198  -8.942   8.680
  310    HG3  GLU  42           HG3      GLU  42  -9.070  -9.175   6.937
  311    H    GLY  43           H        GLY  43  -9.355  -5.155   5.308
  312    HA2  GLY  43           HA1      GLY  43  -9.444  -2.829   4.965
  313    HA3  GLY  43           HA2      GLY  43  -9.703  -2.608   6.693
  314    H    THR  44           H        THR  44  -7.183  -4.685   5.486
  315    HA   THR  44           HA       THR  44  -5.192  -2.620   6.147
  316    HB   THR  44           HB       THR  44  -3.784  -4.592   7.037
  317    HG1  THR  44           HG1      THR  44  -4.770  -6.455   6.904
  318   HG21  THR  44          3HG2      THR  44  -6.221  -3.701   8.587
  319   HG22  THR  44          1HG2      THR  44  -4.690  -2.833   8.483
  320   HG23  THR  44          2HG2      THR  44  -4.760  -4.404   9.281
  321    H    VAL  45           H        VAL  45  -3.175  -2.818   5.071
  322    HA   VAL  45           HA       VAL  45  -3.176  -4.649   2.761
  323    HB   VAL  45           HB       VAL  45  -2.345  -1.734   2.697
  324   HG11  VAL  45          2HG1      VAL  45  -0.920  -3.092   1.277
  325   HG12  VAL  45          1HG1      VAL  45  -2.007  -2.113   0.290
  326   HG13  VAL  45          3HG1      VAL  45  -2.335  -3.829   0.525
  327   HG21  VAL  45          3HG2      VAL  45  -4.663  -3.144   1.366
  328   HG22  VAL  45          2HG2      VAL  45  -4.202  -1.460   1.115
  329   HG23  VAL  45          1HG2      VAL  45  -4.771  -1.992   2.698
  330    H    GLU  46           H        GLU  46  -1.451  -5.927   2.824
  331    HA   GLU  46           HA       GLU  46   0.966  -5.049   4.230
  332    HB2  GLU  46           HB2      GLU  46   0.222  -7.707   3.002
  333    HB3  GLU  46           HB3      GLU  46   1.745  -7.376   3.811
  334    HG2  GLU  46           HG2      GLU  46   0.564  -6.967   5.895
  335    HG3  GLU  46           HG3      GLU  46  -0.977  -7.261   5.084
  336    H    VAL  47           H        VAL  47   2.554  -4.091   3.120
  337    HA   VAL  47           HA       VAL  47   2.724  -4.670   0.231
  338    HB   VAL  47           HB       VAL  47   3.485  -2.061   1.546
  339   HG11  VAL  47          2HG1      VAL  47   4.738  -2.554  -0.477
  340   HG12  VAL  47          1HG1      VAL  47   3.598  -1.238  -0.762
  341   HG13  VAL  47          3HG1      VAL  47   3.238  -2.860  -1.352
  342   HG21  VAL  47          3HG2      VAL  47   1.072  -2.390   1.662
  343   HG22  VAL  47          2HG2      VAL  47   1.025  -2.726  -0.067
  344   HG23  VAL  47          1HG2      VAL  47   1.482  -1.123   0.507
  345    H    THR  48           H        THR  48   4.632  -5.295  -0.570
  346    HA   THR  48           HA       THR  48   6.972  -5.351   1.200
  347    HB   THR  48           HB       THR  48   6.902  -6.496  -1.587
  348    HG1  THR  48           HG1      THR  48   5.476  -7.323   0.647
  349   HG21  THR  48          3HG2      THR  48   8.335  -7.288   0.954
  350   HG22  THR  48          1HG2      THR  48   9.050  -6.465  -0.433
  351   HG23  THR  48          2HG2      THR  48   8.467  -8.123  -0.593
  352    H    ILE  49           H        ILE  49   8.031  -3.414   1.140
  353    HA   ILE  49           HA       ILE  49   8.440  -2.198  -1.519
  354    HB   ILE  49           HB       ILE  49   8.703  -0.031  -0.414
  355   HG12  ILE  49          2HG1      ILE  49   7.786  -1.363   2.137
  356   HG13  ILE  49          3HG1      ILE  49   9.477  -1.021   1.786
  357   HG21  ILE  49          2HG2      ILE  49   6.515  -0.634  -1.247
  358   HG22  ILE  49          1HG2      ILE  49   6.362   0.323   0.226
  359   HG23  ILE  49          3HG2      ILE  49   6.124  -1.423   0.280
  360   HD11  ILE  49          3HD1      ILE  49   7.270   1.019   2.006
  361   HD12  ILE  49          2HD1      ILE  49   8.961   1.364   1.645
  362   HD13  ILE  49          1HD1      ILE  49   8.514   0.691   3.212
  363    H    ASP  50           H        ASP  50  10.439  -1.393  -2.043
  364    HA   ASP  50           HA       ASP  50  12.699  -2.249  -0.415
  365    HB2  ASP  50           HB2      ASP  50  12.661  -2.437  -2.953
  366    HB3  ASP  50           HB3      ASP  50  12.735  -0.680  -3.009
  367    H    SER  51           H        SER  51  12.923  -0.956   1.336
  368    HA   SER  51           HA       SER  51  11.989   1.741   1.331
  369    HB2  SER  51           HB2      SER  51  12.990   1.732   3.674
  370    HB3  SER  51           HB3      SER  51  11.723   0.550   3.352
  371    HG   SER  51           HG       SER  51  13.356  -0.523   4.369
  372    H    SER  52           H        SER  52  14.798   0.429   0.170
  373    HA   SER  52           HA       SER  52  16.420   2.777   0.768
  374    HB2  SER  52           HB2      SER  52  17.080   0.336  -0.893
  375    HB3  SER  52           HB3      SER  52  18.212   1.594  -0.397
  376    HG   SER  52           HG       SER  52  16.705   0.160   1.512
  377    H    VAL  53           H        VAL  53  13.997   2.056  -1.256
  378    HA   VAL  53           HA       VAL  53  14.986   3.929  -3.306
  379    HB   VAL  53           HB       VAL  53  13.071   1.627  -3.751
  380   HG11  VAL  53          2HG1      VAL  53  12.579   3.595  -5.131
  381   HG12  VAL  53          1HG1      VAL  53  13.170   2.241  -6.100
  382   HG13  VAL  53          3HG1      VAL  53  14.243   3.589  -5.720
  383   HG21  VAL  53          3HG2      VAL  53  14.842   0.627  -5.076
  384   HG22  VAL  53          2HG2      VAL  53  15.400   0.907  -3.425
  385   HG23  VAL  53          1HG2      VAL  53  15.905   1.991  -4.725
  386    H    VAL  54           H        VAL  54  11.846   2.458  -2.484
  387    HA   VAL  54           HA       VAL  54  10.675   5.146  -2.428
  388    HB   VAL  54           HB       VAL  54   9.607   3.442  -3.894
  389   HG11  VAL  54          2HG1      VAL  54   8.275   1.642  -2.879
  390   HG12  VAL  54          1HG1      VAL  54   8.975   2.033  -1.308
  391   HG13  VAL  54          3HG1      VAL  54  10.007   1.441  -2.611
  392   HG21  VAL  54          3HG2      VAL  54   8.296   5.305  -3.063
  393   HG22  VAL  54          2HG2      VAL  54   7.887   4.395  -1.610
  394   HG23  VAL  54          1HG2      VAL  54   7.300   3.855  -3.184
  395    H    THR  55           H        THR  55   9.534   5.896  -0.575
  396    HA   THR  55           HA       THR  55  10.193   4.377   1.860
  397    HB   THR  55           HB       THR  55   9.898   6.477   3.098
  398    HG1  THR  55           HG1      THR  55   9.338   7.543   0.501
  399   HG21  THR  55          3HG2      THR  55  12.119   5.936   2.239
  400   HG22  THR  55          1HG2      THR  55  11.848   7.680   2.218
  401   HG23  THR  55          2HG2      THR  55  11.740   6.752   0.722
  402    H    LEU  56           H        LEU  56   8.610   4.629   3.691
  403    HA   LEU  56           HA       LEU  56   6.092   3.616   2.975
  404    HB2  LEU  56           HB2      LEU  56   7.145   4.824   5.519
  405    HB3  LEU  56           HB3      LEU  56   5.495   4.245   5.387
  406    HG   LEU  56           HG       LEU  56   7.955   2.546   4.958
  407   HD11  LEU  56          2HD1      LEU  56   7.346   1.522   7.099
  408   HD12  LEU  56          1HD1      LEU  56   6.060   2.713   7.297
  409   HD13  LEU  56          3HD1      LEU  56   7.746   3.229   7.284
  410   HD21  LEU  56          3HD2      LEU  56   5.027   1.839   5.130
  411   HD22  LEU  56          2HD2      LEU  56   6.358   0.688   5.011
  412   HD23  LEU  56          1HD2      LEU  56   6.023   1.791   3.676
  413    H    LYS  57           H        LYS  57   7.178   6.867   3.730
  414    HA   LYS  57           HA       LYS  57   4.712   8.155   3.910
  415    HB2  LYS  57           HB2      LYS  57   7.038   9.085   4.402
  416    HB3  LYS  57           HB3      LYS  57   7.164   9.391   2.674
  417    HG2  LYS  57           HG2      LYS  57   4.895  10.440   4.324
  418    HG3  LYS  57           HG3      LYS  57   6.416  11.315   4.155
  419    HD2  LYS  57           HD2      LYS  57   4.894  10.402   1.736
  420    HD3  LYS  57           HD3      LYS  57   4.427  11.877   2.578
  421    HE2  LYS  57           HE2      LYS  57   5.888  12.464   0.769
  422    HE3  LYS  57           HE3      LYS  57   6.757  12.709   2.280
  423    HZ1  LYS  57           HZ1      LYS  57   8.186  11.669   0.684
  424    HZ2  LYS  57           HZ2      LYS  57   7.082  10.417   0.408
  425    HZ3  LYS  57           HZ3      LYS  57   7.856  10.550   1.911
  426    H    ASP  58           H        ASP  58   6.702   7.405   1.075
  427    HA   ASP  58           HA       ASP  58   5.177   8.870  -0.788
  428    HB2  ASP  58           HB2      ASP  58   6.803   6.371  -1.308
  429    HB3  ASP  58           HB3      ASP  58   6.314   7.570  -2.503
  430    H    ILE  59           H        ILE  59   5.050   5.505   0.264
  431    HA   ILE  59           HA       ILE  59   2.903   4.629  -1.304
  432    HB   ILE  59           HB       ILE  59   3.464   3.809   1.554
  433   HG12  ILE  59          2HG1      ILE  59   5.533   3.670   0.261
  434   HG13  ILE  59          3HG1      ILE  59   4.923   2.056   0.612
  435   HG21  ILE  59          2HG2      ILE  59   1.349   2.991   0.658
  436   HG22  ILE  59          1HG2      ILE  59   2.494   1.671   0.895
  437   HG23  ILE  59          3HG2      ILE  59   2.196   2.299  -0.725
  438   HD11  ILE  59          3HD1      ILE  59   4.047   1.889  -1.650
  439   HD12  ILE  59          2HD1      ILE  59   5.778   2.226  -1.657
  440   HD13  ILE  59          1HD1      ILE  59   4.626   3.517  -2.002
  441    H    VAL  60           H        VAL  60   2.935   5.971   1.977
  442    HA   VAL  60           HA       VAL  60   0.221   6.127   2.495
  443    HB   VAL  60           HB       VAL  60   2.581   7.737   3.411
  444   HG11  VAL  60          2HG1      VAL  60   0.873   9.391   3.454
  445   HG12  VAL  60          1HG1      VAL  60   1.081   8.805   5.105
  446   HG13  VAL  60          3HG1      VAL  60  -0.292   8.257   4.143
  447   HG21  VAL  60          3HG2      VAL  60   2.296   5.483   4.277
  448   HG22  VAL  60          2HG2      VAL  60   0.667   5.881   4.821
  449   HG23  VAL  60          1HG2      VAL  60   2.060   6.676   5.555
  450    H    ALA  61           H        ALA  61   2.288   8.528   0.898
  451    HA   ALA  61           HA       ALA  61   0.418  10.578   0.656
  452    HB1  ALA  61           HB1      ALA  61   2.693   9.914  -1.208
  453    HB2  ALA  61           HB2      ALA  61   1.855  11.463  -1.106
  454    HB3  ALA  61           HB3      ALA  61   2.808  10.885   0.260
  455    H    VAL  62           H        VAL  62   1.222   7.975  -1.637
  456    HA   VAL  62           HA       VAL  62  -0.646   8.854  -3.597
  457    HB   VAL  62           HB       VAL  62   0.632   6.130  -3.282
  458   HG11  VAL  62          2HG1      VAL  62  -0.725   7.388  -5.670
  459   HG12  VAL  62          1HG1      VAL  62  -1.362   6.059  -4.700
  460   HG13  VAL  62          3HG1      VAL  62   0.105   5.831  -5.653
  461   HG21  VAL  62          3HG2      VAL  62   2.260   7.942  -3.506
  462   HG22  VAL  62          2HG2      VAL  62   1.439   8.501  -4.963
  463   HG23  VAL  62          1HG2      VAL  62   2.231   6.925  -4.947
  464    H    ILE  63           H        ILE  63  -0.759   6.320  -1.102
  465    HA   ILE  63           HA       ILE  63  -3.182   5.151  -1.825
  466    HB   ILE  63           HB       ILE  63  -1.932   5.426   0.907
  467   HG12  ILE  63          2HG1      ILE  63  -2.026   3.161  -1.099
  468   HG13  ILE  63          3HG1      ILE  63  -0.613   4.122  -0.670
  469   HG21  ILE  63          2HG2      ILE  63  -4.306   5.087   1.201
  470   HG22  ILE  63          1HG2      ILE  63  -3.441   3.604   1.607
  471   HG23  ILE  63          3HG2      ILE  63  -4.285   3.741   0.064
  472   HD11  ILE  63          3HD1      ILE  63  -0.511   1.971   0.404
  473   HD12  ILE  63          2HD1      ILE  63  -2.100   2.222   1.127
  474   HD13  ILE  63          1HD1      ILE  63  -0.739   3.230   1.618
  475    H    GLU  64           H        GLU  64  -2.631   7.785   0.536
  476    HA   GLU  64           HA       GLU  64  -5.387   8.061   1.131
  477    HB2  GLU  64           HB2      GLU  64  -3.144  10.044   1.508
  478    HB3  GLU  64           HB3      GLU  64  -4.762  10.215   2.174
  479    HG2  GLU  64           HG2      GLU  64  -4.312   7.935   3.277
  480    HG3  GLU  64           HG3      GLU  64  -2.618   8.270   2.916
  481    H    ASP  65           H        ASP  65  -3.314   9.446  -1.291
  482    HA   ASP  65           HA       ASP  65  -4.974  11.556  -2.153
  483    HB2  ASP  65           HB2      ASP  65  -2.605  11.343  -2.792
  484    HB3  ASP  65           HB3      ASP  65  -2.985   9.902  -3.725
  485    H    GLN  66           H        GLN  66  -5.086   8.130  -2.628
  486    HA   GLN  66           HA       GLN  66  -6.848   8.213  -4.901
  487    HB2  GLN  66           HB2      GLN  66  -6.179   5.912  -3.055
  488    HB3  GLN  66           HB3      GLN  66  -7.012   5.783  -4.600
  489    HG2  GLN  66           HG2      GLN  66  -4.188   6.740  -4.195
  490    HG3  GLN  66           HG3      GLN  66  -4.668   5.147  -4.774
  491   HE21  GLN  66          1HE2      GLN  66  -6.836   6.143  -6.414
  492   HE22  GLN  66          2HE2      GLN  66  -6.106   6.914  -7.779
  493    H    GLY  67           H        GLY  67  -7.262   8.667  -1.576
  494    HA2  GLY  67           HA1      GLY  67  -9.473   9.474  -0.916
  495    HA3  GLY  67           HA2      GLY  67 -10.160   8.184  -1.889
  496    H    TYR  68           H        TYR  68  -7.395   7.543   0.093
  497    HA   TYR  68           HA       TYR  68  -9.113   6.071   1.975
  498    HB2  TYR  68           HB2      TYR  68  -6.273   5.503   1.142
  499    HB3  TYR  68           HB3      TYR  68  -7.157   4.608   2.369
  500    HD1  TYR  68           HD2      TYR  68  -9.249   3.351   1.664
  501    HD2  TYR  68           HD1      TYR  68  -6.461   4.924  -1.141
  502    HE1  TYR  68           HE2      TYR  68 -10.138   1.840  -0.060
  503    HE2  TYR  68           HE1      TYR  68  -7.340   3.413  -2.872
  504    HH   TYR  68           HH       TYR  68  -8.551   1.284  -3.010
  505    H    ASP  69           H        ASP  69  -8.545   6.072   4.188
  506    HA   ASP  69           HA       ASP  69  -6.778   8.304   4.942
  507    HB2  ASP  69           HB2      ASP  69  -9.127   8.537   5.705
  508    HB3  ASP  69           HB3      ASP  69  -8.965   7.027   6.600
  509    H    VAL  70           H        VAL  70  -4.844   7.659   5.570
  510    HA   VAL  70           HA       VAL  70  -4.517   5.463   7.384
  511    HB   VAL  70           HB       VAL  70  -4.632   4.000   5.591
  512   HG11  VAL  70          2HG1      VAL  70  -3.153   6.037   3.933
  513   HG12  VAL  70          1HG1      VAL  70  -4.852   5.563   3.787
  514   HG13  VAL  70          3HG1      VAL  70  -3.572   4.414   3.384
  515   HG21  VAL  70          3HG2      VAL  70  -2.360   3.222   5.116
  516   HG22  VAL  70          2HG2      VAL  70  -2.553   3.647   6.815
  517   HG23  VAL  70          1HG2      VAL  70  -1.709   4.744   5.723
  518    H    GLN  71           H        GLN  71  -3.163   6.332   8.754
  519    HA   GLN  71           HA       GLN  71  -0.664   7.481   7.777
  520    HB2  GLN  71           HB2      GLN  71  -2.400   9.309   8.178
  521    HB3  GLN  71           HB3      GLN  71  -2.312   8.882   9.881
  522    HG2  GLN  71           HG2      GLN  71  -0.912  10.767   9.515
  523    HG3  GLN  71           HG3      GLN  71   0.120   9.371   9.821
  524   HE21  GLN  71          1HE2      GLN  71  -1.510   9.806   6.787
  525   HE22  GLN  71          2HE2      GLN  71  -0.106  10.176   5.850
  Start of MODEL    5
    1    H1   SER   1           H1       SER   1  16.254  -3.982  -5.292
    2    H2   SER   1           H2       SER   1  15.205  -3.076  -4.312
    3    H3   SER   1           H3       SER   1  14.577  -4.071  -5.533
    4    HA   SER   1           HA       SER   1  14.315  -5.056  -3.333
    5    HB2  SER   1           HB2      SER   1  16.327  -6.550  -5.033
    6    HB3  SER   1           HB3      SER   1  15.101  -7.247  -3.975
    7    HG   SER   1           HG       SER   1  13.831  -7.213  -5.636
    8    H    ASN   2           H        ASN   2  16.338  -3.029  -2.841
    9    HA   ASN   2           HA       ASN   2  18.716  -4.384  -1.916
   10    HB2  ASN   2           HB2      ASN   2  18.633  -2.030  -2.892
   11    HB3  ASN   2           HB3      ASN   2  17.958  -1.522  -1.347
   12   HD21  ASN   2          1HD2      ASN   2  20.425  -3.971  -1.915
   13   HD22  ASN   2          2HD2      ASN   2  21.698  -3.142  -1.082
   14    H    ALA   3           H        ALA   3  15.985  -2.676  -0.386
   15    HA   ALA   3           HA       ALA   3  16.506  -4.271   2.030
   16    HB1  ALA   3           HB1      ALA   3  15.882  -1.317   2.034
   17    HB2  ALA   3           HB2      ALA   3  16.001  -2.347   3.460
   18    HB3  ALA   3           HB3      ALA   3  17.426  -2.053   2.464
   19    H    MET   4           H        MET   4  14.809  -5.597   1.924
   20    HA   MET   4           HA       MET   4  12.269  -4.622   0.909
   21    HB2  MET   4           HB2      MET   4  13.027  -7.405   1.784
   22    HB3  MET   4           HB3      MET   4  11.573  -6.951   0.908
   23    HG2  MET   4           HG2      MET   4  14.410  -6.926  -0.072
   24    HG3  MET   4           HG3      MET   4  13.062  -7.903  -0.653
   25    HE1  MET   4           HE1      MET   4  10.954  -6.857  -1.945
   26    HE2  MET   4           HE2      MET   4  10.741  -5.670  -0.660
   27    HE3  MET   4           HE3      MET   4  10.812  -5.144  -2.342
   28    H    GLU   5           H        GLU   5  10.891  -3.725   2.221
   29    HA   GLU   5           HA       GLU   5  10.649  -4.750   4.973
   30    HB2  GLU   5           HB2      GLU   5  10.121  -1.987   3.867
   31    HB3  GLU   5           HB3      GLU   5   9.665  -2.490   5.490
   32    HG2  GLU   5           HG2      GLU   5  12.473  -2.451   4.405
   33    HG3  GLU   5           HG3      GLU   5  11.758  -1.219   5.446
   34    H    GLN   6           H        GLN   6   8.792  -5.682   5.494
   35    HA   GLN   6           HA       GLN   6   6.504  -5.301   3.682
   36    HB2  GLN   6           HB2      GLN   6   7.376  -7.591   3.696
   37    HB3  GLN   6           HB3      GLN   6   7.162  -7.662   5.438
   38    HG2  GLN   6           HG2      GLN   6   4.778  -7.493   5.201
   39    HG3  GLN   6           HG3      GLN   6   4.932  -7.262   3.462
   40   HE21  GLN   6          1HE2      GLN   6   6.925  -9.506   5.233
   41   HE22  GLN   6          2HE2      GLN   6   6.214 -10.949   4.581
   42    H    LEU   7           H        LEU   7   4.983  -4.071   4.492
   43    HA   LEU   7           HA       LEU   7   4.543  -4.077   7.403
   44    HB2  LEU   7           HB2      LEU   7   4.557  -1.683   5.562
   45    HB3  LEU   7           HB3      LEU   7   4.092  -1.646   7.250
   46    HG   LEU   7           HG       LEU   7   6.843  -2.321   6.205
   47   HD11  LEU   7          2HD1      LEU   7   7.494  -0.185   7.202
   48   HD12  LEU   7          1HD1      LEU   7   5.810   0.132   7.618
   49   HD13  LEU   7          3HD1      LEU   7   6.297   0.033   5.926
   50   HD21  LEU   7          3HD2      LEU   7   5.831  -2.014   9.029
   51   HD22  LEU   7          2HD2      LEU   7   7.518  -2.224   8.560
   52   HD23  LEU   7          1HD2      LEU   7   6.354  -3.515   8.267
   53    H    THR   8           H        THR   8   2.447  -3.861   8.094
   54    HA   THR   8           HA       THR   8   0.392  -4.162   6.012
   55    HB   THR   8           HB       THR   8   0.147  -4.789   8.962
   56    HG1  THR   8           HG1      THR   8   0.357  -7.015   8.141
   57   HG21  THR   8          3HG2      THR   8  -1.523  -5.618   6.582
   58   HG22  THR   8          1HG2      THR   8  -1.981  -4.421   7.793
   59   HG23  THR   8          2HG2      THR   8  -1.791  -6.113   8.255
   60    H    LEU   9           H        LEU   9  -0.657  -2.352   5.556
   61    HA   LEU   9           HA       LEU   9  -0.911  -0.277   7.624
   62    HB2  LEU   9           HB2      LEU   9  -1.735   0.931   5.337
   63    HB3  LEU   9           HB3      LEU   9  -0.096   0.980   5.950
   64    HG   LEU   9           HG       LEU   9  -0.876  -1.234   4.094
   65   HD11  LEU   9          2HD1      LEU   9  -0.280   0.167   2.182
   66   HD12  LEU   9          1HD1      LEU   9  -0.152   1.565   3.247
   67   HD13  LEU   9          3HD1      LEU   9  -1.712   0.780   3.008
   68   HD21  LEU   9          3HD2      LEU   9   1.323  -1.288   5.142
   69   HD22  LEU   9          2HD2      LEU   9   1.662   0.338   4.548
   70   HD23  LEU   9          1HD2      LEU   9   1.475  -0.995   3.410
   71    H    GLN  10           H        GLN  10  -2.881   0.699   8.054
   72    HA   GLN  10           HA       GLN  10  -5.205  -0.938   7.369
   73    HB2  GLN  10           HB2      GLN  10  -6.355   0.385   9.154
   74    HB3  GLN  10           HB3      GLN  10  -4.971  -0.539   9.717
   75    HG2  GLN  10           HG2      GLN  10  -3.611   1.430   9.768
   76    HG3  GLN  10           HG3      GLN  10  -4.917   2.394   9.080
   77   HE21  GLN  10          1HE2      GLN  10  -6.685   2.919  10.359
   78   HE22  GLN  10          2HE2      GLN  10  -6.651   2.777  12.085
   79    H    VAL  11           H        VAL  11  -6.775  -0.293   6.063
   80    HA   VAL  11           HA       VAL  11  -6.414   2.346   4.815
   81    HB   VAL  11           HB       VAL  11  -7.869  -0.002   3.609
   82   HG11  VAL  11          2HG1      VAL  11  -8.383   2.161   2.630
   83   HG12  VAL  11          1HG1      VAL  11  -7.454   1.175   1.501
   84   HG13  VAL  11          3HG1      VAL  11  -6.665   2.479   2.389
   85   HG21  VAL  11          3HG2      VAL  11  -5.613  -0.741   4.038
   86   HG22  VAL  11          2HG2      VAL  11  -4.959   0.729   3.309
   87   HG23  VAL  11          1HG2      VAL  11  -5.818  -0.443   2.310
   88    H    GLU  12           H        GLU  12  -7.765   3.687   5.880
   89    HA   GLU  12           HA       GLU  12 -10.494   2.808   6.430
   90    HB2  GLU  12           HB2      GLU  12  -9.049   5.341   7.225
   91    HB3  GLU  12           HB3      GLU  12 -10.667   4.887   7.741
   92    HG2  GLU  12           HG2      GLU  12  -9.738   2.906   8.853
   93    HG3  GLU  12           HG3      GLU  12  -8.120   3.414   8.372
   94    H    GLY  13           H        GLY  13 -11.989   3.140   4.953
   95    HA2  GLY  13           HA1      GLY  13 -13.319   4.972   3.934
   96    HA3  GLY  13           HA2      GLY  13 -11.800   5.585   3.300
   97    H    MET  14           H        MET  14 -12.728   2.185   3.401
   98    HA   MET  14           HA       MET  14 -12.193   1.950   0.583
   99    HB2  MET  14           HB2      MET  14 -13.029  -0.010   2.700
  100    HB3  MET  14           HB3      MET  14 -12.959  -0.464   1.004
  101    HG2  MET  14           HG2      MET  14 -10.569   0.234   0.992
  102    HG3  MET  14           HG3      MET  14 -10.688   0.472   2.736
  103    HE1  MET  14           HE1      MET  14  -8.612  -2.893   2.189
  104    HE2  MET  14           HE2      MET  14  -8.635  -1.497   1.111
  105    HE3  MET  14           HE3      MET  14  -8.546  -1.262   2.858
  106    H    SER  15           H        SER  15 -13.578   1.761  -1.065
  107    HA   SER  15           HA       SER  15 -16.429   2.075  -0.549
  108    HB2  SER  15           HB2      SER  15 -15.241   3.458  -2.276
  109    HB3  SER  15           HB3      SER  15 -14.955   1.986  -3.199
  110    HG   SER  15           HG       SER  15 -17.325   3.406  -2.773
  111    H    CYS  16           H        CYS  16 -14.417  -0.416  -0.557
  112    HA   CYS  16           HA       CYS  16 -14.640  -2.663  -0.629
  113    HB2  CYS  16           HB2      CYS  16 -16.881  -2.328   0.317
  114    HB3  CYS  16           HB3      CYS  16 -17.537  -2.116  -1.302
  115    HG   CYS  16           HG       CYS  16 -17.131  -4.717  -2.121
  116    H    GLY  17           H        GLY  17 -14.172  -4.199  -2.104
  117    HA2  GLY  17           HA1      GLY  17 -14.026  -5.305  -4.110
  118    HA3  GLY  17           HA2      GLY  17 -15.339  -4.304  -4.702
  119    H    HIS  18           H        HIS  18 -14.776  -2.136  -5.480
  120    HA   HIS  18           HA       HIS  18 -12.701  -2.201  -7.359
  121    HB2  HIS  18           HB2      HIS  18 -14.605  -0.168  -6.375
  122    HB3  HIS  18           HB3      HIS  18 -13.136   0.468  -7.105
  123    HD1  HIS  18           HD1      HIS  18 -13.891   1.243  -9.335
  124    HD2  HIS  18           HD2      HIS  18 -15.282  -2.579  -8.449
  125    HE1  HIS  18           HE1      HIS  18 -14.997   0.415 -11.437
  126    HE2  HIS  18           HE2      HIS  18 -15.648  -1.968 -10.942
  127    H    CYS  19           H        CYS  19 -12.752  -1.111  -4.055
  128    HA   CYS  19           HA       CYS  19 -10.447   0.493  -4.098
  129    HB2  CYS  19           HB2      CYS  19 -10.406   0.090  -1.630
  130    HB3  CYS  19           HB3      CYS  19 -11.965   0.636  -2.242
  131    HG   CYS  19           HG       CYS  19 -11.351  -1.925  -0.381
  132    H    VAL  20           H        VAL  20 -10.868  -2.953  -4.046
  133    HA   VAL  20           HA       VAL  20  -8.391  -3.725  -2.950
  134    HB   VAL  20           HB       VAL  20 -10.073  -5.170  -5.009
  135   HG11  VAL  20          2HG1      VAL  20  -7.890  -6.193  -3.199
  136   HG12  VAL  20          1HG1      VAL  20  -7.817  -6.054  -4.956
  137   HG13  VAL  20          3HG1      VAL  20  -8.935  -7.194  -4.208
  138   HG21  VAL  20          3HG2      VAL  20 -10.015  -5.404  -2.005
  139   HG22  VAL  20          2HG2      VAL  20 -10.959  -6.416  -3.097
  140   HG23  VAL  20          1HG2      VAL  20 -11.310  -4.693  -2.967
  141    H    ASN  21           H        ASN  21  -9.389  -3.551  -6.366
  142    HA   ASN  21           HA       ASN  21  -6.823  -3.998  -7.439
  143    HB2  ASN  21           HB2      ASN  21  -9.077  -2.452  -8.740
  144    HB3  ASN  21           HB3      ASN  21  -7.744  -3.262  -9.555
  145   HD21  ASN  21          1HD2      ASN  21  -7.792  -5.487  -9.800
  146   HD22  ASN  21          2HD2      ASN  21  -9.223  -6.419  -9.518
  147    H    ALA  22           H        ALA  22  -8.581  -1.091  -6.549
  148    HA   ALA  22           HA       ALA  22  -6.825   0.780  -7.708
  149    HB1  ALA  22           HB1      ALA  22  -9.107   1.328  -7.008
  150    HB2  ALA  22           HB2      ALA  22  -8.619   1.161  -5.321
  151    HB3  ALA  22           HB3      ALA  22  -7.915   2.432  -6.320
  152    H    ILE  23           H        ILE  23  -7.014  -0.417  -4.323
  153    HA   ILE  23           HA       ILE  23  -4.847   1.234  -3.498
  154    HB   ILE  23           HB       ILE  23  -6.552   0.386  -1.907
  155   HG12  ILE  23          2HG1      ILE  23  -4.920  -0.193  -0.091
  156   HG13  ILE  23          3HG1      ILE  23  -3.663  -0.269  -1.326
  157   HG21  ILE  23          2HG2      ILE  23  -6.770  -1.899  -2.713
  158   HG22  ILE  23          1HG2      ILE  23  -6.352  -1.878  -1.000
  159   HG23  ILE  23          3HG2      ILE  23  -5.119  -2.250  -2.204
  160   HD11  ILE  23          3HD1      ILE  23  -4.012   2.064  -1.851
  161   HD12  ILE  23          2HD1      ILE  23  -3.666   1.858  -0.135
  162   HD13  ILE  23          1HD1      ILE  23  -5.320   2.151  -0.673
  163    H    GLU  24           H        GLU  24  -5.108  -2.128  -4.524
  164    HA   GLU  24           HA       GLU  24  -2.525  -2.958  -3.902
  165    HB2  GLU  24           HB2      GLU  24  -4.297  -4.497  -4.640
  166    HB3  GLU  24           HB3      GLU  24  -4.226  -3.799  -6.256
  167    HG2  GLU  24           HG2      GLU  24  -1.798  -4.505  -6.301
  168    HG3  GLU  24           HG3      GLU  24  -2.144  -5.436  -4.845
  169    H    SER  25           H        SER  25  -3.778  -1.533  -6.932
  170    HA   SER  25           HA       SER  25  -1.184  -1.429  -8.091
  171    HB2  SER  25           HB2      SER  25  -2.254   0.075  -9.788
  172    HB3  SER  25           HB3      SER  25  -2.993  -1.524  -9.628
  173    HG   SER  25           HG       SER  25  -4.713  -0.649  -8.596
  174    H    SER  26           H        SER  26  -3.103   0.802  -6.194
  175    HA   SER  26           HA       SER  26  -1.788   3.176  -6.743
  176    HB2  SER  26           HB2      SER  26  -3.792   2.998  -5.278
  177    HB3  SER  26           HB3      SER  26  -2.790   2.265  -4.026
  178    HG   SER  26           HG       SER  26  -1.505   4.393  -4.524
  179    H    VAL  27           H        VAL  27  -0.913   0.592  -4.485
  180    HA   VAL  27           HA       VAL  27   1.618   1.858  -3.880
  181    HB   VAL  27           HB       VAL  27   0.776  -0.962  -3.218
  182   HG11  VAL  27          2HG1      VAL  27   2.829   0.875  -1.993
  183   HG12  VAL  27          1HG1      VAL  27   3.161  -0.529  -3.007
  184   HG13  VAL  27          3HG1      VAL  27   2.424  -0.743  -1.418
  185   HG21  VAL  27          3HG2      VAL  27   0.398   1.548  -1.587
  186   HG22  VAL  27          2HG2      VAL  27   0.066  -0.097  -1.045
  187   HG23  VAL  27          1HG2      VAL  27  -0.881   0.608  -2.355
  188    H    LYS  28           H        LYS  28   0.473  -0.862  -5.841
  189    HA   LYS  28           HA       LYS  28   2.997  -1.986  -6.384
  190    HB2  LYS  28           HB2      LYS  28   0.923  -3.244  -6.614
  191    HB3  LYS  28           HB3      LYS  28   0.415  -2.201  -7.932
  192    HG2  LYS  28           HG2      LYS  28   2.205  -3.020  -9.324
  193    HG3  LYS  28           HG3      LYS  28   2.832  -3.993  -7.995
  194    HD2  LYS  28           HD2      LYS  28   0.075  -4.319  -9.171
  195    HD3  LYS  28           HD3      LYS  28   1.476  -5.268  -9.668
  196    HE2  LYS  28           HE2      LYS  28   1.725  -6.065  -7.348
  197    HE3  LYS  28           HE3      LYS  28   0.284  -5.153  -6.899
  198    HZ1  LYS  28           HZ1      LYS  28   0.253  -7.243  -9.003
  199    HZ2  LYS  28           HZ2      LYS  28  -1.073  -6.549  -8.201
  200    HZ3  LYS  28           HZ3      LYS  28  -0.029  -7.592  -7.371
  201    H    GLU  29           H        GLU  29   1.193   0.539  -8.051
  202    HA   GLU  29           HA       GLU  29   2.744   0.541 -10.429
  203    HB2  GLU  29           HB2      GLU  29   1.171   2.766  -9.124
  204    HB3  GLU  29           HB3      GLU  29   1.862   2.847 -10.736
  205    HG2  GLU  29           HG2      GLU  29   0.459   0.900 -11.370
  206    HG3  GLU  29           HG3      GLU  29  -0.294   0.983  -9.778
  207    H    LEU  30           H        LEU  30   3.147   1.896  -7.282
  208    HA   LEU  30           HA       LEU  30   5.003   3.925  -7.884
  209    HB2  LEU  30           HB2      LEU  30   4.822   2.332  -5.326
  210    HB3  LEU  30           HB3      LEU  30   5.597   3.891  -5.522
  211    HG   LEU  30           HG       LEU  30   2.649   3.298  -5.678
  212   HD11  LEU  30          2HD1      LEU  30   4.266   4.971  -3.767
  213   HD12  LEU  30          1HD1      LEU  30   3.556   3.393  -3.423
  214   HD13  LEU  30          3HD1      LEU  30   2.512   4.776  -3.749
  215   HD21  LEU  30          3HD2      LEU  30   3.210   4.951  -7.360
  216   HD22  LEU  30          2HD2      LEU  30   4.096   5.895  -6.162
  217   HD23  LEU  30          1HD2      LEU  30   2.348   5.707  -6.020
  218    H    ASN  31           H        ASN  31   7.190   3.973  -8.020
  219    HA   ASN  31           HA       ASN  31   8.495   1.499  -8.704
  220    HB2  ASN  31           HB2      ASN  31   8.917   3.637  -9.919
  221    HB3  ASN  31           HB3      ASN  31   9.684   4.273  -8.468
  222   HD21  ASN  31          1HD2      ASN  31  11.672   4.541  -9.398
  223   HD22  ASN  31          2HD2      ASN  31  12.682   3.212  -9.869
  224    H    GLY  32           H        GLY  32   9.533   0.209  -7.328
  225    HA2  GLY  32           HA1      GLY  32  11.233  -0.006  -5.584
  226    HA3  GLY  32           HA2      GLY  32  10.495   1.380  -4.791
  227    H    VAL  33           H        VAL  33   8.304  -0.792  -6.220
  228    HA   VAL  33           HA       VAL  33   7.737  -1.975  -3.596
  229    HB   VAL  33           HB       VAL  33   5.791  -1.125  -5.745
  230   HG11  VAL  33          2HG1      VAL  33   5.249  -2.585  -3.162
  231   HG12  VAL  33          1HG1      VAL  33   5.114  -3.264  -4.784
  232   HG13  VAL  33          3HG1      VAL  33   4.030  -1.968  -4.278
  233   HG21  VAL  33          3HG2      VAL  33   4.892   0.316  -3.972
  234   HG22  VAL  33          2HG2      VAL  33   6.574   0.695  -4.341
  235   HG23  VAL  33          1HG2      VAL  33   6.176  -0.232  -2.894
  236    H    GLU  34           H        GLU  34   7.746  -4.094  -3.512
  237    HA   GLU  34           HA       GLU  34   8.317  -5.544  -5.960
  238    HB2  GLU  34           HB2      GLU  34   9.823  -6.083  -4.259
  239    HB3  GLU  34           HB3      GLU  34   8.562  -6.165  -3.041
  240    HG2  GLU  34           HG2      GLU  34   7.759  -8.229  -3.916
  241    HG3  GLU  34           HG3      GLU  34   8.835  -8.118  -5.308
  242    H    GLN  35           H        GLN  35   6.045  -5.853  -3.212
  243    HA   GLN  35           HA       GLN  35   4.040  -6.855  -5.042
  244    HB2  GLN  35           HB2      GLN  35   3.567  -8.870  -3.719
  245    HB3  GLN  35           HB3      GLN  35   5.174  -8.908  -4.431
  246    HG2  GLN  35           HG2      GLN  35   6.139  -8.254  -2.306
  247    HG3  GLN  35           HG3      GLN  35   4.535  -8.192  -1.583
  248   HE21  GLN  35          1HE2      GLN  35   3.641 -10.547  -3.094
  249   HE22  GLN  35          2HE2      GLN  35   4.367 -11.904  -2.310
  250    H    VAL  36           H        VAL  36   1.936  -6.722  -4.278
  251    HA   VAL  36           HA       VAL  36   1.590  -5.378  -1.674
  252    HB   VAL  36           HB       VAL  36  -0.015  -4.746  -4.158
  253   HG11  VAL  36          2HG1      VAL  36   0.131  -3.419  -1.457
  254   HG12  VAL  36          1HG1      VAL  36  -1.219  -4.353  -2.100
  255   HG13  VAL  36          3HG1      VAL  36  -0.780  -2.813  -2.839
  256   HG21  VAL  36          3HG2      VAL  36   1.195  -2.615  -4.241
  257   HG22  VAL  36          2HG2      VAL  36   2.270  -3.991  -4.492
  258   HG23  VAL  36          1HG2      VAL  36   2.242  -3.168  -2.933
  259    H    LYS  37           H        LYS  37   0.406  -6.666  -0.406
  260    HA   LYS  37           HA       LYS  37  -1.628  -8.377  -1.680
  261    HB2  LYS  37           HB2      LYS  37  -0.129  -8.840   0.910
  262    HB3  LYS  37           HB3      LYS  37  -1.341  -9.911   0.218
  263    HG2  LYS  37           HG2      LYS  37   0.072 -10.413  -1.649
  264    HG3  LYS  37           HG3      LYS  37   1.245  -9.195  -1.145
  265    HD2  LYS  37           HD2      LYS  37   0.516 -11.678   0.406
  266    HD3  LYS  37           HD3      LYS  37   1.973 -11.467  -0.567
  267    HE2  LYS  37           HE2      LYS  37   2.667  -9.620   0.874
  268    HE3  LYS  37           HE3      LYS  37   1.205  -9.819   1.839
  269    HZ1  LYS  37           HZ1      LYS  37   3.051 -10.886   2.914
  270    HZ2  LYS  37           HZ2      LYS  37   3.395 -11.802   1.531
  271    HZ3  LYS  37           HZ3      LYS  37   1.962 -12.074   2.390
  272    H    VAL  38           H        VAL  38  -3.371  -6.997  -1.538
  273    HA   VAL  38           HA       VAL  38  -3.980  -5.699   0.973
  274    HB   VAL  38           HB       VAL  38  -4.509  -4.456  -1.003
  275   HG11  VAL  38          2HG1      VAL  38  -4.742  -6.304  -2.575
  276   HG12  VAL  38          1HG1      VAL  38  -6.116  -5.201  -2.674
  277   HG13  VAL  38          3HG1      VAL  38  -6.282  -6.744  -1.835
  278   HG21  VAL  38          3HG2      VAL  38  -7.057  -5.474   0.245
  279   HG22  VAL  38          2HG2      VAL  38  -6.890  -3.986  -0.686
  280   HG23  VAL  38          1HG2      VAL  38  -6.051  -4.161   0.856
  281    H    GLN  39           H        GLN  39  -5.395  -6.322   2.486
  282    HA   GLN  39           HA       GLN  39  -6.979  -8.726   1.944
  283    HB2  GLN  39           HB2      GLN  39  -6.093  -7.573   4.594
  284    HB3  GLN  39           HB3      GLN  39  -7.182  -8.939   4.431
  285    HG2  GLN  39           HG2      GLN  39  -5.159  -9.951   4.831
  286    HG3  GLN  39           HG3      GLN  39  -5.266  -9.996   3.075
  287   HE21  GLN  39          1HE2      GLN  39  -3.076 -10.120   2.773
  288   HE22  GLN  39          2HE2      GLN  39  -2.017  -8.786   3.080
  289    H    LEU  40           H        LEU  40  -8.853  -7.991   1.125
  290    HA   LEU  40           HA       LEU  40  -9.959  -5.472   1.697
  291    HB2  LEU  40           HB2      LEU  40 -10.345  -6.902  -0.346
  292    HB3  LEU  40           HB3      LEU  40 -11.434  -7.873   0.620
  293    HG   LEU  40           HG       LEU  40 -12.449  -6.082  -0.920
  294   HD11  LEU  40          2HD1      LEU  40 -14.237  -5.576   0.653
  295   HD12  LEU  40          1HD1      LEU  40 -13.218  -6.096   1.995
  296   HD13  LEU  40          3HD1      LEU  40 -13.743  -7.265   0.783
  297   HD21  LEU  40          3HD2      LEU  40 -10.948  -4.269  -0.343
  298   HD22  LEU  40          2HD2      LEU  40 -11.482  -4.331   1.338
  299   HD23  LEU  40          1HD2      LEU  40 -12.609  -3.842   0.070
  300    H    ALA  41           H        ALA  41 -10.715  -8.691   2.952
  301    HA   ALA  41           HA       ALA  41 -13.071  -8.176   4.282
  302    HB1  ALA  41           HB1      ALA  41 -10.857 -10.003   5.194
  303    HB2  ALA  41           HB2      ALA  41 -12.546 -10.086   5.693
  304    HB3  ALA  41           HB3      ALA  41 -12.106 -10.403   4.015
  305    H    GLU  42           H        GLU  42  -9.772  -7.668   5.502
  306    HA   GLU  42           HA       GLU  42 -10.781  -6.753   8.050
  307    HB2  GLU  42           HB2      GLU  42  -7.956  -6.964   7.012
  308    HB3  GLU  42           HB3      GLU  42  -8.426  -6.661   8.670
  309    HG2  GLU  42           HG2      GLU  42  -9.561  -8.875   8.693
  310    HG3  GLU  42           HG3      GLU  42  -8.886  -9.172   7.092
  311    H    GLY  43           H        GLY  43  -9.843  -5.407   5.050
  312    HA2  GLY  43           HA1      GLY  43  -9.825  -3.195   4.367
  313    HA3  GLY  43           HA2      GLY  43 -10.236  -2.726   6.013
  314    H    THR  44           H        THR  44  -7.509  -4.569   4.749
  315    HA   THR  44           HA       THR  44  -5.642  -2.466   5.534
  316    HB   THR  44           HB       THR  44  -4.260  -4.417   6.630
  317    HG1  THR  44           HG1      THR  44  -5.363  -6.200   6.846
  318   HG21  THR  44          3HG2      THR  44  -6.560  -3.012   7.977
  319   HG22  THR  44          1HG2      THR  44  -4.880  -2.488   7.892
  320   HG23  THR  44          2HG2      THR  44  -5.312  -3.907   8.843
  321    H    VAL  45           H        VAL  45  -3.427  -2.940   4.747
  322    HA   VAL  45           HA       VAL  45  -3.375  -4.986   2.638
  323    HB   VAL  45           HB       VAL  45  -2.143  -2.270   2.209
  324   HG11  VAL  45          2HG1      VAL  45  -2.145  -3.023  -0.144
  325   HG12  VAL  45          1HG1      VAL  45  -2.785  -4.581   0.388
  326   HG13  VAL  45          3HG1      VAL  45  -1.182  -4.057   0.912
  327   HG21  VAL  45          3HG2      VAL  45  -4.013  -1.758   0.713
  328   HG22  VAL  45          2HG2      VAL  45  -4.548  -1.940   2.383
  329   HG23  VAL  45          1HG2      VAL  45  -4.822  -3.240   1.223
  330    H    GLU  46           H        GLU  46  -1.667  -6.236   2.756
  331    HA   GLU  46           HA       GLU  46   0.617  -5.428   4.400
  332    HB2  GLU  46           HB2      GLU  46  -0.449  -7.594   4.881
  333    HB3  GLU  46           HB3      GLU  46  -0.145  -8.112   3.230
  334    HG2  GLU  46           HG2      GLU  46   2.231  -8.081   3.610
  335    HG3  GLU  46           HG3      GLU  46   1.992  -7.424   5.231
  336    H    VAL  47           H        VAL  47   2.153  -4.384   3.302
  337    HA   VAL  47           HA       VAL  47   2.561  -5.085   0.460
  338    HB   VAL  47           HB       VAL  47   3.144  -2.431   1.784
  339   HG11  VAL  47          2HG1      VAL  47   3.371  -1.606  -0.508
  340   HG12  VAL  47          1HG1      VAL  47   3.085  -3.235  -1.121
  341   HG13  VAL  47          3HG1      VAL  47   4.527  -2.894  -0.167
  342   HG21  VAL  47          3HG2      VAL  47   0.741  -2.863   1.761
  343   HG22  VAL  47          2HG2      VAL  47   0.813  -3.205   0.033
  344   HG23  VAL  47          1HG2      VAL  47   1.167  -1.582   0.626
  345    H    THR  48           H        THR  48   4.589  -5.492  -0.281
  346    HA   THR  48           HA       THR  48   6.814  -5.257   1.640
  347    HB   THR  48           HB       THR  48   6.687  -7.090  -0.769
  348    HG1  THR  48           HG1      THR  48   5.449  -7.317   1.575
  349   HG21  THR  48          3HG2      THR  48   8.565  -7.002   1.601
  350   HG22  THR  48          1HG2      THR  48   8.957  -6.493  -0.042
  351   HG23  THR  48          2HG2      THR  48   8.606  -8.188   0.297
  352    H    ILE  49           H        ILE  49   7.985  -3.503   1.214
  353    HA   ILE  49           HA       ILE  49   8.262  -2.638  -1.602
  354    HB   ILE  49           HB       ILE  49   8.573  -0.351  -0.790
  355   HG12  ILE  49          2HG1      ILE  49   7.865  -1.263   1.992
  356   HG13  ILE  49          3HG1      ILE  49   9.540  -1.237   1.452
  357   HG21  ILE  49          2HG2      ILE  49   6.101  -1.619   0.389
  358   HG22  ILE  49          1HG2      ILE  49   6.294  -1.080  -1.279
  359   HG23  ILE  49          3HG2      ILE  49   6.315   0.096   0.034
  360   HD11  ILE  49          3HD1      ILE  49   9.352   1.151   1.001
  361   HD12  ILE  49          2HD1      ILE  49   8.990   0.771   2.684
  362   HD13  ILE  49          1HD1      ILE  49   7.678   1.124   1.557
  363    H    ASP  50           H        ASP  50  10.267  -1.451  -2.073
  364    HA   ASP  50           HA       ASP  50  12.543  -2.350  -0.451
  365    HB2  ASP  50           HB2      ASP  50  12.627  -2.665  -2.958
  366    HB3  ASP  50           HB3      ASP  50  12.604  -0.912  -3.115
  367    H    SER  51           H        SER  51  12.841  -1.003   1.196
  368    HA   SER  51           HA       SER  51  11.948   1.711   1.104
  369    HB2  SER  51           HB2      SER  51  11.765   0.454   3.165
  370    HB3  SER  51           HB3      SER  51  13.503   0.189   3.201
  371    HG   SER  51           HG       SER  51  13.324   2.740   3.062
  372    H    SER  52           H        SER  52  14.600   0.326  -0.214
  373    HA   SER  52           HA       SER  52  16.392   2.574   0.284
  374    HB2  SER  52           HB2      SER  52  16.777   0.144  -1.482
  375    HB3  SER  52           HB3      SER  52  18.021   1.311  -1.022
  376    HG   SER  52           HG       SER  52  16.727  -0.636   0.548
  377    H    VAL  53           H        VAL  53  13.829   1.895  -1.675
  378    HA   VAL  53           HA       VAL  53  14.835   3.641  -3.828
  379    HB   VAL  53           HB       VAL  53  12.889   1.343  -4.080
  380   HG11  VAL  53          2HG1      VAL  53  13.924   3.225  -6.200
  381   HG12  VAL  53          1HG1      VAL  53  12.291   3.225  -5.529
  382   HG13  VAL  53          3HG1      VAL  53  12.864   1.840  -6.463
  383   HG21  VAL  53          3HG2      VAL  53  15.251   0.682  -3.838
  384   HG22  VAL  53          2HG2      VAL  53  15.657   1.684  -5.232
  385   HG23  VAL  53          1HG2      VAL  53  14.598   0.286  -5.430
  386    H    VAL  54           H        VAL  54  11.868   2.456  -2.262
  387    HA   VAL  54           HA       VAL  54  10.675   5.090  -2.788
  388    HB   VAL  54           HB       VAL  54   9.555   3.033  -3.791
  389   HG11  VAL  54          2HG1      VAL  54   8.074   1.749  -2.310
  390   HG12  VAL  54          1HG1      VAL  54   8.808   2.544  -0.915
  391   HG13  VAL  54          3HG1      VAL  54   9.782   1.495  -1.947
  392   HG21  VAL  54          3HG2      VAL  54   7.291   3.815  -3.271
  393   HG22  VAL  54          2HG2      VAL  54   8.399   5.147  -3.607
  394   HG23  VAL  54          1HG2      VAL  54   7.944   4.778  -1.943
  395    H    THR  55           H        THR  55   9.456   6.061  -1.044
  396    HA   THR  55           HA       THR  55  10.414   5.149   1.579
  397    HB   THR  55           HB       THR  55   9.961   7.407   2.406
  398    HG1  THR  55           HG1      THR  55   9.142   7.913  -0.288
  399   HG21  THR  55          3HG2      THR  55  12.171   6.962   1.470
  400   HG22  THR  55          1HG2      THR  55  11.681   8.625   1.141
  401   HG23  THR  55          2HG2      THR  55  11.594   7.411  -0.135
  402    H    LEU  56           H        LEU  56   8.927   5.414   3.404
  403    HA   LEU  56           HA       LEU  56   6.454   4.156   2.939
  404    HB2  LEU  56           HB2      LEU  56   7.346   5.761   5.341
  405    HB3  LEU  56           HB3      LEU  56   5.971   4.677   5.302
  406    HG   LEU  56           HG       LEU  56   8.860   3.866   4.974
  407   HD11  LEU  56          2HD1      LEU  56   8.522   2.756   7.144
  408   HD12  LEU  56          1HD1      LEU  56   6.917   3.477   7.245
  409   HD13  LEU  56          3HD1      LEU  56   8.347   4.507   7.253
  410   HD21  LEU  56          3HD2      LEU  56   6.364   2.179   5.099
  411   HD22  LEU  56          2HD2      LEU  56   8.021   1.581   5.036
  412   HD23  LEU  56          1HD2      LEU  56   7.349   2.459   3.662
  413    H    LYS  57           H        LYS  57   7.366   7.538   3.256
  414    HA   LYS  57           HA       LYS  57   4.772   8.615   3.507
  415    HB2  LYS  57           HB2      LYS  57   7.165   9.710   3.744
  416    HB3  LYS  57           HB3      LYS  57   6.902  10.123   2.055
  417    HG2  LYS  57           HG2      LYS  57   4.971  10.804   4.255
  418    HG3  LYS  57           HG3      LYS  57   6.245  11.891   3.703
  419    HD2  LYS  57           HD2      LYS  57   5.258  11.795   1.423
  420    HD3  LYS  57           HD3      LYS  57   3.944  10.809   2.072
  421    HE2  LYS  57           HE2      LYS  57   4.631  13.604   2.982
  422    HE3  LYS  57           HE3      LYS  57   3.343  13.195   1.852
  423    HZ1  LYS  57           HZ1      LYS  57   2.569  13.521   4.151
  424    HZ2  LYS  57           HZ2      LYS  57   3.502  12.196   4.646
  425    HZ3  LYS  57           HZ3      LYS  57   2.218  11.972   3.561
  426    H    ASP  58           H        ASP  58   6.759   7.823   0.673
  427    HA   ASP  58           HA       ASP  58   5.100   8.851  -1.325
  428    HB2  ASP  58           HB2      ASP  58   6.812   6.355  -1.369
  429    HB3  ASP  58           HB3      ASP  58   6.007   7.012  -2.787
  430    H    ILE  59           H        ILE  59   5.116   5.654   0.166
  431    HA   ILE  59           HA       ILE  59   2.952   4.514  -1.152
  432    HB   ILE  59           HB       ILE  59   3.703   4.100   1.748
  433   HG12  ILE  59          2HG1      ILE  59   5.664   3.839   0.306
  434   HG13  ILE  59          3HG1      ILE  59   5.151   2.284   0.952
  435   HG21  ILE  59          2HG2      ILE  59   2.296   2.288  -0.204
  436   HG22  ILE  59          1HG2      ILE  59   1.564   3.114   1.172
  437   HG23  ILE  59          3HG2      ILE  59   2.773   1.857   1.438
  438   HD11  ILE  59          3HD1      ILE  59   4.062   1.774  -1.185
  439   HD12  ILE  59          2HD1      ILE  59   5.789   2.078  -1.371
  440   HD13  ILE  59          1HD1      ILE  59   4.622   3.320  -1.825
  441    H    VAL  60           H        VAL  60   2.975   6.130   2.010
  442    HA   VAL  60           HA       VAL  60   0.245   6.068   2.511
  443    HB   VAL  60           HB       VAL  60   2.340   8.039   3.423
  444   HG11  VAL  60          2HG1      VAL  60  -0.473   7.673   4.444
  445   HG12  VAL  60          1HG1      VAL  60   0.174   9.096   3.624
  446   HG13  VAL  60          3HG1      VAL  60   0.777   8.646   5.219
  447   HG21  VAL  60          3HG2      VAL  60   2.260   6.734   5.506
  448   HG22  VAL  60          2HG2      VAL  60   2.738   5.747   4.125
  449   HG23  VAL  60          1HG2      VAL  60   1.096   5.637   4.761
  450    H    ALA  61           H        ALA  61   2.151   8.680   1.012
  451    HA   ALA  61           HA       ALA  61   0.090  10.556   0.830
  452    HB1  ALA  61           HB1      ALA  61   2.456  11.111   0.558
  453    HB2  ALA  61           HB2      ALA  61   2.471  10.265  -0.991
  454    HB3  ALA  61           HB3      ALA  61   1.483  11.711  -0.786
  455    H    VAL  62           H        VAL  62   1.193   8.178  -1.576
  456    HA   VAL  62           HA       VAL  62  -0.617   9.001  -3.593
  457    HB   VAL  62           HB       VAL  62   0.739   6.320  -3.230
  458   HG11  VAL  62          2HG1      VAL  62  -0.574   7.524  -5.667
  459   HG12  VAL  62          1HG1      VAL  62  -1.164   6.145  -4.738
  460   HG13  VAL  62          3HG1      VAL  62   0.349   6.021  -5.637
  461   HG21  VAL  62          3HG2      VAL  62   2.367   7.171  -4.843
  462   HG22  VAL  62          2HG2      VAL  62   2.322   8.167  -3.389
  463   HG23  VAL  62          1HG2      VAL  62   1.536   8.726  -4.866
  464    H    ILE  63           H        ILE  63  -0.807   6.618  -1.004
  465    HA   ILE  63           HA       ILE  63  -3.220   5.403  -1.830
  466    HB   ILE  63           HB       ILE  63  -1.915   5.598   0.878
  467   HG12  ILE  63          2HG1      ILE  63  -2.197   3.311  -1.083
  468   HG13  ILE  63          3HG1      ILE  63  -0.751   4.292  -0.867
  469   HG21  ILE  63          2HG2      ILE  63  -3.472   3.849   1.623
  470   HG22  ILE  63          1HG2      ILE  63  -4.343   3.985   0.095
  471   HG23  ILE  63          3HG2      ILE  63  -4.310   5.347   1.216
  472   HD11  ILE  63          3HD1      ILE  63  -2.005   2.529   1.218
  473   HD12  ILE  63          2HD1      ILE  63  -0.547   3.499   1.421
  474   HD13  ILE  63          1HD1      ILE  63  -0.561   2.160   0.273
  475    H    GLU  64           H        GLU  64  -2.598   7.988   0.556
  476    HA   GLU  64           HA       GLU  64  -5.306   8.352   1.242
  477    HB2  GLU  64           HB2      GLU  64  -3.053  10.361   1.369
  478    HB3  GLU  64           HB3      GLU  64  -4.615  10.534   2.157
  479    HG2  GLU  64           HG2      GLU  64  -4.084   8.377   3.380
  480    HG3  GLU  64           HG3      GLU  64  -2.439   8.561   2.766
  481    H    ASP  65           H        ASP  65  -3.382   9.515  -1.388
  482    HA   ASP  65           HA       ASP  65  -5.018  11.645  -2.253
  483    HB2  ASP  65           HB2      ASP  65  -2.687  11.291  -3.003
  484    HB3  ASP  65           HB3      ASP  65  -3.201   9.858  -3.888
  485    H    GLN  66           H        GLN  66  -5.337   8.215  -2.523
  486    HA   GLN  66           HA       GLN  66  -7.186   8.298  -4.746
  487    HB2  GLN  66           HB2      GLN  66  -6.659   5.980  -2.887
  488    HB3  GLN  66           HB3      GLN  66  -7.347   5.921  -4.500
  489    HG2  GLN  66           HG2      GLN  66  -4.514   6.621  -3.781
  490    HG3  GLN  66           HG3      GLN  66  -5.077   5.127  -4.528
  491   HE21  GLN  66          1HE2      GLN  66  -3.142   7.080  -5.440
  492   HE22  GLN  66          2HE2      GLN  66  -3.682   7.616  -6.992
  493    H    GLY  67           H        GLY  67  -7.472   9.229  -1.647
  494    HA2  GLY  67           HA1      GLY  67  -9.505   9.908  -0.653
  495    HA3  GLY  67           HA2      GLY  67 -10.353   8.727  -1.639
  496    H    TYR  68           H        TYR  68  -7.534   8.317   0.472
  497    HA   TYR  68           HA       TYR  68  -9.163   6.606   2.225
  498    HB2  TYR  68           HB2      TYR  68  -6.371   5.961   1.243
  499    HB3  TYR  68           HB3      TYR  68  -7.277   5.031   2.433
  500    HD1  TYR  68           HD2      TYR  68  -9.633   4.185   1.606
  501    HD2  TYR  68           HD1      TYR  68  -6.431   5.274  -0.967
  502    HE1  TYR  68           HE2      TYR  68 -10.619   2.827  -0.189
  503    HE2  TYR  68           HE1      TYR  68  -7.409   3.917  -2.771
  504    HH   TYR  68           HH       TYR  68 -10.575   2.719  -2.653
  505    H    ASP  69           H        ASP  69  -8.370   6.394   4.373
  506    HA   ASP  69           HA       ASP  69  -6.410   8.448   5.161
  507    HB2  ASP  69           HB2      ASP  69  -8.717   7.212   6.664
  508    HB3  ASP  69           HB3      ASP  69  -7.410   8.046   7.498
  509    H    VAL  70           H        VAL  70  -4.465   7.543   5.323
  510    HA   VAL  70           HA       VAL  70  -4.229   5.078   6.891
  511    HB   VAL  70           HB       VAL  70  -2.412   4.283   5.435
  512   HG11  VAL  70          2HG1      VAL  70  -3.784   3.550   3.557
  513   HG12  VAL  70          1HG1      VAL  70  -4.984   4.784   3.953
  514   HG13  VAL  70          3HG1      VAL  70  -4.675   3.456   5.078
  515   HG21  VAL  70          3HG2      VAL  70  -1.998   5.254   3.263
  516   HG22  VAL  70          2HG2      VAL  70  -1.738   6.470   4.514
  517   HG23  VAL  70          1HG2      VAL  70  -3.219   6.494   3.551
  518    H    GLN  71           H        GLN  71  -2.618   5.100   8.381
  519    HA   GLN  71           HA       GLN  71  -0.502   7.091   8.189
  520    HB2  GLN  71           HB2      GLN  71  -2.422   8.163   9.420
  521    HB3  GLN  71           HB3      GLN  71  -2.248   6.923  10.654
  522    HG2  GLN  71           HG2      GLN  71  -1.121   8.808  11.476
  523    HG3  GLN  71           HG3      GLN  71   0.134   7.698  10.931
  524   HE21  GLN  71          1HE2      GLN  71   1.334   8.206   9.086
  525   HE22  GLN  71          2HE2      GLN  71   1.358   9.806   8.426
  Start of MODEL    6
    1    H1   SER   1           H1       SER   1  23.140  -1.487  -1.082
    2    H2   SER   1           H2       SER   1  21.760  -2.261  -0.480
    3    H3   SER   1           H3       SER   1  21.795  -0.570  -0.601
    4    HA   SER   1           HA       SER   1  21.876  -0.679  -2.976
    5    HB2  SER   1           HB2      SER   1  23.128  -2.827  -3.112
    6    HB3  SER   1           HB3      SER   1  21.675  -3.683  -2.600
    7    HG   SER   1           HG       SER   1  22.182  -2.315  -5.026
    8    H    ASN   2           H        ASN   2  20.004  -3.340  -1.502
    9    HA   ASN   2           HA       ASN   2  17.618  -1.672  -1.621
   10    HB2  ASN   2           HB2      ASN   2  16.299  -3.537  -2.646
   11    HB3  ASN   2           HB3      ASN   2  17.467  -2.803  -3.733
   12   HD21  ASN   2          1HD2      ASN   2  17.482  -4.586  -5.058
   13   HD22  ASN   2          2HD2      ASN   2  18.278  -6.062  -4.616
   14    H    ALA   3           H        ALA   3  15.833  -2.547  -0.382
   15    HA   ALA   3           HA       ALA   3  16.247  -4.764   1.381
   16    HB1  ALA   3           HB1      ALA   3  16.366  -1.998   2.585
   17    HB2  ALA   3           HB2      ALA   3  16.305  -3.517   3.479
   18    HB3  ALA   3           HB3      ALA   3  17.710  -3.136   2.483
   19    H    MET   4           H        MET   4  14.237  -5.523   0.998
   20    HA   MET   4           HA       MET   4  12.002  -3.680   0.963
   21    HB2  MET   4           HB2      MET   4  10.640  -5.756   0.486
   22    HB3  MET   4           HB3      MET   4  11.817  -5.297  -0.733
   23    HG2  MET   4           HG2      MET   4  12.599  -7.274   1.346
   24    HG3  MET   4           HG3      MET   4  11.543  -7.786   0.027
   25    HE1  MET   4           HE1      MET   4  13.732  -6.820  -3.093
   26    HE2  MET   4           HE2      MET   4  12.176  -7.446  -2.545
   27    HE3  MET   4           HE3      MET   4  12.604  -5.760  -2.247
   28    H    GLU   5           H        GLU   5  10.590  -3.361   2.474
   29    HA   GLU   5           HA       GLU   5  10.707  -5.014   4.901
   30    HB2  GLU   5           HB2      GLU   5  10.028  -2.114   4.471
   31    HB3  GLU   5           HB3      GLU   5   9.578  -2.960   5.946
   32    HG2  GLU   5           HG2      GLU   5  12.365  -2.559   4.889
   33    HG3  GLU   5           HG3      GLU   5  11.632  -1.757   6.276
   34    H    GLN   6           H        GLN   6   8.810  -5.788   5.785
   35    HA   GLN   6           HA       GLN   6   6.506  -5.745   3.970
   36    HB2  GLN   6           HB2      GLN   6   7.231  -7.616   6.229
   37    HB3  GLN   6           HB3      GLN   6   5.728  -7.704   5.324
   38    HG2  GLN   6           HG2      GLN   6   6.933  -8.165   3.287
   39    HG3  GLN   6           HG3      GLN   6   8.472  -7.975   4.123
   40   HE21  GLN   6          1HE2      GLN   6   5.659  -9.985   3.709
   41   HE22  GLN   6          2HE2      GLN   6   6.340 -11.416   4.417
   42    H    LEU   7           H        LEU   7   5.416  -3.925   4.485
   43    HA   LEU   7           HA       LEU   7   4.824  -3.458   7.326
   44    HB2  LEU   7           HB2      LEU   7   4.935  -1.524   5.013
   45    HB3  LEU   7           HB3      LEU   7   4.421  -1.096   6.636
   46    HG   LEU   7           HG       LEU   7   7.167  -2.124   5.893
   47   HD11  LEU   7          2HD1      LEU   7   7.922   0.147   6.363
   48   HD12  LEU   7          1HD1      LEU   7   6.253   0.652   6.628
   49   HD13  LEU   7          3HD1      LEU   7   6.771   0.119   5.029
   50   HD21  LEU   7          3HD2      LEU   7   6.118  -1.042   8.505
   51   HD22  LEU   7          2HD2      LEU   7   7.776  -1.548   8.176
   52   HD23  LEU   7          1HD2      LEU   7   6.472  -2.736   8.165
   53    H    THR   8           H        THR   8   2.863  -3.824   7.969
   54    HA   THR   8           HA       THR   8   0.694  -3.962   6.006
   55    HB   THR   8           HB       THR   8   0.783  -4.882   8.889
   56    HG1  THR   8           HG1      THR   8   0.504  -6.945   7.322
   57   HG21  THR   8          3HG2      THR   8  -1.301  -6.102   8.285
   58   HG22  THR   8          1HG2      THR   8  -1.320  -5.234   6.751
   59   HG23  THR   8          2HG2      THR   8  -1.483  -4.348   8.266
   60    H    LEU   9           H        LEU   9  -0.178  -2.008   5.701
   61    HA   LEU   9           HA       LEU   9  -0.541  -0.261   8.023
   62    HB2  LEU   9           HB2      LEU   9  -1.088   1.448   6.190
   63    HB3  LEU   9           HB3      LEU   9   0.581   0.960   6.404
   64    HG   LEU   9           HG       LEU   9  -0.089  -0.762   4.485
   65   HD11  LEU   9          2HD1      LEU   9  -1.953   1.569   4.090
   66   HD12  LEU   9          1HD1      LEU   9  -2.403  -0.118   4.335
   67   HD13  LEU   9          3HD1      LEU   9  -1.565   0.368   2.860
   68   HD21  LEU   9          3HD2      LEU   9   0.835   0.816   2.872
   69   HD22  LEU   9          2HD2      LEU   9   1.725   0.875   4.394
   70   HD23  LEU   9          1HD2      LEU   9   0.564   2.142   4.002
   71    H    GLN  10           H        GLN  10  -2.550   0.702   8.476
   72    HA   GLN  10           HA       GLN  10  -4.788  -0.976   7.650
   73    HB2  GLN  10           HB2      GLN  10  -6.044   0.150   9.455
   74    HB3  GLN  10           HB3      GLN  10  -4.564  -0.605  10.033
   75    HG2  GLN  10           HG2      GLN  10  -3.443   1.516  10.076
   76    HG3  GLN  10           HG3      GLN  10  -4.866   2.315   9.416
   77   HE21  GLN  10          1HE2      GLN  10  -3.433   2.791  11.903
   78   HE22  GLN  10          2HE2      GLN  10  -4.598   2.593  13.174
   79    H    VAL  11           H        VAL  11  -6.650  -0.239   6.734
   80    HA   VAL  11           HA       VAL  11  -6.377   2.356   5.362
   81    HB   VAL  11           HB       VAL  11  -7.759  -0.094   4.272
   82   HG11  VAL  11          2HG1      VAL  11  -6.877   2.479   2.977
   83   HG12  VAL  11          1HG1      VAL  11  -8.537   1.986   3.318
   84   HG13  VAL  11          3HG1      VAL  11  -7.579   1.098   2.132
   85   HG21  VAL  11          3HG2      VAL  11  -5.417  -0.620   4.548
   86   HG22  VAL  11          2HG2      VAL  11  -4.959   0.882   3.741
   87   HG23  VAL  11          1HG2      VAL  11  -5.784  -0.387   2.835
   88    H    GLU  12           H        GLU  12  -7.900   3.743   5.907
   89    HA   GLU  12           HA       GLU  12 -10.504   2.721   6.819
   90    HB2  GLU  12           HB2      GLU  12  -9.418   5.505   7.240
   91    HB3  GLU  12           HB3      GLU  12 -10.753   4.726   8.082
   92    HG2  GLU  12           HG2      GLU  12  -9.142   3.134   9.074
   93    HG3  GLU  12           HG3      GLU  12  -7.835   4.020   8.295
   94    H    GLY  13           H        GLY  13 -12.210   3.032   5.525
   95    HA2  GLY  13           HA1      GLY  13 -13.578   4.485   4.184
   96    HA3  GLY  13           HA2      GLY  13 -12.113   5.251   3.590
   97    H    MET  14           H        MET  14 -13.041   1.822   3.821
   98    HA   MET  14           HA       MET  14 -12.110   1.343   1.140
   99    HB2  MET  14           HB2      MET  14 -13.390  -0.364   3.253
  100    HB3  MET  14           HB3      MET  14 -13.227  -0.958   1.606
  101    HG2  MET  14           HG2      MET  14 -10.959  -0.021   3.348
  102    HG3  MET  14           HG3      MET  14 -11.406  -1.703   3.061
  103    HE1  MET  14           HE1      MET  14  -8.135  -1.557   0.999
  104    HE2  MET  14           HE2      MET  14  -8.453  -0.839   2.578
  105    HE3  MET  14           HE3      MET  14  -9.078  -2.444   2.195
  106    H    SER  15           H        SER  15 -13.232   1.502  -0.671
  107    HA   SER  15           HA       SER  15 -15.841   2.556  -0.697
  108    HB2  SER  15           HB2      SER  15 -14.433   1.229  -3.019
  109    HB3  SER  15           HB3      SER  15 -15.668   2.489  -3.084
  110    HG   SER  15           HG       SER  15 -13.963   3.685  -1.728
  111    H    CYS  16           H        CYS  16 -14.805  -0.562  -2.144
  112    HA   CYS  16           HA       CYS  16 -17.008  -1.987  -1.034
  113    HB2  CYS  16           HB2      CYS  16 -18.078  -2.452  -3.309
  114    HB3  CYS  16           HB3      CYS  16 -18.385  -0.874  -2.591
  115    HG   CYS  16           HG       CYS  16 -18.090  -0.273  -5.213
  116    H    GLY  17           H        GLY  17 -15.665  -2.394  -4.297
  117    HA2  GLY  17           HA1      GLY  17 -14.131  -4.710  -3.301
  118    HA3  GLY  17           HA2      GLY  17 -15.234  -4.898  -4.657
  119    H    HIS  18           H        HIS  18 -14.806  -2.847  -6.275
  120    HA   HIS  18           HA       HIS  18 -12.370  -3.446  -7.533
  121    HB2  HIS  18           HB2      HIS  18 -12.855  -1.610  -9.064
  122    HB3  HIS  18           HB3      HIS  18 -14.312  -2.538  -8.747
  123    HD1  HIS  18           HD1      HIS  18 -16.325  -1.223  -8.097
  124    HD2  HIS  18           HD2      HIS  18 -12.799   0.925  -7.559
  125    HE1  HIS  18           HE1      HIS  18 -17.032   1.094  -7.428
  126    HE2  HIS  18           HE2      HIS  18 -14.885   2.360  -7.037
  127    H    CYS  19           H        CYS  19 -12.991  -1.432  -4.894
  128    HA   CYS  19           HA       CYS  19 -11.027   0.542  -5.160
  129    HB2  CYS  19           HB2      CYS  19 -11.118   0.576  -2.626
  130    HB3  CYS  19           HB3      CYS  19 -12.658   0.799  -3.449
  131    HG   CYS  19           HG       CYS  19 -11.758  -1.503  -1.256
  132    H    VAL  20           H        VAL  20 -10.867  -2.809  -4.192
  133    HA   VAL  20           HA       VAL  20  -8.301  -2.843  -3.046
  134    HB   VAL  20           HB       VAL  20  -9.724  -5.040  -4.569
  135   HG11  VAL  20          2HG1      VAL  20  -8.261  -6.576  -3.325
  136   HG12  VAL  20          1HG1      VAL  20  -7.389  -5.192  -2.666
  137   HG13  VAL  20          3HG1      VAL  20  -7.353  -5.514  -4.400
  138   HG21  VAL  20          3HG2      VAL  20 -11.021  -4.237  -2.675
  139   HG22  VAL  20          2HG2      VAL  20  -9.626  -4.443  -1.614
  140   HG23  VAL  20          1HG2      VAL  20 -10.386  -5.852  -2.354
  141    H    ASN  21           H        ASN  21  -9.368  -3.495  -6.372
  142    HA   ASN  21           HA       ASN  21  -6.847  -4.021  -7.471
  143    HB2  ASN  21           HB2      ASN  21  -9.219  -2.760  -8.866
  144    HB3  ASN  21           HB3      ASN  21  -7.877  -3.593  -9.640
  145   HD21  ASN  21          1HD2      ASN  21  -7.748  -5.825  -9.533
  146   HD22  ASN  21          2HD2      ASN  21  -9.113  -6.806  -9.077
  147    H    ALA  22           H        ALA  22  -8.671  -1.009  -7.173
  148    HA   ALA  22           HA       ALA  22  -6.934   0.663  -8.585
  149    HB1  ALA  22           HB1      ALA  22  -9.197   1.314  -7.949
  150    HB2  ALA  22           HB2      ALA  22  -8.710   1.364  -6.255
  151    HB3  ALA  22           HB3      ALA  22  -8.012   2.503  -7.406
  152    H    ILE  23           H        ILE  23  -7.133   0.170  -5.042
  153    HA   ILE  23           HA       ILE  23  -4.884   1.825  -4.528
  154    HB   ILE  23           HB       ILE  23  -6.561   1.459  -2.804
  155   HG12  ILE  23          2HG1      ILE  23  -3.849   0.372  -2.016
  156   HG13  ILE  23          3HG1      ILE  23  -4.293   2.073  -2.110
  157   HG21  ILE  23          2HG2      ILE  23  -6.704  -0.664  -1.584
  158   HG22  ILE  23          1HG2      ILE  23  -5.580  -1.389  -2.734
  159   HG23  ILE  23          3HG2      ILE  23  -7.164  -0.838  -3.278
  160   HD11  ILE  23          3HD1      ILE  23  -4.283   1.274   0.188
  161   HD12  ILE  23          2HD1      ILE  23  -5.484   0.050  -0.229
  162   HD13  ILE  23          1HD1      ILE  23  -5.904   1.761  -0.313
  163    H    GLU  24           H        GLU  24  -5.263  -1.633  -5.061
  164    HA   GLU  24           HA       GLU  24  -2.764  -2.535  -4.249
  165    HB2  GLU  24           HB2      GLU  24  -4.448  -4.116  -4.866
  166    HB3  GLU  24           HB3      GLU  24  -4.557  -3.464  -6.496
  167    HG2  GLU  24           HG2      GLU  24  -2.272  -4.250  -6.935
  168    HG3  GLU  24           HG3      GLU  24  -2.216  -4.941  -5.315
  169    H    SER  25           H        SER  25  -3.737  -1.429  -7.511
  170    HA   SER  25           HA       SER  25  -1.051  -1.549  -8.457
  171    HB2  SER  25           HB2      SER  25  -1.967  -0.134 -10.363
  172    HB3  SER  25           HB3      SER  25  -2.651  -1.754 -10.159
  173    HG   SER  25           HG       SER  25  -4.501  -0.903  -9.381
  174    H    SER  26           H        SER  26  -3.022   0.989  -7.024
  175    HA   SER  26           HA       SER  26  -1.491   3.209  -7.696
  176    HB2  SER  26           HB2      SER  26  -2.923   2.648  -5.084
  177    HB3  SER  26           HB3      SER  26  -2.329   4.229  -5.590
  178    HG   SER  26           HG       SER  26  -4.206   2.674  -7.061
  179    H    VAL  27           H        VAL  27  -1.009   0.805  -5.177
  180    HA   VAL  27           HA       VAL  27   1.468   1.997  -4.297
  181    HB   VAL  27           HB       VAL  27   0.330  -0.739  -3.688
  182   HG11  VAL  27          2HG1      VAL  27   2.522   0.839  -2.351
  183   HG12  VAL  27          1HG1      VAL  27   2.719  -0.639  -3.294
  184   HG13  VAL  27          3HG1      VAL  27   1.851  -0.681  -1.759
  185   HG21  VAL  27          3HG2      VAL  27  -1.180   1.018  -2.954
  186   HG22  VAL  27          2HG2      VAL  27   0.147   1.839  -2.131
  187   HG23  VAL  27          1HG2      VAL  27  -0.399   0.261  -1.567
  188    H    LYS  28           H        LYS  28   0.461  -0.759  -6.273
  189    HA   LYS  28           HA       LYS  28   3.015  -1.956  -6.427
  190    HB2  LYS  28           HB2      LYS  28   0.805  -3.092  -6.756
  191    HB3  LYS  28           HB3      LYS  28   0.725  -2.346  -8.346
  192    HG2  LYS  28           HG2      LYS  28   2.707  -3.523  -9.046
  193    HG3  LYS  28           HG3      LYS  28   2.916  -4.190  -7.425
  194    HD2  LYS  28           HD2      LYS  28   0.750  -5.332  -7.640
  195    HD3  LYS  28           HD3      LYS  28   0.597  -4.713  -9.284
  196    HE2  LYS  28           HE2      LYS  28   2.815  -6.494  -8.289
  197    HE3  LYS  28           HE3      LYS  28   1.413  -7.031  -9.210
  198    HZ1  LYS  28           HZ1      LYS  28   3.424  -5.068 -10.180
  199    HZ2  LYS  28           HZ2      LYS  28   2.119  -5.695 -11.061
  200    HZ3  LYS  28           HZ3      LYS  28   3.392  -6.713 -10.593
  201    H    GLU  29           H        GLU  29   1.428   0.436  -8.480
  202    HA   GLU  29           HA       GLU  29   3.188   0.184 -10.696
  203    HB2  GLU  29           HB2      GLU  29   1.530   2.523  -9.745
  204    HB3  GLU  29           HB3      GLU  29   2.453   2.531 -11.239
  205    HG2  GLU  29           HG2      GLU  29   1.116   0.446 -11.864
  206    HG3  GLU  29           HG3      GLU  29   0.050   0.894 -10.533
  207    H    LEU  30           H        LEU  30   3.423   1.672  -7.629
  208    HA   LEU  30           HA       LEU  30   5.341   3.661  -8.201
  209    HB2  LEU  30           HB2      LEU  30   4.936   2.194  -5.596
  210    HB3  LEU  30           HB3      LEU  30   5.791   3.710  -5.799
  211    HG   LEU  30           HG       LEU  30   2.836   3.221  -6.135
  212   HD11  LEU  30          2HD1      LEU  30   2.636   4.835  -4.320
  213   HD12  LEU  30          1HD1      LEU  30   4.392   4.969  -4.238
  214   HD13  LEU  30          3HD1      LEU  30   3.604   3.442  -3.839
  215   HD21  LEU  30          3HD2      LEU  30   4.439   5.702  -6.746
  216   HD22  LEU  30          2HD2      LEU  30   2.680   5.644  -6.628
  217   HD23  LEU  30          1HD2      LEU  30   3.509   4.730  -7.888
  218    H    ASN  31           H        ASN  31   7.473   3.667  -8.410
  219    HA   ASN  31           HA       ASN  31   8.885   1.269  -8.935
  220    HB2  ASN  31           HB2      ASN  31   9.357   3.535  -9.934
  221    HB3  ASN  31           HB3      ASN  31  10.046   4.008  -8.383
  222   HD21  ASN  31          1HD2      ASN  31  10.357   0.847  -9.907
  223   HD22  ASN  31          2HD2      ASN  31  12.069   0.949 -10.168
  224    H    GLY  32           H        GLY  32   9.573  -0.134  -7.448
  225    HA2  GLY  32           HA1      GLY  32  11.284  -0.425  -5.686
  226    HA3  GLY  32           HA2      GLY  32  10.535   0.942  -4.870
  227    H    VAL  33           H        VAL  33   8.015  -0.627  -6.165
  228    HA   VAL  33           HA       VAL  33   7.468  -1.969  -3.649
  229    HB   VAL  33           HB       VAL  33   5.638  -1.180  -5.916
  230   HG11  VAL  33          2HG1      VAL  33   4.846  -3.260  -4.928
  231   HG12  VAL  33          1HG1      VAL  33   3.800  -1.920  -4.455
  232   HG13  VAL  33          3HG1      VAL  33   4.982  -2.562  -3.315
  233   HG21  VAL  33          3HG2      VAL  33   5.918  -0.210  -3.079
  234   HG22  VAL  33          2HG2      VAL  33   4.713   0.351  -4.238
  235   HG23  VAL  33          1HG2      VAL  33   6.426   0.657  -4.528
  236    H    GLU  34           H        GLU  34   7.854  -3.980  -3.492
  237    HA   GLU  34           HA       GLU  34   8.316  -5.674  -5.763
  238    HB2  GLU  34           HB2      GLU  34   9.755  -6.028  -3.951
  239    HB3  GLU  34           HB3      GLU  34   8.446  -5.963  -2.785
  240    HG2  GLU  34           HG2      GLU  34   9.337  -8.211  -2.995
  241    HG3  GLU  34           HG3      GLU  34   7.662  -8.144  -3.539
  242    H    GLN  35           H        GLN  35   6.042  -5.767  -3.014
  243    HA   GLN  35           HA       GLN  35   3.959  -6.750  -4.773
  244    HB2  GLN  35           HB2      GLN  35   3.415  -8.662  -3.278
  245    HB3  GLN  35           HB3      GLN  35   4.958  -8.845  -4.105
  246    HG2  GLN  35           HG2      GLN  35   6.181  -8.422  -2.164
  247    HG3  GLN  35           HG3      GLN  35   4.791  -7.721  -1.338
  248   HE21  GLN  35          1HE2      GLN  35   5.028  -9.094   0.427
  249   HE22  GLN  35          2HE2      GLN  35   4.600 -10.772   0.345
  250    H    VAL  36           H        VAL  36   1.853  -6.652  -3.808
  251    HA   VAL  36           HA       VAL  36   1.633  -5.304  -1.242
  252    HB   VAL  36           HB       VAL  36   1.873  -3.394  -2.658
  253   HG11  VAL  36          2HG1      VAL  36  -0.290  -4.547  -4.414
  254   HG12  VAL  36          1HG1      VAL  36   1.425  -4.460  -4.812
  255   HG13  VAL  36          3HG1      VAL  36   0.489  -2.978  -4.621
  256   HG21  VAL  36          3HG2      VAL  36  -1.050  -3.838  -2.084
  257   HG22  VAL  36          2HG2      VAL  36  -0.288  -2.278  -2.395
  258   HG23  VAL  36          1HG2      VAL  36   0.150  -3.203  -0.958
  259    H    LYS  37           H        LYS  37   0.133  -6.408  -0.174
  260    HA   LYS  37           HA       LYS  37  -2.066  -7.631  -1.704
  261    HB2  LYS  37           HB2      LYS  37  -0.942  -8.362   1.004
  262    HB3  LYS  37           HB3      LYS  37  -2.338  -9.130   0.262
  263    HG2  LYS  37           HG2      LYS  37  -0.919  -9.889  -1.591
  264    HG3  LYS  37           HG3      LYS  37   0.479  -9.152  -0.806
  265    HD2  LYS  37           HD2      LYS  37   0.405 -11.535  -0.340
  266    HD3  LYS  37           HD3      LYS  37   0.139 -10.614   1.139
  267    HE2  LYS  37           HE2      LYS  37  -1.401 -12.477   1.047
  268    HE3  LYS  37           HE3      LYS  37  -2.288 -10.960   0.893
  269    HZ1  LYS  37           HZ1      LYS  37  -2.451 -11.302  -1.475
  270    HZ2  LYS  37           HZ2      LYS  37  -3.048 -12.672  -0.673
  271    HZ3  LYS  37           HZ3      LYS  37  -1.506 -12.710  -1.381
  272    H    VAL  38           H        VAL  38  -3.766  -6.292  -1.684
  273    HA   VAL  38           HA       VAL  38  -4.392  -4.708   0.660
  274    HB   VAL  38           HB       VAL  38  -5.952  -5.035  -1.908
  275   HG11  VAL  38          2HG1      VAL  38  -7.074  -2.972  -1.251
  276   HG12  VAL  38          1HG1      VAL  38  -6.144  -2.931   0.247
  277   HG13  VAL  38          3HG1      VAL  38  -7.307  -4.226  -0.034
  278   HG21  VAL  38          3HG2      VAL  38  -3.967  -2.917  -1.093
  279   HG22  VAL  38          2HG2      VAL  38  -4.954  -2.888  -2.555
  280   HG23  VAL  38          1HG2      VAL  38  -3.734  -4.144  -2.338
  281    H    GLN  39           H        GLN  39  -5.458  -5.554   2.313
  282    HA   GLN  39           HA       GLN  39  -7.169  -7.894   1.873
  283    HB2  GLN  39           HB2      GLN  39  -6.046  -6.758   4.444
  284    HB3  GLN  39           HB3      GLN  39  -6.990  -8.235   4.303
  285    HG2  GLN  39           HG2      GLN  39  -4.325  -7.786   2.983
  286    HG3  GLN  39           HG3      GLN  39  -4.554  -8.610   4.525
  287   HE21  GLN  39          1HE2      GLN  39  -5.553 -10.626   4.560
  288   HE22  GLN  39          2HE2      GLN  39  -5.689 -11.601   3.135
  289    H    LEU  40           H        LEU  40  -9.161  -7.230   1.368
  290    HA   LEU  40           HA       LEU  40 -10.288  -4.777   2.235
  291    HB2  LEU  40           HB2      LEU  40 -10.825  -6.293   0.177
  292    HB3  LEU  40           HB3      LEU  40 -11.922  -7.103   1.273
  293    HG   LEU  40           HG       LEU  40 -13.028  -5.422  -0.171
  294   HD11  LEU  40          2HD1      LEU  40 -13.082  -4.757   2.765
  295   HD12  LEU  40          1HD1      LEU  40 -14.040  -6.002   1.961
  296   HD13  LEU  40          3HD1      LEU  40 -14.304  -4.300   1.578
  297   HD21  LEU  40          3HD2      LEU  40 -12.669  -3.052   0.246
  298   HD22  LEU  40          2HD2      LEU  40 -11.193  -3.832  -0.324
  299   HD23  LEU  40          1HD2      LEU  40 -11.380  -3.440   1.386
  300    H    ALA  41           H        ALA  41 -10.802  -8.147   3.220
  301    HA   ALA  41           HA       ALA  41 -12.918  -7.695   4.999
  302    HB1  ALA  41           HB1      ALA  41 -10.843  -9.876   5.060
  303    HB2  ALA  41           HB2      ALA  41 -12.390  -9.900   5.908
  304    HB3  ALA  41           HB3      ALA  41 -12.350  -9.898   4.145
  305    H    GLU  42           H        GLU  42  -9.469  -7.329   5.452
  306    HA   GLU  42           HA       GLU  42  -9.813  -7.079   8.338
  307    HB2  GLU  42           HB2      GLU  42  -7.880  -8.360   7.333
  308    HB3  GLU  42           HB3      GLU  42  -7.246  -6.826   6.774
  309    HG2  GLU  42           HG2      GLU  42  -6.957  -6.049   9.006
  310    HG3  GLU  42           HG3      GLU  42  -7.817  -7.445   9.658
  311    H    GLY  43           H        GLY  43  -9.309  -5.116   5.502
  312    HA2  GLY  43           HA1      GLY  43  -9.461  -2.795   5.330
  313    HA3  GLY  43           HA2      GLY  43  -9.579  -2.703   7.081
  314    H    THR  44           H        THR  44  -7.099  -4.364   5.228
  315    HA   THR  44           HA       THR  44  -5.136  -2.355   6.069
  316    HB   THR  44           HB       THR  44  -3.588  -4.083   6.858
  317    HG1  THR  44           HG1      THR  44  -4.833  -6.240   7.233
  318   HG21  THR  44          3HG2      THR  44  -5.196  -3.066   8.473
  319   HG22  THR  44          1HG2      THR  44  -4.657  -4.684   8.929
  320   HG23  THR  44          2HG2      THR  44  -6.256  -4.457   8.219
  321    H    VAL  45           H        VAL  45  -3.074  -2.592   4.952
  322    HA   VAL  45           HA       VAL  45  -3.161  -4.243   2.527
  323    HB   VAL  45           HB       VAL  45  -2.240  -1.357   2.654
  324   HG11  VAL  45          2HG1      VAL  45  -2.171  -3.326   0.362
  325   HG12  VAL  45          1HG1      VAL  45  -0.774  -2.705   1.242
  326   HG13  VAL  45          3HG1      VAL  45  -1.757  -1.615   0.262
  327   HG21  VAL  45          3HG2      VAL  45  -4.658  -1.563   2.502
  328   HG22  VAL  45          2HG2      VAL  45  -4.500  -2.667   1.135
  329   HG23  VAL  45          1HG2      VAL  45  -3.998  -0.984   0.972
  330    H    GLU  46           H        GLU  46  -1.523  -5.611   2.613
  331    HA   GLU  46           HA       GLU  46   0.806  -4.949   4.251
  332    HB2  GLU  46           HB2      GLU  46   0.188  -7.565   2.876
  333    HB3  GLU  46           HB3      GLU  46   1.361  -7.282   4.158
  334    HG2  GLU  46           HG2      GLU  46  -0.649  -6.556   5.565
  335    HG3  GLU  46           HG3      GLU  46  -1.626  -7.341   4.326
  336    H    VAL  47           H        VAL  47   2.354  -3.888   3.231
  337    HA   VAL  47           HA       VAL  47   2.786  -4.486   0.378
  338    HB   VAL  47           HB       VAL  47   3.645  -1.948   1.749
  339   HG11  VAL  47          2HG1      VAL  47   3.157  -2.642  -1.140
  340   HG12  VAL  47          1HG1      VAL  47   4.728  -2.469  -0.358
  341   HG13  VAL  47          3HG1      VAL  47   3.669  -1.069  -0.530
  342   HG21  VAL  47          3HG2      VAL  47   1.055  -2.405   0.275
  343   HG22  VAL  47          2HG2      VAL  47   1.648  -0.859   0.884
  344   HG23  VAL  47          1HG2      VAL  47   1.222  -2.147   2.013
  345    H    THR  48           H        THR  48   4.736  -5.106  -0.294
  346    HA   THR  48           HA       THR  48   6.961  -5.032   1.636
  347    HB   THR  48           HB       THR  48   6.659  -6.852  -0.764
  348    HG1  THR  48           HG1      THR  48   5.595  -6.993   1.748
  349   HG21  THR  48          3HG2      THR  48   8.593  -6.872   1.556
  350   HG22  THR  48          1HG2      THR  48   8.973  -6.500  -0.127
  351   HG23  THR  48          2HG2      THR  48   8.471  -8.128   0.324
  352    H    ILE  49           H        ILE  49   8.040  -3.195   1.202
  353    HA   ILE  49           HA       ILE  49   8.494  -2.478  -1.628
  354    HB   ILE  49           HB       ILE  49   8.731  -0.134  -0.836
  355   HG12  ILE  49          2HG1      ILE  49   7.528  -1.128   1.753
  356   HG13  ILE  49          3HG1      ILE  49   9.246  -0.811   1.552
  357   HG21  ILE  49          2HG2      ILE  49   6.666  -0.842  -1.829
  358   HG22  ILE  49          1HG2      ILE  49   6.316   0.248  -0.485
  359   HG23  ILE  49          3HG2      ILE  49   6.105  -1.492  -0.289
  360   HD11  ILE  49          3HD1      ILE  49   8.729   1.531   1.023
  361   HD12  ILE  49          2HD1      ILE  49   8.175   1.054   2.628
  362   HD13  ILE  49          1HD1      ILE  49   7.020   1.195   1.301
  363    H    ASP  50           H        ASP  50  10.504  -1.836  -2.281
  364    HA   ASP  50           HA       ASP  50  12.770  -2.358  -0.600
  365    HB2  ASP  50           HB2      ASP  50  12.920  -2.620  -3.057
  366    HB3  ASP  50           HB3      ASP  50  12.606  -0.898  -3.252
  367    H    SER  51           H        SER  51  12.912  -1.092   1.133
  368    HA   SER  51           HA       SER  51  11.950   1.603   1.132
  369    HB2  SER  51           HB2      SER  51  12.683   1.581   3.511
  370    HB3  SER  51           HB3      SER  51  11.637   0.228   3.093
  371    HG   SER  51           HG       SER  51  13.606  -1.022   2.817
  372    H    SER  52           H        SER  52  14.628   0.460  -0.207
  373    HA   SER  52           HA       SER  52  16.431   2.571   0.662
  374    HB2  SER  52           HB2      SER  52  16.817   0.617  -1.611
  375    HB3  SER  52           HB3      SER  52  18.060   1.540  -0.765
  376    HG   SER  52           HG       SER  52  16.544  -0.658   0.152
  377    H    VAL  53           H        VAL  53  13.959   2.068  -1.574
  378    HA   VAL  53           HA       VAL  53  14.887   4.296  -3.266
  379    HB   VAL  53           HB       VAL  53  13.135   1.959  -4.055
  380   HG11  VAL  53          2HG1      VAL  53  14.135   4.284  -5.697
  381   HG12  VAL  53          1HG1      VAL  53  12.465   3.995  -5.206
  382   HG13  VAL  53          3HG1      VAL  53  13.263   2.883  -6.320
  383   HG21  VAL  53          3HG2      VAL  53  15.518   1.408  -3.775
  384   HG22  VAL  53          2HG2      VAL  53  15.932   2.681  -4.924
  385   HG23  VAL  53          1HG2      VAL  53  14.993   1.285  -5.457
  386    H    VAL  54           H        VAL  54  11.818   2.617  -2.569
  387    HA   VAL  54           HA       VAL  54  10.504   5.232  -2.456
  388    HB   VAL  54           HB       VAL  54   9.548   3.530  -3.985
  389   HG11  VAL  54          2HG1      VAL  54   8.335   1.607  -3.071
  390   HG12  VAL  54          1HG1      VAL  54   8.959   1.987  -1.466
  391   HG13  VAL  54          3HG1      VAL  54  10.067   1.510  -2.753
  392   HG21  VAL  54          3HG2      VAL  54   7.757   4.269  -1.681
  393   HG22  VAL  54          2HG2      VAL  54   7.219   3.764  -3.283
  394   HG23  VAL  54          1HG2      VAL  54   8.118   5.269  -3.088
  395    H    THR  55           H        THR  55   9.420   5.919  -0.584
  396    HA   THR  55           HA       THR  55  10.152   4.425   1.824
  397    HB   THR  55           HB       THR  55   9.498   6.455   3.076
  398    HG1  THR  55           HG1      THR  55   8.941   7.458   0.454
  399   HG21  THR  55          3HG2      THR  55  11.809   6.200   2.374
  400   HG22  THR  55          1HG2      THR  55  11.334   7.897   2.295
  401   HG23  THR  55          2HG2      THR  55  11.438   6.941   0.817
  402    H    LEU  56           H        LEU  56   8.553   4.392   3.620
  403    HA   LEU  56           HA       LEU  56   6.105   3.218   2.825
  404    HB2  LEU  56           HB2      LEU  56   7.282   2.783   4.976
  405    HB3  LEU  56           HB3      LEU  56   6.879   4.400   5.503
  406    HG   LEU  56           HG       LEU  56   5.494   2.414   6.389
  407   HD11  LEU  56          2HD1      LEU  56   3.463   3.756   6.474
  408   HD12  LEU  56          1HD1      LEU  56   4.109   4.815   5.220
  409   HD13  LEU  56          3HD1      LEU  56   4.899   4.728   6.795
  410   HD21  LEU  56          3HD2      LEU  56   3.562   1.812   5.009
  411   HD22  LEU  56          2HD2      LEU  56   5.083   1.319   4.265
  412   HD23  LEU  56          1HD2      LEU  56   4.233   2.746   3.672
  413    H    LYS  57           H        LYS  57   7.097   6.467   3.594
  414    HA   LYS  57           HA       LYS  57   4.556   7.614   3.946
  415    HB2  LYS  57           HB2      LYS  57   7.220   8.535   3.892
  416    HB3  LYS  57           HB3      LYS  57   6.317   9.498   2.724
  417    HG2  LYS  57           HG2      LYS  57   5.571   9.050   5.596
  418    HG3  LYS  57           HG3      LYS  57   6.269  10.529   4.925
  419    HD2  LYS  57           HD2      LYS  57   4.271  10.739   3.463
  420    HD3  LYS  57           HD3      LYS  57   3.581   9.318   4.250
  421    HE2  LYS  57           HE2      LYS  57   3.803  10.547   6.429
  422    HE3  LYS  57           HE3      LYS  57   4.226  11.981   5.497
  423    HZ1  LYS  57           HZ1      LYS  57   1.663  10.500   5.496
  424    HZ2  LYS  57           HZ2      LYS  57   2.056  11.636   4.300
  425    HZ3  LYS  57           HZ3      LYS  57   1.933  12.118   5.921
  426    H    ASP  58           H        ASP  58   6.592   7.219   1.053
  427    HA   ASP  58           HA       ASP  58   4.991   8.559  -0.797
  428    HB2  ASP  58           HB2      ASP  58   6.723   6.105  -1.156
  429    HB3  ASP  58           HB3      ASP  58   5.942   6.936  -2.494
  430    H    ILE  59           H        ILE  59   4.885   5.215   0.304
  431    HA   ILE  59           HA       ILE  59   2.849   4.256  -1.341
  432    HB   ILE  59           HB       ILE  59   3.408   3.452   1.521
  433   HG12  ILE  59          2HG1      ILE  59   5.448   3.348   0.195
  434   HG13  ILE  59          3HG1      ILE  59   4.875   1.719   0.539
  435   HG21  ILE  59          2HG2      ILE  59   1.293   2.584   0.699
  436   HG22  ILE  59          1HG2      ILE  59   2.473   1.285   0.869
  437   HG23  ILE  59          3HG2      ILE  59   2.097   1.931  -0.728
  438   HD11  ILE  59          3HD1      ILE  59   4.526   3.210  -2.055
  439   HD12  ILE  59          2HD1      ILE  59   3.936   1.583  -1.713
  440   HD13  ILE  59          1HD1      ILE  59   5.669   1.904  -1.742
  441    H    VAL  60           H        VAL  60   2.615   5.503   1.990
  442    HA   VAL  60           HA       VAL  60  -0.196   5.386   2.141
  443    HB   VAL  60           HB       VAL  60   1.675   7.191   3.689
  444   HG11  VAL  60          2HG1      VAL  60  -0.081   7.209   5.391
  445   HG12  VAL  60          1HG1      VAL  60  -1.119   6.255   4.333
  446   HG13  VAL  60          3HG1      VAL  60  -0.654   7.892   3.870
  447   HG21  VAL  60          3HG2      VAL  60   1.627   5.443   5.401
  448   HG22  VAL  60          2HG2      VAL  60   2.311   4.848   3.887
  449   HG23  VAL  60          1HG2      VAL  60   0.657   4.427   4.334
  450    H    ALA  61           H        ALA  61   2.009   7.986   1.200
  451    HA   ALA  61           HA       ALA  61   0.214  10.098   1.068
  452    HB1  ALA  61           HB1      ALA  61   1.795  11.144  -0.477
  453    HB2  ALA  61           HB2      ALA  61   2.620  10.390   0.888
  454    HB3  ALA  61           HB3      ALA  61   2.614   9.596  -0.685
  455    H    VAL  62           H        VAL  62   1.022   7.668  -1.390
  456    HA   VAL  62           HA       VAL  62  -0.719   8.778  -3.370
  457    HB   VAL  62           HB       VAL  62   0.503   6.014  -3.190
  458   HG11  VAL  62          2HG1      VAL  62  -0.038   5.799  -5.560
  459   HG12  VAL  62          1HG1      VAL  62  -0.836   7.372  -5.530
  460   HG13  VAL  62          3HG1      VAL  62  -1.501   6.029  -4.601
  461   HG21  VAL  62          3HG2      VAL  62   1.329   8.463  -4.748
  462   HG22  VAL  62          2HG2      VAL  62   2.084   6.875  -4.865
  463   HG23  VAL  62          1HG2      VAL  62   2.168   7.782  -3.356
  464    H    ILE  63           H        ILE  63  -0.949   6.067  -1.095
  465    HA   ILE  63           HA       ILE  63  -3.406   5.021  -1.836
  466    HB   ILE  63           HB       ILE  63  -2.112   5.197   0.881
  467   HG12  ILE  63          2HG1      ILE  63  -2.434   2.904  -1.066
  468   HG13  ILE  63          3HG1      ILE  63  -0.963   3.843  -0.833
  469   HG21  ILE  63          2HG2      ILE  63  -4.557   3.605   0.118
  470   HG22  ILE  63          1HG2      ILE  63  -4.525   5.003   1.190
  471   HG23  ILE  63          3HG2      ILE  63  -3.702   3.516   1.658
  472   HD11  ILE  63          3HD1      ILE  63  -0.819   3.046   1.467
  473   HD12  ILE  63          2HD1      ILE  63  -0.846   1.709   0.317
  474   HD13  ILE  63          1HD1      ILE  63  -2.296   2.112   1.237
  475    H    GLU  64           H        GLU  64  -2.763   7.571   0.569
  476    HA   GLU  64           HA       GLU  64  -5.462   7.879   1.328
  477    HB2  GLU  64           HB2      GLU  64  -3.176   9.844   1.542
  478    HB3  GLU  64           HB3      GLU  64  -4.725  10.001   2.358
  479    HG2  GLU  64           HG2      GLU  64  -4.274   7.879   3.546
  480    HG3  GLU  64           HG3      GLU  64  -2.688   7.825   2.779
  481    H    ASP  65           H        ASP  65  -3.563   9.299  -1.237
  482    HA   ASP  65           HA       ASP  65  -5.316  11.451  -1.828
  483    HB2  ASP  65           HB2      ASP  65  -2.945  11.344  -2.572
  484    HB3  ASP  65           HB3      ASP  65  -3.380  10.055  -3.689
  485    H    GLN  66           H        GLN  66  -5.350   8.086  -2.582
  486    HA   GLN  66           HA       GLN  66  -7.112   8.231  -4.827
  487    HB2  GLN  66           HB2      GLN  66  -6.456   5.928  -2.981
  488    HB3  GLN  66           HB3      GLN  66  -7.349   5.789  -4.489
  489    HG2  GLN  66           HG2      GLN  66  -4.495   6.705  -4.203
  490    HG3  GLN  66           HG3      GLN  66  -5.031   5.122  -4.769
  491   HE21  GLN  66          1HE2      GLN  66  -5.944   4.929  -6.808
  492   HE22  GLN  66          2HE2      GLN  66  -5.817   6.171  -8.003
  493    H    GLY  67           H        GLY  67  -7.555   8.601  -1.495
  494    HA2  GLY  67           HA1      GLY  67  -9.762   9.430  -0.813
  495    HA3  GLY  67           HA2      GLY  67 -10.460   8.164  -1.813
  496    H    TYR  68           H        TYR  68  -7.774   8.015   0.471
  497    HA   TYR  68           HA       TYR  68  -9.348   6.279   2.232
  498    HB2  TYR  68           HB2      TYR  68  -6.568   5.601   1.237
  499    HB3  TYR  68           HB3      TYR  68  -7.501   4.675   2.406
  500    HD1  TYR  68           HD2      TYR  68  -9.672   3.590   1.613
  501    HD2  TYR  68           HD1      TYR  68  -6.777   5.202  -1.054
  502    HE1  TYR  68           HE2      TYR  68 -10.622   2.253  -0.221
  503    HE2  TYR  68           HE1      TYR  68  -7.718   3.872  -2.893
  504    HH   TYR  68           HH       TYR  68  -9.047   1.810  -3.186
  505    H    ASP  69           H        ASP  69  -8.375   6.063   4.370
  506    HA   ASP  69           HA       ASP  69  -6.287   8.060   4.939
  507    HB2  ASP  69           HB2      ASP  69  -8.866   7.563   6.358
  508    HB3  ASP  69           HB3      ASP  69  -7.458   7.969   7.334
  509    H    VAL  70           H        VAL  70  -4.538   7.283   5.939
  510    HA   VAL  70           HA       VAL  70  -4.714   4.550   7.024
  511    HB   VAL  70           HB       VAL  70  -2.619   5.656   5.149
  512   HG11  VAL  70          2HG1      VAL  70  -1.446   3.525   5.398
  513   HG12  VAL  70          1HG1      VAL  70  -2.589   3.045   6.653
  514   HG13  VAL  70          3HG1      VAL  70  -1.507   4.411   6.922
  515   HG21  VAL  70          3HG2      VAL  70  -4.674   4.786   4.108
  516   HG22  VAL  70          2HG2      VAL  70  -4.430   3.248   4.941
  517   HG23  VAL  70          1HG2      VAL  70  -3.269   3.789   3.728
  518    H    GLN  71           H        GLN  71  -4.075   4.463   9.062
  519    HA   GLN  71           HA       GLN  71  -2.335   6.592  10.093
  520    HB2  GLN  71           HB2      GLN  71  -4.035   4.662  11.680
  521    HB3  GLN  71           HB3      GLN  71  -3.208   6.090  12.285
  522    HG2  GLN  71           HG2      GLN  71  -4.675   7.476  10.834
  523    HG3  GLN  71           HG3      GLN  71  -5.564   6.011  10.417
  524   HE21  GLN  71          1HE2      GLN  71  -7.484   6.633  11.325
  525   HE22  GLN  71          2HE2      GLN  71  -7.705   6.825  13.034
  Start of MODEL    7
    1    H1   SER   1           H1       SER   1  23.633  -2.099  -1.151
    2    H2   SER   1           H2       SER   1  22.266  -3.098  -1.106
    3    H3   SER   1           H3       SER   1  22.338  -1.717  -0.124
    4    HA   SER   1           HA       SER   1  22.339  -0.300  -2.064
    5    HB2  SER   1           HB2      SER   1  21.905  -2.866  -3.615
    6    HB3  SER   1           HB3      SER   1  22.004  -1.236  -4.279
    7    HG   SER   1           HG       SER   1  24.006  -2.969  -3.617
    8    H    ASN   2           H        ASN   2  20.424  -3.293  -1.819
    9    HA   ASN   2           HA       ASN   2  17.990  -1.625  -1.754
   10    HB2  ASN   2           HB2      ASN   2  18.420  -4.342  -3.010
   11    HB3  ASN   2           HB3      ASN   2  16.836  -3.611  -2.784
   12   HD21  ASN   2          1HD2      ASN   2  18.147  -4.411  -5.237
   13   HD22  ASN   2          2HD2      ASN   2  18.263  -2.986  -6.219
   14    H    ALA   3           H        ALA   3  16.172  -2.596  -0.536
   15    HA   ALA   3           HA       ALA   3  16.828  -4.743   1.315
   16    HB1  ALA   3           HB1      ALA   3  17.745  -2.799   2.470
   17    HB2  ALA   3           HB2      ALA   3  16.184  -1.985   2.354
   18    HB3  ALA   3           HB3      ALA   3  16.347  -3.446   3.328
   19    H    MET   4           H        MET   4  15.105  -6.019   1.252
   20    HA   MET   4           HA       MET   4  12.507  -4.979   0.515
   21    HB2  MET   4           HB2      MET   4  13.294  -7.791   1.280
   22    HB3  MET   4           HB3      MET   4  11.762  -7.309   0.575
   23    HG2  MET   4           HG2      MET   4  14.469  -7.268  -0.725
   24    HG3  MET   4           HG3      MET   4  13.094  -8.295  -1.121
   25    HE1  MET   4           HE1      MET   4  10.581  -5.738  -2.684
   26    HE2  MET   4           HE2      MET   4  10.864  -7.417  -2.230
   27    HE3  MET   4           HE3      MET   4  10.673  -6.186  -0.980
   28    H    GLU   5           H        GLU   5  11.254  -4.063   1.961
   29    HA   GLU   5           HA       GLU   5  11.184  -5.154   4.703
   30    HB2  GLU   5           HB2      GLU   5  10.593  -2.360   3.709
   31    HB3  GLU   5           HB3      GLU   5  10.329  -2.900   5.360
   32    HG2  GLU   5           HG2      GLU   5  13.003  -2.911   3.985
   33    HG3  GLU   5           HG3      GLU   5  12.418  -1.605   5.012
   34    H    GLN   6           H        GLN   6   9.182  -5.609   5.599
   35    HA   GLN   6           HA       GLN   6   6.913  -5.485   3.723
   36    HB2  GLN   6           HB2      GLN   6   7.539  -7.577   5.808
   37    HB3  GLN   6           HB3      GLN   6   6.049  -7.513   4.880
   38    HG2  GLN   6           HG2      GLN   6   7.290  -7.829   2.819
   39    HG3  GLN   6           HG3      GLN   6   8.804  -7.836   3.720
   40   HE21  GLN   6          1HE2      GLN   6   9.326  -9.905   2.998
   41   HE22  GLN   6          2HE2      GLN   6   8.512 -11.315   3.591
   42    H    LEU   7           H        LEU   7   5.457  -4.037   4.352
   43    HA   LEU   7           HA       LEU   7   5.144  -3.545   7.243
   44    HB2  LEU   7           HB2      LEU   7   4.840  -1.650   4.917
   45    HB3  LEU   7           HB3      LEU   7   4.359  -1.259   6.557
   46    HG   LEU   7           HG       LEU   7   7.172  -1.896   5.656
   47   HD11  LEU   7          2HD1      LEU   7   5.918   0.719   6.481
   48   HD12  LEU   7          1HD1      LEU   7   6.376   0.265   4.840
   49   HD13  LEU   7          3HD1      LEU   7   7.616   0.462   6.078
   50   HD21  LEU   7          3HD2      LEU   7   6.776  -2.607   7.949
   51   HD22  LEU   7          2HD2      LEU   7   6.113  -1.021   8.340
   52   HD23  LEU   7          1HD2      LEU   7   7.815  -1.184   7.911
   53    H    THR   8           H        THR   8   2.971  -2.598   7.801
   54    HA   THR   8           HA       THR   8   0.827  -3.684   6.114
   55    HB   THR   8           HB       THR   8   0.926  -3.955   9.129
   56    HG1  THR   8           HG1      THR   8   1.818  -5.567   7.082
   57   HG21  THR   8          3HG2      THR   8  -1.347  -3.686   8.240
   58   HG22  THR   8          1HG2      THR   8  -1.086  -5.323   8.846
   59   HG23  THR   8          2HG2      THR   8  -1.063  -5.011   7.111
   60    H    LEU   9           H        LEU   9  -0.512  -2.102   5.586
   61    HA   LEU   9           HA       LEU   9  -0.814   0.164   7.446
   62    HB2  LEU   9           HB2      LEU   9  -1.528   1.465   5.403
   63    HB3  LEU   9           HB3      LEU   9   0.168   1.048   5.481
   64    HG   LEU   9           HG       LEU   9  -1.736  -0.663   3.911
   65   HD11  LEU   9          2HD1      LEU   9  -1.265   0.687   1.942
   66   HD12  LEU   9          1HD1      LEU   9  -0.350   1.827   2.927
   67   HD13  LEU   9          3HD1      LEU   9  -2.087   1.647   3.170
   68   HD21  LEU   9          3HD2      LEU   9   1.189   0.001   3.568
   69   HD22  LEU   9          2HD2      LEU   9   0.258  -1.164   2.626
   70   HD23  LEU   9          1HD2      LEU   9   0.563  -1.457   4.339
   71    H    GLN  10           H        GLN  10  -2.842   0.892   7.931
   72    HA   GLN  10           HA       GLN  10  -5.072  -0.868   7.419
   73    HB2  GLN  10           HB2      GLN  10  -6.377   0.855   8.664
   74    HB3  GLN  10           HB3      GLN  10  -4.972   0.276   9.549
   75    HG2  GLN  10           HG2      GLN  10  -3.794   2.252   9.218
   76    HG3  GLN  10           HG3      GLN  10  -4.849   2.771   7.903
   77   HE21  GLN  10          1HE2      GLN  10  -6.837   3.673   8.383
   78   HE22  GLN  10          2HE2      GLN  10  -7.249   4.241   9.967
   79    H    VAL  11           H        VAL  11  -6.805  -0.500   6.024
   80    HA   VAL  11           HA       VAL  11  -6.476   1.823   4.249
   81    HB   VAL  11           HB       VAL  11  -5.990  -0.019   2.869
   82   HG11  VAL  11          2HG1      VAL  11  -7.356  -2.033   2.699
   83   HG12  VAL  11          1HG1      VAL  11  -8.430  -1.415   3.954
   84   HG13  VAL  11          3HG1      VAL  11  -6.751  -1.805   4.346
   85   HG21  VAL  11          3HG2      VAL  11  -7.806  -0.071   1.249
   86   HG22  VAL  11          2HG2      VAL  11  -7.554   1.564   1.862
   87   HG23  VAL  11          1HG2      VAL  11  -8.910   0.599   2.450
   88    H    GLU  12           H        GLU  12  -7.871   3.251   5.048
   89    HA   GLU  12           HA       GLU  12 -10.664   2.452   5.436
   90    HB2  GLU  12           HB2      GLU  12  -9.197   5.027   6.040
   91    HB3  GLU  12           HB3      GLU  12 -10.926   4.805   6.276
   92    HG2  GLU  12           HG2      GLU  12  -8.817   3.130   7.617
   93    HG3  GLU  12           HG3      GLU  12  -9.550   4.563   8.336
   94    H    GLY  13           H        GLY  13 -12.145   2.826   3.919
   95    HA2  GLY  13           HA1      GLY  13 -12.999   4.622   2.361
   96    HA3  GLY  13           HA2      GLY  13 -11.386   4.581   1.662
   97    H    MET  14           H        MET  14 -12.280   1.519   2.645
   98    HA   MET  14           HA       MET  14 -12.455   0.512  -0.001
   99    HB2  MET  14           HB2      MET  14 -13.154  -0.786   2.639
  100    HB3  MET  14           HB3      MET  14 -13.040  -1.636   1.105
  101    HG2  MET  14           HG2      MET  14 -10.681  -1.048   0.944
  102    HG3  MET  14           HG3      MET  14 -10.791  -0.176   2.472
  103    HE1  MET  14           HE1      MET  14 -11.396  -1.367   4.786
  104    HE2  MET  14           HE2      MET  14 -12.798  -2.147   4.056
  105    HE3  MET  14           HE3      MET  14 -11.626  -3.106   4.960
  106    H    SER  15           H        SER  15 -14.277  -0.677  -0.916
  107    HA   SER  15           HA       SER  15 -16.914   0.045   0.074
  108    HB2  SER  15           HB2      SER  15 -16.204   1.932  -1.385
  109    HB3  SER  15           HB3      SER  15 -16.007   0.795  -2.718
  110    HG   SER  15           HG       SER  15 -18.019   1.501  -3.019
  111    H    CYS  16           H        CYS  16 -15.685  -1.065  -3.077
  112    HA   CYS  16           HA       CYS  16 -17.048  -3.636  -2.609
  113    HB2  CYS  16           HB2      CYS  16 -16.701  -2.194  -5.255
  114    HB3  CYS  16           HB3      CYS  16 -17.529  -3.729  -5.007
  115    HG   CYS  16           HG       CYS  16 -18.802  -1.342  -3.084
  116    H    GLY  17           H        GLY  17 -16.047  -5.074  -4.734
  117    HA2  GLY  17           HA1      GLY  17 -13.467  -5.744  -3.779
  118    HA3  GLY  17           HA2      GLY  17 -14.213  -6.366  -5.243
  119    H    HIS  18           H        HIS  18 -14.477  -3.434  -6.113
  120    HA   HIS  18           HA       HIS  18 -12.103  -3.453  -7.691
  121    HB2  HIS  18           HB2      HIS  18 -14.321  -2.646  -8.509
  122    HB3  HIS  18           HB3      HIS  18 -14.158  -1.249  -7.452
  123    HD1  HIS  18           HD1      HIS  18 -13.777   0.654  -9.002
  124    HD2  HIS  18           HD2      HIS  18 -11.466  -2.663  -9.997
  125    HE1  HIS  18           HE1      HIS  18 -12.284   1.402 -10.890
  126    HE2  HIS  18           HE2      HIS  18 -10.988  -0.655 -11.564
  127    H    CYS  19           H        CYS  19 -13.039  -1.853  -4.725
  128    HA   CYS  19           HA       CYS  19 -11.147   0.251  -4.836
  129    HB2  CYS  19           HB2      CYS  19 -11.570   0.592  -2.500
  130    HB3  CYS  19           HB3      CYS  19 -13.098   0.157  -3.255
  131    HG   CYS  19           HG       CYS  19 -13.010  -2.508  -2.343
  132    H    VAL  20           H        VAL  20 -10.952  -3.104  -4.011
  133    HA   VAL  20           HA       VAL  20  -8.508  -3.198  -2.665
  134    HB   VAL  20           HB       VAL  20  -9.619  -5.212  -4.635
  135   HG11  VAL  20          2HG1      VAL  20  -7.512  -5.525  -2.496
  136   HG12  VAL  20          1HG1      VAL  20  -7.246  -5.568  -4.239
  137   HG13  VAL  20          3HG1      VAL  20  -8.195  -6.835  -3.461
  138   HG21  VAL  20          3HG2      VAL  20 -10.474  -6.367  -2.649
  139   HG22  VAL  20          2HG2      VAL  20 -11.168  -4.756  -2.814
  140   HG23  VAL  20          1HG2      VAL  20  -9.891  -5.048  -1.633
  141    H    ASN  21           H        ASN  21  -9.175  -3.554  -6.146
  142    HA   ASN  21           HA       ASN  21  -6.532  -3.603  -7.039
  143    HB2  ASN  21           HB2      ASN  21  -8.281  -4.211  -8.564
  144    HB3  ASN  21           HB3      ASN  21  -9.059  -2.641  -8.395
  145   HD21  ASN  21          1HD2      ASN  21  -8.261  -0.883  -9.524
  146   HD22  ASN  21          2HD2      ASN  21  -7.057  -1.032 -10.761
  147    H    ALA  22           H        ALA  22  -8.705  -0.893  -6.441
  148    HA   ALA  22           HA       ALA  22  -7.230   1.182  -7.510
  149    HB1  ALA  22           HB1      ALA  22  -8.425   2.652  -6.000
  150    HB2  ALA  22           HB2      ALA  22  -9.507   1.415  -6.644
  151    HB3  ALA  22           HB3      ALA  22  -8.889   1.274  -5.000
  152    H    ILE  23           H        ILE  23  -7.178   0.193  -4.056
  153    HA   ILE  23           HA       ILE  23  -4.908   1.847  -3.557
  154    HB   ILE  23           HB       ILE  23  -6.418   1.396  -1.723
  155   HG12  ILE  23          2HG1      ILE  23  -3.718   0.116  -1.245
  156   HG13  ILE  23          3HG1      ILE  23  -4.032   1.847  -1.256
  157   HG21  ILE  23          2HG2      ILE  23  -5.584  -1.490  -1.987
  158   HG22  ILE  23          1HG2      ILE  23  -7.192  -0.822  -2.272
  159   HG23  ILE  23          3HG2      ILE  23  -6.511  -0.821  -0.642
  160   HD11  ILE  23          3HD1      ILE  23  -5.220  -0.132   0.672
  161   HD12  ILE  23          2HD1      ILE  23  -5.473   1.612   0.681
  162   HD13  ILE  23          1HD1      ILE  23  -3.871   0.951   1.008
  163    H    GLU  24           H        GLU  24  -5.363  -1.539  -4.369
  164    HA   GLU  24           HA       GLU  24  -2.864  -2.585  -3.830
  165    HB2  GLU  24           HB2      GLU  24  -4.750  -3.913  -4.686
  166    HB3  GLU  24           HB3      GLU  24  -4.593  -3.133  -6.254
  167    HG2  GLU  24           HG2      GLU  24  -2.347  -4.096  -6.484
  168    HG3  GLU  24           HG3      GLU  24  -2.554  -4.909  -4.933
  169    H    SER  25           H        SER  25  -3.901  -1.049  -6.891
  170    HA   SER  25           HA       SER  25  -1.256  -1.051  -7.932
  171    HB2  SER  25           HB2      SER  25  -3.645   0.558  -8.835
  172    HB3  SER  25           HB3      SER  25  -2.135   0.343  -9.730
  173    HG   SER  25           HG       SER  25  -2.725  -2.051  -9.380
  174    H    SER  26           H        SER  26  -3.149   1.301  -6.115
  175    HA   SER  26           HA       SER  26  -1.600   3.568  -6.582
  176    HB2  SER  26           HB2      SER  26  -3.029   2.741  -4.042
  177    HB3  SER  26           HB3      SER  26  -2.385   4.354  -4.353
  178    HG   SER  26           HG       SER  26  -4.417   3.004  -5.817
  179    H    VAL  27           H        VAL  27  -1.061   0.856  -4.404
  180    HA   VAL  27           HA       VAL  27   1.466   1.934  -3.489
  181    HB   VAL  27           HB       VAL  27   0.505  -0.912  -3.197
  182   HG11  VAL  27          2HG1      VAL  27   2.863  -0.506  -2.707
  183   HG12  VAL  27          1HG1      VAL  27   1.966  -0.930  -1.248
  184   HG13  VAL  27          3HG1      VAL  27   2.407   0.750  -1.555
  185   HG21  VAL  27          3HG2      VAL  27  -1.228   0.580  -2.341
  186   HG22  VAL  27          2HG2      VAL  27  -0.031   1.406  -1.346
  187   HG23  VAL  27          1HG2      VAL  27  -0.426  -0.284  -1.030
  188    H    LYS  28           H        LYS  28   0.389  -0.752  -5.551
  189    HA   LYS  28           HA       LYS  28   2.865  -1.881  -6.096
  190    HB2  LYS  28           HB2      LYS  28   0.774  -3.013  -6.551
  191    HB3  LYS  28           HB3      LYS  28   0.353  -1.823  -7.770
  192    HG2  LYS  28           HG2      LYS  28   1.048  -3.683  -8.978
  193    HG3  LYS  28           HG3      LYS  28   2.432  -2.593  -9.014
  194    HD2  LYS  28           HD2      LYS  28   3.511  -3.864  -7.246
  195    HD3  LYS  28           HD3      LYS  28   2.100  -4.923  -7.125
  196    HE2  LYS  28           HE2      LYS  28   2.455  -5.541  -9.516
  197    HE3  LYS  28           HE3      LYS  28   3.956  -4.618  -9.485
  198    HZ1  LYS  28           HZ1      LYS  28   3.323  -7.009  -7.835
  199    HZ2  LYS  28           HZ2      LYS  28   4.733  -6.090  -7.692
  200    HZ3  LYS  28           HZ3      LYS  28   4.418  -6.937  -9.127
  201    H    GLU  29           H        GLU  29   1.191   0.708  -7.862
  202    HA   GLU  29           HA       GLU  29   2.875   0.742 -10.110
  203    HB2  GLU  29           HB2      GLU  29   1.119   2.838  -8.874
  204    HB3  GLU  29           HB3      GLU  29   2.047   3.141 -10.338
  205    HG2  GLU  29           HG2      GLU  29   0.147   0.858 -10.031
  206    HG3  GLU  29           HG3      GLU  29  -0.335   2.428 -10.680
  207    H    LEU  30           H        LEU  30   3.114   2.181  -6.970
  208    HA   LEU  30           HA       LEU  30   5.058   4.139  -7.387
  209    HB2  LEU  30           HB2      LEU  30   4.138   2.536  -5.068
  210    HB3  LEU  30           HB3      LEU  30   5.690   3.329  -4.902
  211    HG   LEU  30           HG       LEU  30   3.592   4.545  -4.035
  212   HD11  LEU  30          2HD1      LEU  30   5.465   5.965  -5.917
  213   HD12  LEU  30          1HD1      LEU  30   5.806   5.561  -4.235
  214   HD13  LEU  30          3HD1      LEU  30   4.523   6.707  -4.623
  215   HD21  LEU  30          3HD2      LEU  30   2.459   5.940  -5.705
  216   HD22  LEU  30          2HD2      LEU  30   2.184   4.221  -5.991
  217   HD23  LEU  30          1HD2      LEU  30   3.338   5.108  -6.987
  218    H    ASN  31           H        ASN  31   7.187   4.126  -7.770
  219    HA   ASN  31           HA       ASN  31   8.482   1.688  -8.474
  220    HB2  ASN  31           HB2      ASN  31   8.943   3.996  -9.454
  221    HB3  ASN  31           HB3      ASN  31   9.869   4.323  -7.994
  222   HD21  ASN  31          1HD2      ASN  31   9.749   2.633 -10.992
  223   HD22  ASN  31          2HD2      ASN  31  11.371   2.013 -10.953
  224    H    GLY  32           H        GLY  32   9.306   0.270  -7.129
  225    HA2  GLY  32           HA1      GLY  32  11.116  -0.085  -5.474
  226    HA3  GLY  32           HA2      GLY  32  10.405   1.240  -4.558
  227    H    VAL  33           H        VAL  33   7.759  -0.078  -5.676
  228    HA   VAL  33           HA       VAL  33   7.370  -1.774  -3.346
  229    HB   VAL  33           HB       VAL  33   5.432  -0.777  -5.438
  230   HG11  VAL  33          2HG1      VAL  33   3.670  -1.669  -3.973
  231   HG12  VAL  33          1HG1      VAL  33   4.907  -2.399  -2.951
  232   HG13  VAL  33          3HG1      VAL  33   4.704  -2.944  -4.614
  233   HG21  VAL  33          3HG2      VAL  33   6.275   0.932  -3.906
  234   HG22  VAL  33          2HG2      VAL  33   5.787  -0.062  -2.533
  235   HG23  VAL  33          1HG2      VAL  33   4.566   0.597  -3.622
  236    H    GLU  34           H        GLU  34   7.141  -3.930  -3.401
  237    HA   GLU  34           HA       GLU  34   7.652  -5.228  -5.978
  238    HB2  GLU  34           HB2      GLU  34   9.220  -5.761  -4.223
  239    HB3  GLU  34           HB3      GLU  34   7.915  -6.202  -3.133
  240    HG2  GLU  34           HG2      GLU  34   8.999  -8.166  -3.985
  241    HG3  GLU  34           HG3      GLU  34   7.342  -8.079  -4.577
  242    H    GLN  35           H        GLN  35   5.835  -6.160  -3.047
  243    HA   GLN  35           HA       GLN  35   3.639  -7.013  -4.790
  244    HB2  GLN  35           HB2      GLN  35   5.118  -8.622  -2.736
  245    HB3  GLN  35           HB3      GLN  35   3.439  -8.986  -3.112
  246    HG2  GLN  35           HG2      GLN  35   5.632  -8.849  -5.156
  247    HG3  GLN  35           HG3      GLN  35   5.101 -10.339  -4.373
  248   HE21  GLN  35          1HE2      GLN  35   3.093 -11.197  -4.876
  249   HE22  GLN  35          2HE2      GLN  35   2.191 -10.696  -6.262
  250    H    VAL  36           H        VAL  36   1.598  -6.949  -3.924
  251    HA   VAL  36           HA       VAL  36   1.320  -5.798  -1.243
  252    HB   VAL  36           HB       VAL  36  -0.461  -4.270  -2.109
  253   HG11  VAL  36          2HG1      VAL  36   1.772  -3.422  -1.647
  254   HG12  VAL  36          1HG1      VAL  36   1.082  -2.610  -3.055
  255   HG13  VAL  36          3HG1      VAL  36   2.293  -3.873  -3.270
  256   HG21  VAL  36          3HG2      VAL  36   0.647  -5.074  -4.800
  257   HG22  VAL  36          2HG2      VAL  36  -0.493  -3.759  -4.514
  258   HG23  VAL  36          1HG2      VAL  36  -0.971  -5.426  -4.193
  259    H    LYS  37           H        LYS  37  -0.363  -6.589  -0.098
  260    HA   LYS  37           HA       LYS  37  -2.363  -8.203  -1.536
  261    HB2  LYS  37           HB2      LYS  37  -1.246  -8.922   1.179
  262    HB3  LYS  37           HB3      LYS  37  -2.369  -9.862   0.207
  263    HG2  LYS  37           HG2      LYS  37  -0.491  -9.996  -1.520
  264    HG3  LYS  37           HG3      LYS  37   0.568  -9.424  -0.228
  265    HD2  LYS  37           HD2      LYS  37  -1.110 -11.932  -0.248
  266    HD3  LYS  37           HD3      LYS  37   0.651 -11.824  -0.276
  267    HE2  LYS  37           HE2      LYS  37  -1.004 -10.728   1.980
  268    HE3  LYS  37           HE3      LYS  37  -0.445 -12.397   1.945
  269    HZ1  LYS  37           HZ1      LYS  37   1.450 -10.140   1.659
  270    HZ2  LYS  37           HZ2      LYS  37   1.759 -11.743   2.123
  271    HZ3  LYS  37           HZ3      LYS  37   0.950 -10.698   3.184
  272    H    VAL  38           H        VAL  38  -3.939  -6.649  -1.450
  273    HA   VAL  38           HA       VAL  38  -4.641  -5.315   1.006
  274    HB   VAL  38           HB       VAL  38  -6.235  -5.533  -1.557
  275   HG11  VAL  38          2HG1      VAL  38  -7.587  -4.839   0.342
  276   HG12  VAL  38          1HG1      VAL  38  -7.344  -3.490  -0.768
  277   HG13  VAL  38          3HG1      VAL  38  -6.420  -3.576   0.732
  278   HG21  VAL  38          3HG2      VAL  38  -4.268  -3.415  -0.689
  279   HG22  VAL  38          2HG2      VAL  38  -5.292  -3.341  -2.124
  280   HG23  VAL  38          1HG2      VAL  38  -4.042  -4.578  -1.997
  281    H    GLN  39           H        GLN  39  -5.854  -6.156   2.588
  282    HA   GLN  39           HA       GLN  39  -7.478  -8.523   1.967
  283    HB2  GLN  39           HB2      GLN  39  -6.553  -7.554   4.679
  284    HB3  GLN  39           HB3      GLN  39  -7.368  -9.073   4.329
  285    HG2  GLN  39           HG2      GLN  39  -4.600  -8.254   3.485
  286    HG3  GLN  39           HG3      GLN  39  -5.042  -9.506   4.645
  287   HE21  GLN  39          1HE2      GLN  39  -3.461  -9.642   2.184
  288   HE22  GLN  39          2HE2      GLN  39  -4.221 -10.837   1.186
  289    H    LEU  40           H        LEU  40  -9.480  -7.980   1.503
  290    HA   LEU  40           HA       LEU  40 -10.677  -5.518   2.203
  291    HB2  LEU  40           HB2      LEU  40 -11.136  -7.177   0.247
  292    HB3  LEU  40           HB3      LEU  40 -12.233  -7.948   1.372
  293    HG   LEU  40           HG       LEU  40 -13.331  -6.379  -0.223
  294   HD11  LEU  40          2HD1      LEU  40 -14.449  -6.907   1.852
  295   HD12  LEU  40          1HD1      LEU  40 -14.707  -5.209   1.448
  296   HD13  LEU  40          3HD1      LEU  40 -13.538  -5.653   2.694
  297   HD21  LEU  40          3HD2      LEU  40 -13.083  -3.980   0.113
  298   HD22  LEU  40          2HD2      LEU  40 -11.552  -4.719  -0.356
  299   HD23  LEU  40          1HD2      LEU  40 -11.837  -4.271   1.325
  300    H    ALA  41           H        ALA  41 -10.916  -8.774   3.565
  301    HA   ALA  41           HA       ALA  41 -13.189  -8.250   5.188
  302    HB1  ALA  41           HB1      ALA  41 -12.691 -10.366   6.269
  303    HB2  ALA  41           HB2      ALA  41 -12.526 -10.519   4.520
  304    HB3  ALA  41           HB3      ALA  41 -11.089 -10.388   5.534
  305    H    GLU  42           H        GLU  42  -9.713  -8.120   5.770
  306    HA   GLU  42           HA       GLU  42 -10.130  -7.492   8.568
  307    HB2  GLU  42           HB2      GLU  42  -7.591  -7.739   6.949
  308    HB3  GLU  42           HB3      GLU  42  -7.656  -7.484   8.687
  309    HG2  GLU  42           HG2      GLU  42  -8.877  -9.602   8.934
  310    HG3  GLU  42           HG3      GLU  42  -8.741  -9.868   7.199
  311    H    GLY  43           H        GLY  43  -9.453  -5.833   5.594
  312    HA2  GLY  43           HA1      GLY  43  -9.660  -3.563   5.193
  313    HA3  GLY  43           HA2      GLY  43  -9.886  -3.305   6.916
  314    H    THR  44           H        THR  44  -7.178  -5.109   5.710
  315    HA   THR  44           HA       THR  44  -5.443  -2.770   6.064
  316    HB   THR  44           HB       THR  44  -3.761  -4.272   7.171
  317    HG1  THR  44           HG1      THR  44  -4.739  -6.226   8.132
  318   HG21  THR  44          3HG2      THR  44  -5.190  -2.761   8.496
  319   HG22  THR  44          1HG2      THR  44  -4.808  -4.246   9.372
  320   HG23  THR  44          2HG2      THR  44  -6.395  -4.044   8.630
  321    H    VAL  45           H        VAL  45  -3.284  -3.071   5.097
  322    HA   VAL  45           HA       VAL  45  -3.329  -4.959   2.832
  323    HB   VAL  45           HB       VAL  45  -2.293  -2.115   2.742
  324   HG11  VAL  45          2HG1      VAL  45  -2.059  -2.524   0.327
  325   HG12  VAL  45          1HG1      VAL  45  -2.537  -4.204   0.577
  326   HG13  VAL  45          3HG1      VAL  45  -1.040  -3.597   1.287
  327   HG21  VAL  45          3HG2      VAL  45  -4.729  -2.156   2.832
  328   HG22  VAL  45          2HG2      VAL  45  -4.771  -3.295   1.487
  329   HG23  VAL  45          1HG2      VAL  45  -4.167  -1.657   1.237
  330    H    GLU  46           H        GLU  46  -1.614  -6.274   2.823
  331    HA   GLU  46           HA       GLU  46   0.800  -5.519   4.296
  332    HB2  GLU  46           HB2      GLU  46   0.119  -8.079   2.838
  333    HB3  GLU  46           HB3      GLU  46   1.577  -7.807   3.781
  334    HG2  GLU  46           HG2      GLU  46  -0.001  -7.364   5.742
  335    HG3  GLU  46           HG3      GLU  46  -1.246  -8.094   4.725
  336    H    VAL  47           H        VAL  47   2.640  -4.842   3.314
  337    HA   VAL  47           HA       VAL  47   2.777  -5.078   0.385
  338    HB   VAL  47           HB       VAL  47   3.396  -2.540   1.908
  339   HG11  VAL  47          2HG1      VAL  47   3.697  -1.554  -0.311
  340   HG12  VAL  47          1HG1      VAL  47   3.436  -3.137  -1.043
  341   HG13  VAL  47          3HG1      VAL  47   4.841  -2.863  -0.014
  342   HG21  VAL  47          3HG2      VAL  47   0.991  -2.932   1.773
  343   HG22  VAL  47          2HG2      VAL  47   1.117  -3.152   0.027
  344   HG23  VAL  47          1HG2      VAL  47   1.471  -1.581   0.747
  345    H    THR  48           H        THR  48   4.659  -5.794  -0.323
  346    HA   THR  48           HA       THR  48   7.015  -5.687   1.419
  347    HB   THR  48           HB       THR  48   6.883  -7.064  -1.273
  348    HG1  THR  48           HG1      THR  48   6.463  -8.983   0.226
  349   HG21  THR  48          3HG2      THR  48   8.516  -7.539   1.226
  350   HG22  THR  48          1HG2      THR  48   9.088  -6.799  -0.268
  351   HG23  THR  48          2HG2      THR  48   8.608  -8.495  -0.252
  352    H    ILE  49           H        ILE  49   8.167  -3.852   1.181
  353    HA   ILE  49           HA       ILE  49   8.378  -2.676  -1.526
  354    HB   ILE  49           HB       ILE  49   8.808  -0.498  -0.450
  355   HG12  ILE  49          2HG1      ILE  49   8.011  -1.786   2.164
  356   HG13  ILE  49          3HG1      ILE  49   9.691  -1.568   1.689
  357   HG21  ILE  49          2HG2      ILE  49   6.237  -1.777   0.471
  358   HG22  ILE  49          1HG2      ILE  49   6.534  -1.056  -1.111
  359   HG23  ILE  49          3HG2      ILE  49   6.543  -0.045   0.334
  360   HD11  ILE  49          3HD1      ILE  49   8.996   0.201   3.172
  361   HD12  ILE  49          2HD1      ILE  49   7.659   0.616   2.097
  362   HD13  ILE  49          1HD1      ILE  49   9.327   0.853   1.568
  363    H    ASP  50           H        ASP  50  10.381  -1.455  -1.907
  364    HA   ASP  50           HA       ASP  50  12.668  -2.544  -0.423
  365    HB2  ASP  50           HB2      ASP  50  12.568  -2.603  -2.998
  366    HB3  ASP  50           HB3      ASP  50  12.827  -0.861  -2.921
  367    H    SER  51           H        SER  51  12.989  -1.320   1.326
  368    HA   SER  51           HA       SER  51  12.087   1.406   1.393
  369    HB2  SER  51           HB2      SER  51  11.778  -0.057   3.327
  370    HB3  SER  51           HB3      SER  51  13.524  -0.231   3.491
  371    HG   SER  51           HG       SER  51  13.238   2.300   3.511
  372    H    SER  52           H        SER  52  14.765   0.143   0.084
  373    HA   SER  52           HA       SER  52  16.515   2.342   0.903
  374    HB2  SER  52           HB2      SER  52  17.096  -0.001  -0.921
  375    HB3  SER  52           HB3      SER  52  18.272   1.159  -0.303
  376    HG   SER  52           HG       SER  52  16.801  -0.788   1.127
  377    H    VAL  53           H        VAL  53  14.116   1.791  -1.236
  378    HA   VAL  53           HA       VAL  53  15.255   3.621  -3.248
  379    HB   VAL  53           HB       VAL  53  13.204   1.435  -3.677
  380   HG11  VAL  53          2HG1      VAL  53  13.363   2.013  -6.054
  381   HG12  VAL  53          1HG1      VAL  53  14.447   3.349  -5.660
  382   HG13  VAL  53          3HG1      VAL  53  12.772   3.375  -5.102
  383   HG21  VAL  53          3HG2      VAL  53  16.046   1.660  -4.669
  384   HG22  VAL  53          2HG2      VAL  53  14.928   0.331  -4.978
  385   HG23  VAL  53          1HG2      VAL  53  15.513   0.632  -3.339
  386    H    VAL  54           H        VAL  54  12.073   2.404  -2.213
  387    HA   VAL  54           HA       VAL  54  11.017   5.125  -2.501
  388    HB   VAL  54           HB       VAL  54   9.920   3.235  -3.747
  389   HG11  VAL  54          2HG1      VAL  54   9.064   2.360  -0.992
  390   HG12  VAL  54          1HG1      VAL  54  10.144   1.488  -2.081
  391   HG13  VAL  54          3HG1      VAL  54   8.449   1.716  -2.515
  392   HG21  VAL  54          3HG2      VAL  54   7.615   3.907  -3.186
  393   HG22  VAL  54          2HG2      VAL  54   8.708   5.281  -3.356
  394   HG23  VAL  54          1HG2      VAL  54   8.227   4.730  -1.752
  395    H    THR  55           H        THR  55   9.656   5.981  -0.834
  396    HA   THR  55           HA       THR  55  10.267   4.920   1.829
  397    HB   THR  55           HB       THR  55   9.677   7.052   2.733
  398    HG1  THR  55           HG1      THR  55   9.048   8.336   0.352
  399   HG21  THR  55          3HG2      THR  55  11.895   7.012   1.711
  400   HG22  THR  55          1HG2      THR  55  11.168   8.610   1.551
  401   HG23  THR  55          2HG2      THR  55  11.206   7.517   0.167
  402    H    LEU  56           H        LEU  56   8.422   5.013   3.412
  403    HA   LEU  56           HA       LEU  56   6.097   3.826   2.236
  404    HB2  LEU  56           HB2      LEU  56   5.246   3.678   4.527
  405    HB3  LEU  56           HB3      LEU  56   6.865   3.031   4.386
  406    HG   LEU  56           HG       LEU  56   7.524   5.469   5.211
  407   HD11  LEU  56          2HD1      LEU  56   5.931   6.269   6.897
  408   HD12  LEU  56          1HD1      LEU  56   4.769   5.054   6.365
  409   HD13  LEU  56          3HD1      LEU  56   5.262   6.342   5.267
  410   HD21  LEU  56          3HD2      LEU  56   7.609   4.578   7.482
  411   HD22  LEU  56          2HD2      LEU  56   8.122   3.373   6.300
  412   HD23  LEU  56          1HD2      LEU  56   6.514   3.277   7.018
  413    H    LYS  57           H        LYS  57   7.047   6.986   3.295
  414    HA   LYS  57           HA       LYS  57   4.448   8.070   3.645
  415    HB2  LYS  57           HB2      LYS  57   6.874   8.932   4.348
  416    HB3  LYS  57           HB3      LYS  57   6.695   9.848   2.857
  417    HG2  LYS  57           HG2      LYS  57   4.660   9.859   5.068
  418    HG3  LYS  57           HG3      LYS  57   5.968  11.035   4.939
  419    HD2  LYS  57           HD2      LYS  57   5.114  11.777   2.790
  420    HD3  LYS  57           HD3      LYS  57   3.852  10.544   2.842
  421    HE2  LYS  57           HE2      LYS  57   4.160  12.735   4.888
  422    HE3  LYS  57           HE3      LYS  57   3.096  12.836   3.488
  423    HZ1  LYS  57           HZ1      LYS  57   1.956  12.127   5.535
  424    HZ2  LYS  57           HZ2      LYS  57   2.910  10.729   5.580
  425    HZ3  LYS  57           HZ3      LYS  57   1.835  10.985   4.293
  426    H    ASP  58           H        ASP  58   6.734   8.093   0.894
  427    HA   ASP  58           HA       ASP  58   5.243   9.693  -0.844
  428    HB2  ASP  58           HB2      ASP  58   7.159   7.428  -1.336
  429    HB3  ASP  58           HB3      ASP  58   6.333   8.213  -2.676
  430    H    ILE  59           H        ILE  59   5.172   6.187  -0.416
  431    HA   ILE  59           HA       ILE  59   3.179   5.587  -2.280
  432    HB   ILE  59           HB       ILE  59   3.670   4.160   0.338
  433   HG12  ILE  59          2HG1      ILE  59   4.954   3.668  -2.356
  434   HG13  ILE  59          3HG1      ILE  59   5.741   4.486  -1.010
  435   HG21  ILE  59          2HG2      ILE  59   2.817   2.198  -0.870
  436   HG22  ILE  59          1HG2      ILE  59   2.492   3.216  -2.274
  437   HG23  ILE  59          3HG2      ILE  59   1.615   3.485  -0.768
  438   HD11  ILE  59          3HD1      ILE  59   4.771   1.640  -1.029
  439   HD12  ILE  59          2HD1      ILE  59   5.548   2.456   0.329
  440   HD13  ILE  59          1HD1      ILE  59   6.446   2.177  -1.163
  441    H    VAL  60           H        VAL  60   2.897   6.075   1.235
  442    HA   VAL  60           HA       VAL  60   0.135   5.867   1.450
  443    HB   VAL  60           HB       VAL  60   2.121   7.428   3.098
  444   HG11  VAL  60          2HG1      VAL  60   0.376   7.589   4.824
  445   HG12  VAL  60          1HG1      VAL  60  -0.801   6.952   3.674
  446   HG13  VAL  60          3HG1      VAL  60  -0.028   8.511   3.374
  447   HG21  VAL  60          3HG2      VAL  60   1.774   5.610   4.702
  448   HG22  VAL  60          2HG2      VAL  60   2.357   5.006   3.153
  449   HG23  VAL  60          1HG2      VAL  60   0.654   4.838   3.580
  450    H    ALA  61           H        ALA  61   2.119   8.726   0.750
  451    HA   ALA  61           HA       ALA  61   0.116  10.661   0.806
  452    HB1  ALA  61           HB1      ALA  61   2.510  11.174   0.648
  453    HB2  ALA  61           HB2      ALA  61   2.520  10.580  -1.013
  454    HB3  ALA  61           HB3      ALA  61   1.574  12.008  -0.592
  455    H    VAL  62           H        VAL  62   1.200   8.586  -1.857
  456    HA   VAL  62           HA       VAL  62  -0.606   9.602  -3.790
  457    HB   VAL  62           HB       VAL  62   0.682   6.867  -3.646
  458   HG11  VAL  62          2HG1      VAL  62  -1.224   6.865  -5.162
  459   HG12  VAL  62          1HG1      VAL  62   0.284   6.773  -6.072
  460   HG13  VAL  62          3HG1      VAL  62  -0.597   8.298  -5.977
  461   HG21  VAL  62          3HG2      VAL  62   1.554   9.383  -5.067
  462   HG22  VAL  62          2HG2      VAL  62   2.334   7.806  -5.200
  463   HG23  VAL  62          1HG2      VAL  62   2.329   8.660  -3.657
  464    H    ILE  63           H        ILE  63  -0.790   6.898  -1.511
  465    HA   ILE  63           HA       ILE  63  -3.210   5.804  -2.449
  466    HB   ILE  63           HB       ILE  63  -2.161   5.712   0.384
  467   HG12  ILE  63          2HG1      ILE  63  -1.729   3.741  -1.868
  468   HG13  ILE  63          3HG1      ILE  63  -0.529   4.916  -1.334
  469   HG21  ILE  63          2HG2      ILE  63  -4.091   3.936  -1.104
  470   HG22  ILE  63          1HG2      ILE  63  -4.482   5.035   0.218
  471   HG23  ILE  63          3HG2      ILE  63  -3.465   3.626   0.515
  472   HD11  ILE  63          3HD1      ILE  63  -0.505   3.880   0.875
  473   HD12  ILE  63          2HD1      ILE  63  -0.086   2.730  -0.395
  474   HD13  ILE  63          1HD1      ILE  63  -1.695   2.698   0.329
  475    H    GLU  64           H        GLU  64  -2.589   8.149   0.168
  476    HA   GLU  64           HA       GLU  64  -5.327   8.350   0.906
  477    HB2  GLU  64           HB2      GLU  64  -3.081  10.306   1.418
  478    HB3  GLU  64           HB3      GLU  64  -4.652  10.306   2.212
  479    HG2  GLU  64           HG2      GLU  64  -4.109   7.988   3.039
  480    HG3  GLU  64           HG3      GLU  64  -2.468   8.260   2.453
  481    H    ASP  65           H        ASP  65  -3.384   9.859  -1.518
  482    HA   ASP  65           HA       ASP  65  -5.068  12.064  -2.107
  483    HB2  ASP  65           HB2      ASP  65  -2.762  11.989  -2.893
  484    HB3  ASP  65           HB3      ASP  65  -3.104  10.552  -3.849
  485    H    GLN  66           H        GLN  66  -5.308   8.699  -2.716
  486    HA   GLN  66           HA       GLN  66  -7.189   8.876  -4.894
  487    HB2  GLN  66           HB2      GLN  66  -6.549   6.553  -3.063
  488    HB3  GLN  66           HB3      GLN  66  -7.478   6.460  -4.551
  489    HG2  GLN  66           HG2      GLN  66  -4.612   7.348  -4.443
  490    HG3  GLN  66           HG3      GLN  66  -5.107   5.675  -4.690
  491   HE21  GLN  66          1HE2      GLN  66  -4.252   5.510  -6.709
  492   HE22  GLN  66          2HE2      GLN  66  -4.899   6.339  -8.089
  493    H    GLY  67           H        GLY  67  -7.355   9.424  -1.596
  494    HA2  GLY  67           HA1      GLY  67  -9.428  10.230  -0.657
  495    HA3  GLY  67           HA2      GLY  67 -10.277   9.037  -1.628
  496    H    TYR  68           H        TYR  68  -7.560   7.569  -0.448
  497    HA   TYR  68           HA       TYR  68  -9.119   6.229   1.611
  498    HB2  TYR  68           HB2      TYR  68  -6.390   5.586   0.477
  499    HB3  TYR  68           HB3      TYR  68  -7.202   4.644   1.716
  500    HD1  TYR  68           HD1      TYR  68  -9.291   3.424   1.167
  501    HD2  TYR  68           HD2      TYR  68  -6.937   5.313  -1.827
  502    HE1  TYR  68           HE1      TYR  68 -10.404   2.068  -0.552
  503    HE2  TYR  68           HE2      TYR  68  -8.049   3.966  -3.558
  504    HH   TYR  68           HH       TYR  68  -9.255   1.725  -3.650
  505    H    ASP  69           H        ASP  69  -8.300   5.853   3.713
  506    HA   ASP  69           HA       ASP  69  -6.201   7.736   4.575
  507    HB2  ASP  69           HB2      ASP  69  -8.656   6.746   6.013
  508    HB3  ASP  69           HB3      ASP  69  -7.273   7.384   6.897
  509    H    VAL  70           H        VAL  70  -4.376   6.632   4.694
  510    HA   VAL  70           HA       VAL  70  -4.498   3.913   5.787
  511    HB   VAL  70           HB       VAL  70  -2.683   3.243   4.282
  512   HG11  VAL  70          2HG1      VAL  70  -3.992   3.167   2.217
  513   HG12  VAL  70          1HG1      VAL  70  -5.059   4.423   2.849
  514   HG13  VAL  70          3HG1      VAL  70  -5.000   2.840   3.628
  515   HG21  VAL  70          3HG2      VAL  70  -3.073   5.932   2.975
  516   HG22  VAL  70          2HG2      VAL  70  -2.012   4.637   2.419
  517   HG23  VAL  70          1HG2      VAL  70  -1.674   5.458   3.944
  518    H    GLN  71           H        GLN  71  -2.832   3.214   7.038
  519    HA   GLN  71           HA       GLN  71  -0.638   4.974   7.698
  520    HB2  GLN  71           HB2      GLN  71  -2.322   5.865   9.178
  521    HB3  GLN  71           HB3      GLN  71  -2.803   4.251   9.682
  522    HG2  GLN  71           HG2      GLN  71  -0.706   3.929  10.818
  523    HG3  GLN  71           HG3      GLN  71  -0.110   5.479  10.226
  524   HE21  GLN  71          1HE2      GLN  71  -2.322   3.905  12.403
  525   HE22  GLN  71          2HE2      GLN  71  -2.638   5.284  13.398
  Start of MODEL    8
    1    H1   SER   1           H1       SER   1  23.188  -1.403  -0.451
    2    H2   SER   1           H2       SER   1  22.038  -1.507   0.793
    3    H3   SER   1           H3       SER   1  21.774  -0.472  -0.519
    4    HA   SER   1           HA       SER   1  21.702  -2.381  -2.014
    5    HB2  SER   1           HB2      SER   1  23.070  -3.861  -0.520
    6    HB3  SER   1           HB3      SER   1  21.696  -3.968   0.576
    7    HG   SER   1           HG       SER   1  21.700  -4.780  -2.154
    8    H    ASN   2           H        ASN   2  19.671  -3.812  -2.103
    9    HA   ASN   2           HA       ASN   2  17.453  -2.141  -1.647
   10    HB2  ASN   2           HB2      ASN   2  17.404  -5.114  -2.213
   11    HB3  ASN   2           HB3      ASN   2  16.114  -3.958  -2.519
   12   HD21  ASN   2          1HD2      ASN   2  16.367  -2.439  -4.193
   13   HD22  ASN   2          2HD2      ASN   2  17.471  -2.733  -5.505
   14    H    ALA   3           H        ALA   3  15.984  -2.044  -0.041
   15    HA   ALA   3           HA       ALA   3  16.406  -3.875   2.242
   16    HB1  ALA   3           HB1      ALA   3  15.661  -2.055   3.706
   17    HB2  ALA   3           HB2      ALA   3  17.096  -1.602   2.788
   18    HB3  ALA   3           HB3      ALA   3  15.513  -0.992   2.308
   19    H    MET   4           H        MET   4  14.838  -5.363   1.877
   20    HA   MET   4           HA       MET   4  12.239  -4.498   0.918
   21    HB2  MET   4           HB2      MET   4  13.120  -7.300   1.582
   22    HB3  MET   4           HB3      MET   4  11.735  -6.823   0.611
   23    HG2  MET   4           HG2      MET   4  14.648  -6.616  -0.085
   24    HG3  MET   4           HG3      MET   4  13.401  -7.574  -0.878
   25    HE1  MET   4           HE1      MET   4  10.999  -5.403  -0.936
   26    HE2  MET   4           HE2      MET   4  11.224  -4.770  -2.566
   27    HE3  MET   4           HE3      MET   4  11.393  -6.499  -2.260
   28    H    GLU   5           H        GLU   5  11.186  -3.497   2.528
   29    HA   GLU   5           HA       GLU   5  10.942  -4.870   5.111
   30    HB2  GLU   5           HB2      GLU   5  10.263  -2.037   4.306
   31    HB3  GLU   5           HB3      GLU   5  10.010  -2.706   5.913
   32    HG2  GLU   5           HG2      GLU   5  12.682  -2.497   4.546
   33    HG3  GLU   5           HG3      GLU   5  12.053  -1.335   5.713
   34    H    GLN   6           H        GLN   6   9.092  -5.793   5.720
   35    HA   GLN   6           HA       GLN   6   6.782  -5.556   3.936
   36    HB2  GLN   6           HB2      GLN   6   7.265  -7.532   6.165
   37    HB3  GLN   6           HB3      GLN   6   5.962  -7.584   4.985
   38    HG2  GLN   6           HG2      GLN   6   7.578  -7.935   3.199
   39    HG3  GLN   6           HG3      GLN   6   8.893  -7.860   4.368
   40   HE21  GLN   6          1HE2      GLN   6   9.608  -9.920   3.932
   41   HE22  GLN   6          2HE2      GLN   6   8.728 -11.333   4.416
   42    H    LEU   7           H        LEU   7   5.431  -3.982   4.516
   43    HA   LEU   7           HA       LEU   7   4.974  -3.543   7.397
   44    HB2  LEU   7           HB2      LEU   7   4.798  -1.561   5.126
   45    HB3  LEU   7           HB3      LEU   7   4.390  -1.213   6.795
   46    HG   LEU   7           HG       LEU   7   7.133  -1.971   5.783
   47   HD11  LEU   7          2HD1      LEU   7   6.469   0.260   5.067
   48   HD12  LEU   7          1HD1      LEU   7   7.727   0.342   6.300
   49   HD13  LEU   7          3HD1      LEU   7   6.048   0.681   6.727
   50   HD21  LEU   7          3HD2      LEU   7   7.882  -1.370   8.042
   51   HD22  LEU   7          2HD2      LEU   7   6.778  -2.746   8.054
   52   HD23  LEU   7          1HD2      LEU   7   6.202  -1.150   8.530
   53    H    THR   8           H        THR   8   2.888  -3.270   8.125
   54    HA   THR   8           HA       THR   8   0.776  -3.955   6.193
   55    HB   THR   8           HB       THR   8   0.708  -4.282   9.203
   56    HG1  THR   8           HG1      THR   8   1.925  -5.764   7.300
   57   HG21  THR   8          3HG2      THR   8  -1.226  -5.719   8.747
   58   HG22  THR   8          1HG2      THR   8  -1.088  -5.366   7.025
   59   HG23  THR   8          2HG2      THR   8  -1.500  -4.079   8.160
   60    H    LEU   9           H        LEU   9  -0.120  -2.115   5.516
   61    HA   LEU   9           HA       LEU   9  -0.342   0.176   7.297
   62    HB2  LEU   9           HB2      LEU   9  -0.951  -0.219   4.371
   63    HB3  LEU   9           HB3      LEU   9  -1.330   1.264   5.221
   64    HG   LEU   9           HG       LEU   9   1.131   1.469   5.759
   65   HD11  LEU   9          2HD1      LEU   9   2.706   0.240   4.376
   66   HD12  LEU   9          1HD1      LEU   9   1.387  -0.688   3.666
   67   HD13  LEU   9          3HD1      LEU   9   1.769  -0.865   5.379
   68   HD21  LEU   9          3HD2      LEU   9   0.053   2.779   4.026
   69   HD22  LEU   9          2HD2      LEU   9   0.297   1.473   2.865
   70   HD23  LEU   9          1HD2      LEU   9   1.688   2.326   3.539
   71    H    GLN  10           H        GLN  10  -2.211   0.913   8.176
   72    HA   GLN  10           HA       GLN  10  -4.569  -0.766   7.844
   73    HB2  GLN  10           HB2      GLN  10  -5.470   0.576   9.769
   74    HB3  GLN  10           HB3      GLN  10  -4.011  -0.338  10.123
   75    HG2  GLN  10           HG2      GLN  10  -2.674   1.676   9.844
   76    HG3  GLN  10           HG3      GLN  10  -4.141   2.604   9.549
   77   HE21  GLN  10          1HE2      GLN  10  -5.518   3.059  11.264
   78   HE22  GLN  10          2HE2      GLN  10  -5.040   2.849  12.917
   79    H    VAL  11           H        VAL  11  -6.127  -0.260   6.514
   80    HA   VAL  11           HA       VAL  11  -6.240   2.485   5.451
   81    HB   VAL  11           HB       VAL  11  -7.358   0.008   4.148
   82   HG11  VAL  11          2HG1      VAL  11  -7.233   1.386   2.107
   83   HG12  VAL  11          1HG1      VAL  11  -6.695   2.749   3.088
   84   HG13  VAL  11          3HG1      VAL  11  -8.302   2.065   3.332
   85   HG21  VAL  11          3HG2      VAL  11  -5.337   0.017   2.721
   86   HG22  VAL  11          2HG2      VAL  11  -4.998  -0.370   4.411
   87   HG23  VAL  11          1HG2      VAL  11  -4.634   1.239   3.782
   88    H    GLU  12           H        GLU  12  -7.736   3.501   6.664
   89    HA   GLU  12           HA       GLU  12 -10.213   2.084   7.309
   90    HB2  GLU  12           HB2      GLU  12  -9.128   4.709   8.349
   91    HB3  GLU  12           HB3      GLU  12 -10.586   3.903   8.922
   92    HG2  GLU  12           HG2      GLU  12  -9.282   2.027   9.710
   93    HG3  GLU  12           HG3      GLU  12  -7.811   2.746   9.062
   94    H    GLY  13           H        GLY  13 -11.839   2.309   5.951
   95    HA2  GLY  13           HA1      GLY  13 -13.575   3.891   5.246
   96    HA3  GLY  13           HA2      GLY  13 -12.283   4.970   4.743
   97    H    MET  14           H        MET  14 -12.645   1.479   4.189
   98    HA   MET  14           HA       MET  14 -11.778   1.562   1.530
   99    HB2  MET  14           HB2      MET  14 -13.405  -0.471   3.042
  100    HB3  MET  14           HB3      MET  14 -12.951  -0.709   1.363
  101    HG2  MET  14           HG2      MET  14 -11.041  -0.315   3.656
  102    HG3  MET  14           HG3      MET  14 -11.443  -1.855   2.901
  103    HE1  MET  14           HE1      MET  14  -9.011  -2.530   2.326
  104    HE2  MET  14           HE2      MET  14  -7.822  -1.430   1.629
  105    HE3  MET  14           HE3      MET  14  -8.485  -1.113   3.233
  106    H    SER  15           H        SER  15 -12.864   1.317  -0.438
  107    HA   SER  15           HA       SER  15 -15.290   2.866  -0.571
  108    HB2  SER  15           HB2      SER  15 -13.471   3.260  -2.175
  109    HB3  SER  15           HB3      SER  15 -13.644   1.615  -2.783
  110    HG   SER  15           HG       SER  15 -15.663   3.625  -2.846
  111    H    CYS  16           H        CYS  16 -14.478  -0.148  -2.327
  112    HA   CYS  16           HA       CYS  16 -16.838  -1.477  -1.403
  113    HB2  CYS  16           HB2      CYS  16 -17.821  -1.646  -3.753
  114    HB3  CYS  16           HB3      CYS  16 -18.028  -0.114  -2.911
  115    HG   CYS  16           HG       CYS  16 -16.479   1.380  -4.460
  116    H    GLY  17           H        GLY  17 -15.589  -1.863  -4.680
  117    HA2  GLY  17           HA1      GLY  17 -14.234  -4.336  -3.812
  118    HA3  GLY  17           HA2      GLY  17 -15.403  -4.372  -5.121
  119    H    HIS  18           H        HIS  18 -14.804  -2.328  -6.729
  120    HA   HIS  18           HA       HIS  18 -12.515  -3.206  -8.102
  121    HB2  HIS  18           HB2      HIS  18 -14.443  -1.955  -9.115
  122    HB3  HIS  18           HB3      HIS  18 -13.815  -0.488  -8.370
  123    HD1  HIS  18           HD1      HIS  18 -11.998   0.749  -9.610
  124    HD2  HIS  18           HD2      HIS  18 -12.706  -3.055 -11.149
  125    HE1  HIS  18           HE1      HIS  18 -10.659   0.610 -11.733
  126    HE2  HIS  18           HE2      HIS  18 -11.261  -1.616 -12.744
  127    H    CYS  19           H        CYS  19 -12.891  -0.996  -5.518
  128    HA   CYS  19           HA       CYS  19 -10.610   0.599  -5.813
  129    HB2  CYS  19           HB2      CYS  19 -10.822   0.951  -3.353
  130    HB3  CYS  19           HB3      CYS  19 -12.326   1.201  -4.233
  131    HG   CYS  19           HG       CYS  19 -11.512  -1.284  -2.071
  132    H    VAL  20           H        VAL  20 -10.993  -2.701  -4.825
  133    HA   VAL  20           HA       VAL  20  -8.676  -3.108  -3.329
  134    HB   VAL  20           HB       VAL  20 -10.113  -4.991  -5.212
  135   HG11  VAL  20          2HG1      VAL  20  -8.011  -5.644  -3.147
  136   HG12  VAL  20          1HG1      VAL  20  -7.806  -5.740  -4.896
  137   HG13  VAL  20          3HG1      VAL  20  -8.943  -6.813  -4.080
  138   HG21  VAL  20          3HG2      VAL  20 -10.173  -4.704  -2.210
  139   HG22  VAL  20          2HG2      VAL  20 -11.038  -5.925  -3.146
  140   HG23  VAL  20          1HG2      VAL  20 -11.449  -4.218  -3.329
  141    H    ASN  21           H        ASN  21  -9.119  -3.652  -6.838
  142    HA   ASN  21           HA       ASN  21  -6.338  -4.018  -7.293
  143    HB2  ASN  21           HB2      ASN  21  -8.608  -3.439  -9.198
  144    HB3  ASN  21           HB3      ASN  21  -6.951  -3.710  -9.725
  145   HD21  ASN  21          1HD2      ASN  21  -6.009  -5.757  -9.400
  146   HD22  ASN  21          2HD2      ASN  21  -6.997  -7.170  -9.224
  147    H    ALA  22           H        ALA  22  -8.476  -1.248  -7.350
  148    HA   ALA  22           HA       ALA  22  -6.823   0.595  -8.641
  149    HB1  ALA  22           HB1      ALA  22  -8.103   2.320  -7.496
  150    HB2  ALA  22           HB2      ALA  22  -9.161   1.037  -8.086
  151    HB3  ALA  22           HB3      ALA  22  -8.741   1.117  -6.375
  152    H    ILE  23           H        ILE  23  -7.128   0.047  -5.105
  153    HA   ILE  23           HA       ILE  23  -4.929   1.742  -4.480
  154    HB   ILE  23           HB       ILE  23  -6.666   1.292  -2.820
  155   HG12  ILE  23          2HG1      ILE  23  -3.959   0.255  -1.958
  156   HG13  ILE  23          3HG1      ILE  23  -4.426   1.951  -2.052
  157   HG21  ILE  23          2HG2      ILE  23  -5.599  -1.525  -2.766
  158   HG22  ILE  23          1HG2      ILE  23  -7.176  -1.017  -3.367
  159   HG23  ILE  23          3HG2      ILE  23  -6.794  -0.855  -1.654
  160   HD11  ILE  23          3HD1      ILE  23  -6.110   1.577  -0.324
  161   HD12  ILE  23          2HD1      ILE  23  -4.493   1.153   0.235
  162   HD13  ILE  23          1HD1      ILE  23  -5.629  -0.116  -0.225
  163    H    GLU  24           H        GLU  24  -5.260  -1.716  -5.074
  164    HA   GLU  24           HA       GLU  24  -2.754  -2.621  -4.312
  165    HB2  GLU  24           HB2      GLU  24  -4.429  -4.177  -5.021
  166    HB3  GLU  24           HB3      GLU  24  -4.518  -3.445  -6.617
  167    HG2  GLU  24           HG2      GLU  24  -2.245  -4.212  -7.091
  168    HG3  GLU  24           HG3      GLU  24  -2.170  -4.954  -5.492
  169    H    SER  25           H        SER  25  -3.724  -1.352  -7.513
  170    HA   SER  25           HA       SER  25  -1.038  -1.375  -8.467
  171    HB2  SER  25           HB2      SER  25  -3.417   0.114  -9.578
  172    HB3  SER  25           HB3      SER  25  -1.867  -0.148 -10.393
  173    HG   SER  25           HG       SER  25  -2.988  -2.460  -9.445
  174    H    SER  26           H        SER  26  -3.034   1.018  -6.862
  175    HA   SER  26           HA       SER  26  -1.541   3.304  -7.327
  176    HB2  SER  26           HB2      SER  26  -2.948   2.444  -4.783
  177    HB3  SER  26           HB3      SER  26  -2.331   4.070  -5.076
  178    HG   SER  26           HG       SER  26  -4.324   2.710  -6.589
  179    H    VAL  27           H        VAL  27  -0.988   0.665  -5.060
  180    HA   VAL  27           HA       VAL  27   1.518   1.769  -4.137
  181    HB   VAL  27           HB       VAL  27   0.399  -1.011  -3.749
  182   HG11  VAL  27          2HG1      VAL  27   2.809  -0.871  -3.381
  183   HG12  VAL  27          1HG1      VAL  27   1.948  -1.136  -1.866
  184   HG13  VAL  27          3HG1      VAL  27   2.566   0.468  -2.260
  185   HG21  VAL  27          3HG2      VAL  27   0.221   1.407  -1.955
  186   HG22  VAL  27          2HG2      VAL  27  -0.341  -0.218  -1.556
  187   HG23  VAL  27          1HG2      VAL  27  -1.111   0.687  -2.860
  188    H    LYS  28           H        LYS  28   0.510  -0.985  -6.158
  189    HA   LYS  28           HA       LYS  28   3.037  -2.082  -6.588
  190    HB2  LYS  28           HB2      LYS  28   1.022  -3.329  -7.029
  191    HB3  LYS  28           HB3      LYS  28   0.554  -2.207  -8.301
  192    HG2  LYS  28           HG2      LYS  28   2.436  -2.917  -9.656
  193    HG3  LYS  28           HG3      LYS  28   2.983  -3.989  -8.367
  194    HD2  LYS  28           HD2      LYS  28   0.298  -4.214  -9.719
  195    HD3  LYS  28           HD3      LYS  28   1.724  -5.130 -10.204
  196    HE2  LYS  28           HE2      LYS  28   0.436  -5.203  -7.476
  197    HE3  LYS  28           HE3      LYS  28   0.230  -6.420  -8.735
  198    HZ1  LYS  28           HZ1      LYS  28   2.812  -5.702  -7.446
  199    HZ2  LYS  28           HZ2      LYS  28   2.591  -6.897  -8.628
  200    HZ3  LYS  28           HZ3      LYS  28   1.886  -7.080  -7.096
  201    H    GLU  29           H        GLU  29   1.343   0.397  -8.472
  202    HA   GLU  29           HA       GLU  29   3.089   0.346 -10.690
  203    HB2  GLU  29           HB2      GLU  29   1.012   2.191  -9.668
  204    HB3  GLU  29           HB3      GLU  29   2.171   2.847 -10.821
  205    HG2  GLU  29           HG2      GLU  29   0.561   0.352 -11.271
  206    HG3  GLU  29           HG3      GLU  29   0.090   1.954 -11.847
  207    H    LEU  30           H        LEU  30   3.366   1.722  -7.561
  208    HA   LEU  30           HA       LEU  30   5.331   3.699  -8.208
  209    HB2  LEU  30           HB2      LEU  30   4.976   2.356  -5.535
  210    HB3  LEU  30           HB3      LEU  30   5.694   3.922  -5.851
  211    HG   LEU  30           HG       LEU  30   2.792   3.155  -5.965
  212   HD11  LEU  30          2HD1      LEU  30   3.655   3.736  -3.784
  213   HD12  LEU  30          1HD1      LEU  30   2.562   4.990  -4.367
  214   HD13  LEU  30          3HD1      LEU  30   4.306   5.246  -4.421
  215   HD21  LEU  30          3HD2      LEU  30   3.219   4.490  -7.944
  216   HD22  LEU  30          2HD2      LEU  30   4.057   5.703  -6.971
  217   HD23  LEU  30          1HD2      LEU  30   2.327   5.437  -6.752
  218    H    ASN  31           H        ASN  31   7.503   3.534  -8.382
  219    HA   ASN  31           HA       ASN  31   8.585   0.918  -8.781
  220    HB2  ASN  31           HB2      ASN  31   9.282   2.858 -10.137
  221    HB3  ASN  31           HB3      ASN  31  10.012   3.582  -8.705
  222   HD21  ASN  31          1HD2      ASN  31  10.214   0.981 -11.026
  223   HD22  ASN  31          2HD2      ASN  31  11.867   0.567 -10.696
  224    H    GLY  32           H        GLY  32   9.636  -0.348  -7.439
  225    HA2  GLY  32           HA1      GLY  32  11.316  -0.630  -5.701
  226    HA3  GLY  32           HA2      GLY  32  10.661   0.802  -4.914
  227    H    VAL  33           H        VAL  33   8.076  -0.829  -6.089
  228    HA   VAL  33           HA       VAL  33   7.553  -2.039  -3.491
  229    HB   VAL  33           HB       VAL  33   5.723  -1.416  -5.809
  230   HG11  VAL  33          2HG1      VAL  33   4.967  -3.459  -4.720
  231   HG12  VAL  33          1HG1      VAL  33   3.882  -2.119  -4.346
  232   HG13  VAL  33          3HG1      VAL  33   5.052  -2.667  -3.146
  233   HG21  VAL  33          3HG2      VAL  33   5.997  -0.270  -3.035
  234   HG22  VAL  33          2HG2      VAL  33   4.730   0.160  -4.186
  235   HG23  VAL  33          1HG2      VAL  33   6.415   0.527  -4.553
  236    H    GLU  34           H        GLU  34   7.727  -4.109  -3.166
  237    HA   GLU  34           HA       GLU  34   8.395  -5.909  -5.322
  238    HB2  GLU  34           HB2      GLU  34   9.294  -5.810  -2.864
  239    HB3  GLU  34           HB3      GLU  34   7.855  -6.741  -2.488
  240    HG2  GLU  34           HG2      GLU  34  10.070  -7.538  -4.357
  241    HG3  GLU  34           HG3      GLU  34   9.748  -8.187  -2.752
  242    H    GLN  35           H        GLN  35   6.046  -6.137  -2.671
  243    HA   GLN  35           HA       GLN  35   4.054  -7.192  -4.533
  244    HB2  GLN  35           HB2      GLN  35   3.499  -9.026  -3.080
  245    HB3  GLN  35           HB3      GLN  35   5.231  -9.085  -3.384
  246    HG2  GLN  35           HG2      GLN  35   5.566  -7.899  -1.221
  247    HG3  GLN  35           HG3      GLN  35   3.846  -8.101  -0.909
  248   HE21  GLN  35          1HE2      GLN  35   5.878 -10.450  -2.523
  249   HE22  GLN  35          2HE2      GLN  35   5.809 -11.652  -1.277
  250    H    VAL  36           H        VAL  36   1.916  -6.807  -3.919
  251    HA   VAL  36           HA       VAL  36   1.495  -5.296  -1.452
  252    HB   VAL  36           HB       VAL  36   1.730  -3.523  -3.022
  253   HG11  VAL  36          2HG1      VAL  36   1.522  -4.791  -5.087
  254   HG12  VAL  36          1HG1      VAL  36   0.461  -3.383  -5.112
  255   HG13  VAL  36          3HG1      VAL  36  -0.208  -4.987  -4.810
  256   HG21  VAL  36          3HG2      VAL  36  -1.213  -4.060  -2.633
  257   HG22  VAL  36          2HG2      VAL  36  -0.493  -2.499  -3.021
  258   HG23  VAL  36          1HG2      VAL  36  -0.140  -3.272  -1.476
  259    H    LYS  37           H        LYS  37   0.045  -6.398  -0.353
  260    HA   LYS  37           HA       LYS  37  -2.192  -7.623  -1.834
  261    HB2  LYS  37           HB2      LYS  37  -0.948  -8.508   0.773
  262    HB3  LYS  37           HB3      LYS  37  -2.384  -9.219   0.052
  263    HG2  LYS  37           HG2      LYS  37  -1.002  -9.814  -1.937
  264    HG3  LYS  37           HG3      LYS  37   0.416  -9.265  -1.041
  265    HD2  LYS  37           HD2      LYS  37  -1.480 -11.434  -0.147
  266    HD3  LYS  37           HD3      LYS  37   0.093 -11.703  -0.898
  267    HE2  LYS  37           HE2      LYS  37   1.237 -10.783   0.957
  268    HE3  LYS  37           HE3      LYS  37  -0.247 -10.107   1.628
  269    HZ1  LYS  37           HZ1      LYS  37   0.483 -12.116   2.795
  270    HZ2  LYS  37           HZ2      LYS  37   0.324 -13.010   1.361
  271    HZ3  LYS  37           HZ3      LYS  37  -1.043 -12.310   2.085
  272    H    VAL  38           H        VAL  38  -3.743  -6.109  -1.701
  273    HA   VAL  38           HA       VAL  38  -4.259  -4.771   0.823
  274    HB   VAL  38           HB       VAL  38  -4.527  -3.403  -1.132
  275   HG11  VAL  38          2HG1      VAL  38  -6.184  -3.874  -2.865
  276   HG12  VAL  38          1HG1      VAL  38  -6.556  -5.413  -2.089
  277   HG13  VAL  38          3HG1      VAL  38  -4.957  -5.137  -2.779
  278   HG21  VAL  38          3HG2      VAL  38  -7.215  -4.110   0.041
  279   HG22  VAL  38          2HG2      VAL  38  -6.848  -2.636  -0.857
  280   HG23  VAL  38          1HG2      VAL  38  -6.058  -2.945   0.691
  281    H    GLN  39           H        GLN  39  -5.418  -5.668   2.348
  282    HA   GLN  39           HA       GLN  39  -7.289  -7.803   1.674
  283    HB2  GLN  39           HB2      GLN  39  -6.381  -6.826   4.391
  284    HB3  GLN  39           HB3      GLN  39  -7.354  -8.257   4.081
  285    HG2  GLN  39           HG2      GLN  39  -4.496  -7.811   3.248
  286    HG3  GLN  39           HG3      GLN  39  -5.069  -8.872   4.532
  287   HE21  GLN  39          1HE2      GLN  39  -6.086 -10.815   3.994
  288   HE22  GLN  39          2HE2      GLN  39  -5.962 -11.496   2.406
  289    H    LEU  40           H        LEU  40  -9.145  -6.957   0.981
  290    HA   LEU  40           HA       LEU  40 -10.198  -4.462   1.748
  291    HB2  LEU  40           HB2      LEU  40 -10.670  -5.955  -0.327
  292    HB3  LEU  40           HB3      LEU  40 -11.865  -6.729   0.689
  293    HG   LEU  40           HG       LEU  40 -12.784  -4.993  -0.849
  294   HD11  LEU  40          2HD1      LEU  40 -14.030  -5.611   1.131
  295   HD12  LEU  40          1HD1      LEU  40 -14.203  -3.885   0.808
  296   HD13  LEU  40          3HD1      LEU  40 -13.124  -4.440   2.091
  297   HD21  LEU  40          3HD2      LEU  40 -12.438  -2.640  -0.317
  298   HD22  LEU  40          2HD2      LEU  40 -10.928  -3.426  -0.774
  299   HD23  LEU  40          1HD2      LEU  40 -11.268  -3.088   0.923
  300    H    ALA  41           H        ALA  41 -10.824  -7.761   2.823
  301    HA   ALA  41           HA       ALA  41 -13.035  -7.263   4.470
  302    HB1  ALA  41           HB1      ALA  41 -12.361  -9.504   3.768
  303    HB2  ALA  41           HB2      ALA  41 -10.922  -9.390   4.780
  304    HB3  ALA  41           HB3      ALA  41 -12.522  -9.403   5.521
  305    H    GLU  42           H        GLU  42  -9.591  -7.513   5.359
  306    HA   GLU  42           HA       GLU  42 -10.050  -6.788   8.076
  307    HB2  GLU  42           HB2      GLU  42  -7.554  -7.000   6.403
  308    HB3  GLU  42           HB3      GLU  42  -7.512  -6.466   8.074
  309    HG2  GLU  42           HG2      GLU  42  -6.961  -8.810   7.908
  310    HG3  GLU  42           HG3      GLU  42  -8.466  -8.585   8.791
  311    H    GLY  43           H        GLY  43  -9.229  -5.010   5.170
  312    HA2  GLY  43           HA1      GLY  43  -9.362  -2.703   4.843
  313    HA3  GLY  43           HA2      GLY  43  -9.620  -2.497   6.574
  314    H    THR  44           H        THR  44  -7.017  -4.317   5.088
  315    HA   THR  44           HA       THR  44  -5.103  -2.224   5.817
  316    HB   THR  44           HB       THR  44  -3.602  -4.044   6.774
  317    HG1  THR  44           HG1      THR  44  -4.856  -5.881   7.608
  318   HG21  THR  44          3HG2      THR  44  -4.639  -4.006   8.991
  319   HG22  THR  44          1HG2      THR  44  -6.157  -3.465   8.277
  320   HG23  THR  44          2HG2      THR  44  -4.737  -2.422   8.223
  321    H    VAL  45           H        VAL  45  -2.973  -2.581   4.835
  322    HA   VAL  45           HA       VAL  45  -3.074  -4.405   2.526
  323    HB   VAL  45           HB       VAL  45  -1.840  -1.642   2.459
  324   HG11  VAL  45          2HG1      VAL  45  -1.619  -2.044   0.072
  325   HG12  VAL  45          1HG1      VAL  45  -2.339  -3.642   0.259
  326   HG13  VAL  45          3HG1      VAL  45  -0.773  -3.290   0.989
  327   HG21  VAL  45          3HG2      VAL  45  -4.428  -2.616   1.257
  328   HG22  VAL  45          2HG2      VAL  45  -3.686  -1.046   0.950
  329   HG23  VAL  45          1HG2      VAL  45  -4.256  -1.449   2.570
  330    H    GLU  46           H        GLU  46  -1.513  -5.837   2.635
  331    HA   GLU  46           HA       GLU  46   0.868  -5.307   4.235
  332    HB2  GLU  46           HB2      GLU  46  -0.107  -7.810   2.849
  333    HB3  GLU  46           HB3      GLU  46   1.392  -7.709   3.762
  334    HG2  GLU  46           HG2      GLU  46   0.135  -7.180   5.779
  335    HG3  GLU  46           HG3      GLU  46  -1.370  -7.261   4.865
  336    H    VAL  47           H        VAL  47   2.528  -4.346   3.258
  337    HA   VAL  47           HA       VAL  47   2.993  -4.955   0.409
  338    HB   VAL  47           HB       VAL  47   3.510  -2.266   1.682
  339   HG11  VAL  47          2HG1      VAL  47   3.690  -1.516  -0.655
  340   HG12  VAL  47          1HG1      VAL  47   3.484  -3.186  -1.188
  341   HG13  VAL  47          3HG1      VAL  47   4.899  -2.731  -0.236
  342   HG21  VAL  47          3HG2      VAL  47   1.109  -2.689   1.676
  343   HG22  VAL  47          2HG2      VAL  47   1.175  -3.077  -0.043
  344   HG23  VAL  47          1HG2      VAL  47   1.541  -1.441   0.507
  345    H    THR  48           H        THR  48   4.944  -5.746   0.011
  346    HA   THR  48           HA       THR  48   7.138  -5.238   1.879
  347    HB   THR  48           HB       THR  48   7.173  -6.980  -0.606
  348    HG1  THR  48           HG1      THR  48   7.029  -8.690   1.087
  349   HG21  THR  48          3HG2      THR  48   9.003  -6.874   1.798
  350   HG22  THR  48          1HG2      THR  48   9.382  -6.266   0.186
  351   HG23  THR  48          2HG2      THR  48   9.139  -7.995   0.442
  352    H    ILE  49           H        ILE  49   8.246  -3.416   1.525
  353    HA   ILE  49           HA       ILE  49   8.462  -2.462  -1.260
  354    HB   ILE  49           HB       ILE  49   8.746  -0.189  -0.349
  355   HG12  ILE  49          2HG1      ILE  49   7.904  -1.280   2.333
  356   HG13  ILE  49          3HG1      ILE  49   9.598  -1.074   1.903
  357   HG21  ILE  49          2HG2      ILE  49   6.223  -1.564   0.552
  358   HG22  ILE  49          1HG2      ILE  49   6.539  -0.892  -1.048
  359   HG23  ILE  49          3HG2      ILE  49   6.424   0.177   0.351
  360   HD11  ILE  49          3HD1      ILE  49   8.811   0.800   3.203
  361   HD12  ILE  49          2HD1      ILE  49   7.521   1.099   2.037
  362   HD13  ILE  49          1HD1      ILE  49   9.207   1.317   1.566
  363    H    ASP  50           H        ASP  50  10.405  -1.601  -1.954
  364    HA   ASP  50           HA       ASP  50  12.769  -2.260  -0.390
  365    HB2  ASP  50           HB2      ASP  50  12.702  -2.646  -2.863
  366    HB3  ASP  50           HB3      ASP  50  12.555  -0.907  -3.093
  367    H    SER  51           H        SER  51  12.870  -0.880   1.285
  368    HA   SER  51           HA       SER  51  11.956   1.820   1.078
  369    HB2  SER  51           HB2      SER  51  11.712   0.419   3.128
  370    HB3  SER  51           HB3      SER  51  13.453   0.519   3.360
  371    HG   SER  51           HG       SER  51  12.347   2.965   2.974
  372    H    SER  52           H        SER  52  14.797   0.385   0.144
  373    HA   SER  52           HA       SER  52  16.505   2.660   0.687
  374    HB2  SER  52           HB2      SER  52  16.949   0.239  -1.079
  375    HB3  SER  52           HB3      SER  52  18.170   1.442  -0.668
  376    HG   SER  52           HG       SER  52  18.100  -0.577   0.616
  377    H    VAL  53           H        VAL  53  14.122   1.837  -1.524
  378    HA   VAL  53           HA       VAL  53  15.165   3.738  -3.518
  379    HB   VAL  53           HB       VAL  53  13.397   1.323  -3.949
  380   HG11  VAL  53          2HG1      VAL  53  14.396   3.346  -5.956
  381   HG12  VAL  53          1HG1      VAL  53  12.727   3.163  -5.412
  382   HG13  VAL  53          3HG1      VAL  53  13.504   1.870  -6.329
  383   HG21  VAL  53          3HG2      VAL  53  15.781   0.831  -3.573
  384   HG22  VAL  53          2HG2      VAL  53  16.205   1.927  -4.888
  385   HG23  VAL  53          1HG2      VAL  53  15.285   0.461  -5.228
  386    H    VAL  54           H        VAL  54  12.017   2.311  -2.567
  387    HA   VAL  54           HA       VAL  54  10.830   4.974  -2.913
  388    HB   VAL  54           HB       VAL  54   9.807   3.047  -4.154
  389   HG11  VAL  54          2HG1      VAL  54   8.366   1.487  -2.910
  390   HG12  VAL  54          1HG1      VAL  54   9.018   2.123  -1.398
  391   HG13  VAL  54          3HG1      VAL  54  10.077   1.284  -2.531
  392   HG21  VAL  54          3HG2      VAL  54   7.482   3.623  -3.616
  393   HG22  VAL  54          2HG2      VAL  54   8.516   5.048  -3.732
  394   HG23  VAL  54          1HG2      VAL  54   8.034   4.433  -2.149
  395    H    THR  55           H        THR  55   9.532   5.878  -1.230
  396    HA   THR  55           HA       THR  55  10.302   4.872   1.411
  397    HB   THR  55           HB       THR  55   9.612   7.064   2.279
  398    HG1  THR  55           HG1      THR  55   8.765   7.429  -0.397
  399   HG21  THR  55          3HG2      THR  55  11.358   8.424   1.205
  400   HG22  THR  55          1HG2      THR  55  11.470   7.238  -0.094
  401   HG23  THR  55          2HG2      THR  55  11.917   6.790   1.553
  402    H    LEU  56           H        LEU  56   8.688   4.861   3.133
  403    HA   LEU  56           HA       LEU  56   6.318   3.544   2.312
  404    HB2  LEU  56           HB2      LEU  56   5.690   3.635   4.722
  405    HB3  LEU  56           HB3      LEU  56   7.255   2.920   4.408
  406    HG   LEU  56           HG       LEU  56   8.112   5.361   4.955
  407   HD11  LEU  56          2HD1      LEU  56   5.897   6.354   5.183
  408   HD12  LEU  56          1HD1      LEU  56   6.782   6.422   6.706
  409   HD13  LEU  56          3HD1      LEU  56   5.513   5.219   6.477
  410   HD21  LEU  56          3HD2      LEU  56   8.742   3.350   6.162
  411   HD22  LEU  56          2HD2      LEU  56   7.217   3.383   7.045
  412   HD23  LEU  56          1HD2      LEU  56   8.403   4.666   7.285
  413    H    LYS  57           H        LYS  57   7.129   6.824   3.075
  414    HA   LYS  57           HA       LYS  57   4.591   7.916   3.479
  415    HB2  LYS  57           HB2      LYS  57   7.098   8.908   3.468
  416    HB3  LYS  57           HB3      LYS  57   6.526   9.527   1.925
  417    HG2  LYS  57           HG2      LYS  57   5.090   9.916   4.536
  418    HG3  LYS  57           HG3      LYS  57   6.229  11.077   3.852
  419    HD2  LYS  57           HD2      LYS  57   4.783  11.212   1.835
  420    HD3  LYS  57           HD3      LYS  57   3.622  10.156   2.646
  421    HE2  LYS  57           HE2      LYS  57   2.927  12.445   2.901
  422    HE3  LYS  57           HE3      LYS  57   3.441  11.814   4.464
  423    HZ1  LYS  57           HZ1      LYS  57   5.113  13.502   2.677
  424    HZ2  LYS  57           HZ2      LYS  57   5.536  12.958   4.227
  425    HZ3  LYS  57           HZ3      LYS  57   4.265  14.064   4.034
  426    H    ASP  58           H        ASP  58   6.370   7.263   0.474
  427    HA   ASP  58           HA       ASP  58   4.626   8.440  -1.362
  428    HB2  ASP  58           HB2      ASP  58   6.265   5.908  -1.664
  429    HB3  ASP  58           HB3      ASP  58   5.447   6.719  -2.992
  430    H    ILE  59           H        ILE  59   4.656   5.158  -0.058
  431    HA   ILE  59           HA       ILE  59   2.451   4.141  -1.433
  432    HB   ILE  59           HB       ILE  59   3.274   3.395   1.378
  433   HG12  ILE  59          2HG1      ILE  59   5.238   3.342  -0.060
  434   HG13  ILE  59          3HG1      ILE  59   4.733   1.700   0.321
  435   HG21  ILE  59          2HG2      ILE  59   1.887   1.812  -0.783
  436   HG22  ILE  59          1HG2      ILE  59   1.148   2.445   0.689
  437   HG23  ILE  59          3HG2      ILE  59   2.383   1.189   0.792
  438   HD11  ILE  59          3HD1      ILE  59   3.689   1.513  -1.874
  439   HD12  ILE  59          2HD1      ILE  59   5.403   1.904  -2.000
  440   HD13  ILE  59          1HD1      ILE  59   4.192   3.160  -2.252
  441    H    VAL  60           H        VAL  60   2.635   5.573   1.812
  442    HA   VAL  60           HA       VAL  60  -0.085   5.412   2.451
  443    HB   VAL  60           HB       VAL  60   1.965   7.434   3.384
  444   HG11  VAL  60          2HG1      VAL  60  -0.293   8.233   3.818
  445   HG12  VAL  60          1HG1      VAL  60   0.498   7.757   5.321
  446   HG13  VAL  60          3HG1      VAL  60  -0.704   6.697   4.582
  447   HG21  VAL  60          3HG2      VAL  60   2.159   5.967   5.345
  448   HG22  VAL  60          2HG2      VAL  60   2.628   5.149   3.854
  449   HG23  VAL  60          1HG2      VAL  60   1.055   4.821   4.584
  450    H    ALA  61           H        ALA  61   1.764   8.054   0.960
  451    HA   ALA  61           HA       ALA  61  -0.230   9.988   0.882
  452    HB1  ALA  61           HB1      ALA  61   1.951   9.571  -1.154
  453    HB2  ALA  61           HB2      ALA  61   1.078  11.070  -0.836
  454    HB3  ALA  61           HB3      ALA  61   2.151  10.396   0.392
  455    H    VAL  62           H        VAL  62   0.619   7.593  -1.615
  456    HA   VAL  62           HA       VAL  62  -1.347   8.456  -3.455
  457    HB   VAL  62           HB       VAL  62  -0.059   5.725  -3.274
  458   HG11  VAL  62          2HG1      VAL  62  -0.574   5.564  -5.659
  459   HG12  VAL  62          1HG1      VAL  62  -1.384   7.130  -5.592
  460   HG13  VAL  62          3HG1      VAL  62  -2.042   5.758  -4.701
  461   HG21  VAL  62          3HG2      VAL  62   1.625   7.470  -3.406
  462   HG22  VAL  62          2HG2      VAL  62   0.799   8.193  -4.786
  463   HG23  VAL  62          1HG2      VAL  62   1.534   6.595  -4.935
  464    H    ILE  63           H        ILE  63  -1.363   6.021  -0.897
  465    HA   ILE  63           HA       ILE  63  -3.882   4.895  -1.524
  466    HB   ILE  63           HB       ILE  63  -2.376   5.013   1.089
  467   HG12  ILE  63          2HG1      ILE  63  -2.803   2.780  -0.909
  468   HG13  ILE  63          3HG1      ILE  63  -1.322   3.712  -0.719
  469   HG21  ILE  63          2HG2      ILE  63  -4.742   4.793   1.578
  470   HG22  ILE  63          1HG2      ILE  63  -3.912   3.269   1.893
  471   HG23  ILE  63          3HG2      ILE  63  -4.878   3.462   0.430
  472   HD11  ILE  63          3HD1      ILE  63  -1.143   1.540   0.347
  473   HD12  ILE  63          2HD1      ILE  63  -2.542   1.907   1.357
  474   HD13  ILE  63          1HD1      ILE  63  -1.054   2.839   1.538
  475    H    GLU  64           H        GLU  64  -2.951   7.482   0.752
  476    HA   GLU  64           HA       GLU  64  -5.612   7.964   1.621
  477    HB2  GLU  64           HB2      GLU  64  -3.181   9.754   1.723
  478    HB3  GLU  64           HB3      GLU  64  -4.707  10.092   2.530
  479    HG2  GLU  64           HG2      GLU  64  -4.406   7.873   3.717
  480    HG3  GLU  64           HG3      GLU  64  -2.755   7.883   3.097
  481    H    ASP  65           H        ASP  65  -3.733   9.038  -1.079
  482    HA   ASP  65           HA       ASP  65  -5.295  11.226  -1.902
  483    HB2  ASP  65           HB2      ASP  65  -3.100  10.804  -2.862
  484    HB3  ASP  65           HB3      ASP  65  -3.657   9.277  -3.538
  485    H    GLN  66           H        GLN  66  -5.802   7.806  -2.104
  486    HA   GLN  66           HA       GLN  66  -7.813   7.865  -4.138
  487    HB2  GLN  66           HB2      GLN  66  -7.229   5.783  -2.021
  488    HB3  GLN  66           HB3      GLN  66  -8.304   5.557  -3.393
  489    HG2  GLN  66           HG2      GLN  66  -5.342   6.074  -3.540
  490    HG3  GLN  66           HG3      GLN  66  -6.131   4.512  -3.750
  491   HE21  GLN  66          1HE2      GLN  66  -5.421   7.574  -5.162
  492   HE22  GLN  66          2HE2      GLN  66  -5.981   7.213  -6.759
  493    H    GLY  67           H        GLY  67  -7.788   8.923  -0.964
  494    HA2  GLY  67           HA1      GLY  67  -9.706  10.015  -0.033
  495    HA3  GLY  67           HA2      GLY  67 -10.727   8.860  -0.877
  496    H    TYR  68           H        TYR  68  -7.880   7.858   0.827
  497    HA   TYR  68           HA       TYR  68  -9.586   6.609   2.878
  498    HB2  TYR  68           HB2      TYR  68  -6.935   5.588   1.823
  499    HB3  TYR  68           HB3      TYR  68  -7.969   4.789   3.003
  500    HD1  TYR  68           HD2      TYR  68 -10.614   5.024   1.814
  501    HD2  TYR  68           HD1      TYR  68  -6.881   4.211  -0.044
  502    HE1  TYR  68           HE2      TYR  68 -11.782   3.867  -0.009
  503    HE2  TYR  68           HE1      TYR  68  -8.038   3.046  -1.877
  504    HH   TYR  68           HH       TYR  68 -11.300   3.340  -2.445
  505    H    ASP  69           H        ASP  69  -8.563   6.326   4.992
  506    HA   ASP  69           HA       ASP  69  -6.480   8.350   5.484
  507    HB2  ASP  69           HB2      ASP  69  -8.736   7.404   7.252
  508    HB3  ASP  69           HB3      ASP  69  -7.353   8.293   7.880
  509    H    VAL  70           H        VAL  70  -4.573   7.557   5.951
  510    HA   VAL  70           HA       VAL  70  -4.400   4.948   7.302
  511    HB   VAL  70           HB       VAL  70  -2.793   5.771   4.869
  512   HG11  VAL  70          2HG1      VAL  70  -2.609   3.267   6.547
  513   HG12  VAL  70          1HG1      VAL  70  -1.400   4.546   6.443
  514   HG13  VAL  70          3HG1      VAL  70  -1.754   3.553   5.032
  515   HG21  VAL  70          3HG2      VAL  70  -3.851   3.868   3.772
  516   HG22  VAL  70          2HG2      VAL  70  -5.062   5.022   4.333
  517   HG23  VAL  70          1HG2      VAL  70  -4.781   3.530   5.233
  518    H    GLN  71           H        GLN  71  -3.091   4.987   8.981
  519    HA   GLN  71           HA       GLN  71  -1.396   5.478  10.407
  520    HB2  GLN  71           HB2      GLN  71   0.047   5.434   8.351
  521    HB3  GLN  71           HB3      GLN  71  -0.207   7.167   8.195
  522    HG2  GLN  71           HG2      GLN  71   0.781   7.410  10.494
  523    HG3  GLN  71           HG3      GLN  71   1.222   5.706  10.398
  524   HE21  GLN  71          1HE2      GLN  71   1.702   5.938   7.493
  525   HE22  GLN  71          2HE2      GLN  71   3.227   6.739   7.332
  Start of MODEL    9
    1    H1   SER   1           H1       SER   1  16.784  -5.116  -4.962
    2    H2   SER   1           H2       SER   1  15.738  -3.909  -4.384
    3    H3   SER   1           H3       SER   1  15.140  -5.147  -5.374
    4    HA   SER   1           HA       SER   1  14.536  -5.483  -3.077
    5    HB2  SER   1           HB2      SER   1  15.456  -7.817  -2.891
    6    HB3  SER   1           HB3      SER   1  14.762  -7.448  -4.470
    7    HG   SER   1           HG       SER   1  17.304  -8.149  -3.811
    8    H    ASN   2           H        ASN   2  16.208  -3.467  -2.557
    9    HA   ASN   2           HA       ASN   2  18.248  -4.551  -0.720
   10    HB2  ASN   2           HB2      ASN   2  18.006  -1.821  -2.009
   11    HB3  ASN   2           HB3      ASN   2  19.235  -2.256  -0.826
   12   HD21  ASN   2          1HD2      ASN   2  19.470  -1.387  -3.616
   13   HD22  ASN   2          2HD2      ASN   2  20.373  -2.624  -4.423
   14    H    ALA   3           H        ALA   3  17.657  -4.568   1.342
   15    HA   ALA   3           HA       ALA   3  16.549  -4.166   3.280
   16    HB1  ALA   3           HB1      ALA   3  16.102  -1.845   3.914
   17    HB2  ALA   3           HB2      ALA   3  17.709  -2.017   3.206
   18    HB3  ALA   3           HB3      ALA   3  16.394  -1.332   2.252
   19    H    MET   4           H        MET   4  14.844  -5.523   2.673
   20    HA   MET   4           HA       MET   4  12.560  -4.373   1.289
   21    HB2  MET   4           HB2      MET   4  12.956  -7.175   2.351
   22    HB3  MET   4           HB3      MET   4  11.653  -6.641   1.296
   23    HG2  MET   4           HG2      MET   4  14.582  -6.728   0.613
   24    HG3  MET   4           HG3      MET   4  13.340  -7.845   0.046
   25    HE1  MET   4           HE1      MET   4  11.366  -7.142  -1.609
   26    HE2  MET   4           HE2      MET   4  10.901  -5.849  -0.505
   27    HE3  MET   4           HE3      MET   4  11.144  -5.499  -2.215
   28    H    GLU   5           H        GLU   5  11.397  -3.082   2.561
   29    HA   GLU   5           HA       GLU   5  10.840  -3.829   5.325
   30    HB2  GLU   5           HB2      GLU   5  10.082  -1.373   3.728
   31    HB3  GLU   5           HB3      GLU   5   9.733  -1.606   5.434
   32    HG2  GLU   5           HG2      GLU   5  12.521  -1.628   4.317
   33    HG3  GLU   5           HG3      GLU   5  11.719  -0.164   4.882
   34    H    GLN   6           H        GLN   6   9.180  -5.189   5.667
   35    HA   GLN   6           HA       GLN   6   6.843  -5.005   3.894
   36    HB2  GLN   6           HB2      GLN   6   7.865  -7.252   4.230
   37    HB3  GLN   6           HB3      GLN   6   7.475  -7.133   5.941
   38    HG2  GLN   6           HG2      GLN   6   5.086  -6.910   5.334
   39    HG3  GLN   6           HG3      GLN   6   5.525  -7.175   3.650
   40   HE21  GLN   6          1HE2      GLN   6   7.059  -8.814   6.323
   41   HE22  GLN   6          2HE2      GLN   6   6.416 -10.383   5.982
   42    H    LEU   7           H        LEU   7   5.231  -3.787   4.570
   43    HA   LEU   7           HA       LEU   7   4.754  -3.584   7.467
   44    HB2  LEU   7           HB2      LEU   7   4.643  -1.382   5.411
   45    HB3  LEU   7           HB3      LEU   7   4.022  -1.225   7.043
   46    HG   LEU   7           HG       LEU   7   6.909  -1.764   6.330
   47   HD11  LEU   7          2HD1      LEU   7   5.566   0.752   7.303
   48   HD12  LEU   7          1HD1      LEU   7   6.219   0.482   5.688
   49   HD13  LEU   7          3HD1      LEU   7   7.300   0.525   7.081
   50   HD21  LEU   7          3HD2      LEU   7   6.269  -2.721   8.480
   51   HD22  LEU   7          2HD2      LEU   7   5.596  -1.169   8.979
   52   HD23  LEU   7          1HD2      LEU   7   7.329  -1.328   8.698
   53    H    THR   8           H        THR   8   2.647  -3.463   8.149
   54    HA   THR   8           HA       THR   8   0.603  -4.000   6.094
   55    HB   THR   8           HB       THR   8   0.497  -4.666   9.046
   56    HG1  THR   8           HG1      THR   8   1.754  -5.901   7.019
   57   HG21  THR   8          3HG2      THR   8  -1.298  -5.470   6.750
   58   HG22  THR   8          1HG2      THR   8  -1.710  -4.338   8.040
   59   HG23  THR   8          2HG2      THR   8  -1.439  -6.042   8.412
   60    H    LEU   9           H        LEU   9  -0.306  -2.096   5.606
   61    HA   LEU   9           HA       LEU   9  -0.819  -0.160   7.730
   62    HB2  LEU   9           HB2      LEU   9  -1.592   1.294   5.793
   63    HB3  LEU   9           HB3      LEU   9   0.116   0.928   5.868
   64    HG   LEU   9           HG       LEU   9  -1.658  -0.765   4.152
   65   HD11  LEU   9          2HD1      LEU   9  -0.536   1.924   3.365
   66   HD12  LEU   9          1HD1      LEU   9  -2.244   1.550   3.596
   67   HD13  LEU   9          3HD1      LEU   9  -1.341   0.777   2.293
   68   HD21  LEU   9          3HD2      LEU   9   0.378  -0.919   2.804
   69   HD22  LEU   9          2HD2      LEU   9   0.681  -1.404   4.473
   70   HD23  LEU   9          1HD2      LEU   9   1.199   0.185   3.908
   71    H    GLN  10           H        GLN  10  -2.832   0.428   8.394
   72    HA   GLN  10           HA       GLN  10  -5.071  -1.201   7.509
   73    HB2  GLN  10           HB2      GLN  10  -6.377   0.026   9.187
   74    HB3  GLN  10           HB3      GLN  10  -4.898  -0.615   9.887
   75    HG2  GLN  10           HG2      GLN  10  -3.889   1.488   9.961
   76    HG3  GLN  10           HG3      GLN  10  -5.106   2.204   8.906
   77   HE21  GLN  10          1HE2      GLN  10  -5.634   3.815  10.373
   78   HE22  GLN  10          2HE2      GLN  10  -6.493   3.488  11.844
   79    H    VAL  11           H        VAL  11  -6.908  -0.387   6.421
   80    HA   VAL  11           HA       VAL  11  -6.545   2.271   5.239
   81    HB   VAL  11           HB       VAL  11  -5.801   0.973   3.462
   82   HG11  VAL  11          2HG1      VAL  11  -8.015  -0.986   4.042
   83   HG12  VAL  11          1HG1      VAL  11  -6.298  -1.217   4.375
   84   HG13  VAL  11          3HG1      VAL  11  -6.868  -1.106   2.707
   85   HG21  VAL  11          3HG2      VAL  11  -7.549   2.490   2.723
   86   HG22  VAL  11          2HG2      VAL  11  -8.771   1.254   3.030
   87   HG23  VAL  11          1HG2      VAL  11  -7.569   1.010   1.762
   88    H    GLU  12           H        GLU  12  -8.149   3.443   5.937
   89    HA   GLU  12           HA       GLU  12 -10.782   2.312   6.372
   90    HB2  GLU  12           HB2      GLU  12  -9.626   5.069   6.778
   91    HB3  GLU  12           HB3      GLU  12 -11.322   4.693   7.053
   92    HG2  GLU  12           HG2      GLU  12  -9.072   3.255   8.428
   93    HG3  GLU  12           HG3      GLU  12  -9.856   4.689   9.085
   94    H    GLY  13           H        GLY  13 -12.036   2.000   4.692
   95    HA2  GLY  13           HA1      GLY  13 -13.366   3.827   3.262
   96    HA3  GLY  13           HA2      GLY  13 -11.878   3.681   2.337
   97    H    MET  14           H        MET  14 -11.794   2.190   0.843
   98    HA   MET  14           HA       MET  14 -12.263   0.456  -0.501
   99    HB2  MET  14           HB2      MET  14 -13.190  -0.721   2.108
  100    HB3  MET  14           HB3      MET  14 -13.189  -1.606   0.599
  101    HG2  MET  14           HG2      MET  14 -10.786  -1.354   0.415
  102    HG3  MET  14           HG3      MET  14 -10.766  -0.407   1.903
  103    HE1  MET  14           HE1      MET  14  -8.811  -2.159   2.467
  104    HE2  MET  14           HE2      MET  14  -9.092  -3.853   2.864
  105    HE3  MET  14           HE3      MET  14  -9.125  -3.324   1.181
  106    H    SER  15           H        SER  15 -14.284  -1.302  -0.758
  107    HA   SER  15           HA       SER  15 -16.850  -0.049  -0.501
  108    HB2  SER  15           HB2      SER  15 -17.251  -0.093  -3.008
  109    HB3  SER  15           HB3      SER  15 -16.165   1.175  -2.441
  110    HG   SER  15           HG       SER  15 -15.179   0.249  -4.181
  111    H    CYS  16           H        CYS  16 -15.577  -2.265  -2.946
  112    HA   CYS  16           HA       CYS  16 -16.423  -4.584  -1.440
  113    HB2  CYS  16           HB2      CYS  16 -18.493  -3.955  -2.621
  114    HB3  CYS  16           HB3      CYS  16 -17.630  -3.982  -4.153
  115    HG   CYS  16           HG       CYS  16 -19.408  -6.287  -3.433
  116    H    GLY  17           H        GLY  17 -15.476  -3.553  -4.734
  117    HA2  GLY  17           HA1      GLY  17 -13.184  -5.387  -4.518
  118    HA3  GLY  17           HA2      GLY  17 -14.269  -5.531  -5.892
  119    H    HIS  18           H        HIS  18 -14.675  -2.623  -6.134
  120    HA   HIS  18           HA       HIS  18 -12.609  -2.172  -8.000
  121    HB2  HIS  18           HB2      HIS  18 -14.915  -1.163  -8.076
  122    HB3  HIS  18           HB3      HIS  18 -14.407  -0.059  -6.803
  123    HD1  HIS  18           HD1      HIS  18 -14.442  -0.482 -10.419
  124    HD2  HIS  18           HD2      HIS  18 -12.235   1.723  -7.661
  125    HE1  HIS  18           HE1      HIS  18 -13.289   1.318 -11.749
  126    HE2  HIS  18           HE2      HIS  18 -11.933   2.628 -10.072
  127    H    CYS  19           H        CYS  19 -13.187  -0.691  -4.801
  128    HA   CYS  19           HA       CYS  19 -10.875   0.912  -4.806
  129    HB2  CYS  19           HB2      CYS  19 -12.457  -0.226  -2.499
  130    HB3  CYS  19           HB3      CYS  19 -11.171   0.962  -2.316
  131    HG   CYS  19           HG       CYS  19 -12.908   2.446  -4.438
  132    H    VAL  20           H        VAL  20 -11.322  -2.455  -4.237
  133    HA   VAL  20           HA       VAL  20  -9.084  -3.023  -2.635
  134    HB   VAL  20           HB       VAL  20 -10.431  -4.775  -4.701
  135   HG11  VAL  20          2HG1      VAL  20  -9.508  -6.657  -3.446
  136   HG12  VAL  20          1HG1      VAL  20  -8.644  -5.533  -2.396
  137   HG13  VAL  20          3HG1      VAL  20  -8.234  -5.633  -4.109
  138   HG21  VAL  20          3HG2      VAL  20 -11.671  -5.696  -2.804
  139   HG22  VAL  20          2HG2      VAL  20 -11.987  -3.974  -3.019
  140   HG23  VAL  20          1HG2      VAL  20 -10.904  -4.520  -1.737
  141    H    ASN  21           H        ASN  21  -9.477  -3.393  -6.166
  142    HA   ASN  21           HA       ASN  21  -6.677  -3.812  -6.568
  143    HB2  ASN  21           HB2      ASN  21  -8.911  -3.247  -8.525
  144    HB3  ASN  21           HB3      ASN  21  -7.257  -3.620  -9.000
  145   HD21  ASN  21          1HD2      ASN  21  -6.450  -5.704  -8.653
  146   HD22  ASN  21          2HD2      ASN  21  -7.498  -7.048  -8.368
  147    H    ALA  22           H        ALA  22  -8.746  -1.043  -6.443
  148    HA   ALA  22           HA       ALA  22  -7.152   0.810  -7.821
  149    HB1  ALA  22           HB1      ALA  22  -9.441   1.310  -7.139
  150    HB2  ALA  22           HB2      ALA  22  -8.946   1.294  -5.447
  151    HB3  ALA  22           HB3      ALA  22  -8.319   2.532  -6.535
  152    H    ILE  23           H        ILE  23  -7.303   0.171  -4.295
  153    HA   ILE  23           HA       ILE  23  -5.044   1.806  -3.754
  154    HB   ILE  23           HB       ILE  23  -6.689   1.350  -2.006
  155   HG12  ILE  23          2HG1      ILE  23  -3.947   0.261  -1.330
  156   HG13  ILE  23          3HG1      ILE  23  -4.386   1.965  -1.382
  157   HG21  ILE  23          2HG2      ILE  23  -5.664  -1.485  -2.094
  158   HG22  ILE  23          1HG2      ILE  23  -7.278  -0.938  -2.548
  159   HG23  ILE  23          3HG2      ILE  23  -6.751  -0.833  -0.867
  160   HD11  ILE  23          3HD1      ILE  23  -5.940   1.625   0.460
  161   HD12  ILE  23          2HD1      ILE  23  -4.305   1.127   0.897
  162   HD13  ILE  23          1HD1      ILE  23  -5.522  -0.087   0.501
  163    H    GLU  24           H        GLU  24  -5.469  -1.620  -4.419
  164    HA   GLU  24           HA       GLU  24  -2.974  -2.602  -3.751
  165    HB2  GLU  24           HB2      GLU  24  -4.720  -4.096  -4.485
  166    HB3  GLU  24           HB3      GLU  24  -4.760  -3.341  -6.076
  167    HG2  GLU  24           HG2      GLU  24  -2.485  -4.150  -6.500
  168    HG3  GLU  24           HG3      GLU  24  -2.476  -4.934  -4.921
  169    H    SER  25           H        SER  25  -3.967  -1.224  -6.904
  170    HA   SER  25           HA       SER  25  -1.280  -1.209  -7.856
  171    HB2  SER  25           HB2      SER  25  -2.212   0.329  -9.642
  172    HB3  SER  25           HB3      SER  25  -2.888  -1.306  -9.563
  173    HG   SER  25           HG       SER  25  -4.722  -0.516  -8.615
  174    H    SER  26           H        SER  26  -3.257   1.130  -6.130
  175    HA   SER  26           HA       SER  26  -1.870   3.461  -6.702
  176    HB2  SER  26           HB2      SER  26  -3.119   2.611  -4.078
  177    HB3  SER  26           HB3      SER  26  -2.579   4.250  -4.438
  178    HG   SER  26           HG       SER  26  -4.491   2.828  -5.989
  179    H    VAL  27           H        VAL  27  -1.114   0.963  -4.291
  180    HA   VAL  27           HA       VAL  27   1.415   2.232  -3.668
  181    HB   VAL  27           HB       VAL  27   0.319   1.034  -1.911
  182   HG11  VAL  27          2HG1      VAL  27   0.521  -1.424  -3.603
  183   HG12  VAL  27          1HG1      VAL  27  -0.958  -0.562  -3.177
  184   HG13  VAL  27          3HG1      VAL  27  -0.019  -1.373  -1.924
  185   HG21  VAL  27          3HG2      VAL  27   2.725   1.041  -1.816
  186   HG22  VAL  27          2HG2      VAL  27   2.790  -0.407  -2.820
  187   HG23  VAL  27          1HG2      VAL  27   2.114  -0.493  -1.194
  188    H    LYS  28           H        LYS  28   0.293  -0.578  -5.459
  189    HA   LYS  28           HA       LYS  28   2.752  -1.758  -6.028
  190    HB2  LYS  28           HB2      LYS  28   0.284  -2.541  -6.471
  191    HB3  LYS  28           HB3      LYS  28   0.566  -1.852  -8.062
  192    HG2  LYS  28           HG2      LYS  28   2.411  -3.881  -6.848
  193    HG3  LYS  28           HG3      LYS  28   0.988  -4.335  -7.783
  194    HD2  LYS  28           HD2      LYS  28   1.840  -3.231  -9.731
  195    HD3  LYS  28           HD3      LYS  28   3.181  -2.542  -8.812
  196    HE2  LYS  28           HE2      LYS  28   2.718  -5.487  -9.249
  197    HE3  LYS  28           HE3      LYS  28   3.835  -4.495 -10.187
  198    HZ1  LYS  28           HZ1      LYS  28   3.982  -5.051  -7.272
  199    HZ2  LYS  28           HZ2      LYS  28   5.020  -3.998  -8.104
  200    HZ3  LYS  28           HZ3      LYS  28   5.022  -5.656  -8.466
  201    H    GLU  29           H        GLU  29   1.073   0.808  -7.825
  202    HA   GLU  29           HA       GLU  29   2.750   0.850 -10.085
  203    HB2  GLU  29           HB2      GLU  29   1.115   3.029  -8.794
  204    HB3  GLU  29           HB3      GLU  29   1.981   3.249 -10.305
  205    HG2  GLU  29           HG2      GLU  29   0.654   1.332 -11.230
  206    HG3  GLU  29           HG3      GLU  29  -0.306   1.374  -9.751
  207    H    LEU  30           H        LEU  30   3.189   1.975  -6.879
  208    HA   LEU  30           HA       LEU  30   5.162   3.944  -7.343
  209    HB2  LEU  30           HB2      LEU  30   4.286   2.353  -5.002
  210    HB3  LEU  30           HB3      LEU  30   5.910   3.007  -4.921
  211    HG   LEU  30           HG       LEU  30   4.240   4.460  -3.828
  212   HD11  LEU  30          2HD1      LEU  30   5.478   5.659  -6.299
  213   HD12  LEU  30          1HD1      LEU  30   6.290   5.408  -4.752
  214   HD13  LEU  30          3HD1      LEU  30   4.942   6.540  -4.867
  215   HD21  LEU  30          3HD2      LEU  30   2.334   3.962  -5.281
  216   HD22  LEU  30          2HD2      LEU  30   3.128   4.807  -6.609
  217   HD23  LEU  30          1HD2      LEU  30   2.632   5.697  -5.170
  218    H    ASN  31           H        ASN  31   7.234   3.834  -7.844
  219    HA   ASN  31           HA       ASN  31   8.354   1.364  -8.719
  220    HB2  ASN  31           HB2      ASN  31   8.829   3.514  -9.821
  221    HB3  ASN  31           HB3      ASN  31   9.653   4.076  -8.371
  222   HD21  ASN  31          1HD2      ASN  31  11.590   4.381  -9.383
  223   HD22  ASN  31          2HD2      ASN  31  12.583   3.076  -9.941
  224    H    GLY  32           H        GLY  32   9.100  -0.123  -7.373
  225    HA2  GLY  32           HA1      GLY  32  11.020  -0.649  -5.910
  226    HA3  GLY  32           HA2      GLY  32  10.584   0.781  -4.983
  227    H    VAL  33           H        VAL  33   7.968  -1.079  -6.173
  228    HA   VAL  33           HA       VAL  33   7.522  -2.111  -3.463
  229    HB   VAL  33           HB       VAL  33   5.574  -1.438  -5.669
  230   HG11  VAL  33          2HG1      VAL  33   4.997  -2.786  -3.030
  231   HG12  VAL  33          1HG1      VAL  33   4.880  -3.537  -4.621
  232   HG13  VAL  33          3HG1      VAL  33   3.795  -2.216  -4.189
  233   HG21  VAL  33          3HG2      VAL  33   4.666   0.079  -3.963
  234   HG22  VAL  33          2HG2      VAL  33   6.354   0.432  -4.330
  235   HG23  VAL  33          1HG2      VAL  33   5.935  -0.431  -2.851
  236    H    GLU  34           H        GLU  34   7.690  -4.192  -3.123
  237    HA   GLU  34           HA       GLU  34   8.322  -5.965  -5.292
  238    HB2  GLU  34           HB2      GLU  34   9.524  -6.119  -3.183
  239    HB3  GLU  34           HB3      GLU  34   8.028  -6.445  -2.323
  240    HG2  GLU  34           HG2      GLU  34   9.374  -8.454  -2.654
  241    HG3  GLU  34           HG3      GLU  34   7.806  -8.567  -3.448
  242    H    GLN  35           H        GLN  35   5.947  -6.262  -2.646
  243    HA   GLN  35           HA       GLN  35   4.047  -7.375  -4.568
  244    HB2  GLN  35           HB2      GLN  35   3.470  -9.201  -3.023
  245    HB3  GLN  35           HB3      GLN  35   5.134  -9.309  -3.583
  246    HG2  GLN  35           HG2      GLN  35   5.942  -8.426  -1.517
  247    HG3  GLN  35           HG3      GLN  35   4.304  -8.123  -0.948
  248   HE21  GLN  35          1HE2      GLN  35   3.310 -10.639  -2.060
  249   HE22  GLN  35          2HE2      GLN  35   3.876 -11.887  -1.000
  250    H    VAL  36           H        VAL  36   1.868  -7.240  -3.933
  251    HA   VAL  36           HA       VAL  36   1.327  -5.576  -1.564
  252    HB   VAL  36           HB       VAL  36  -0.093  -5.352  -4.223
  253   HG11  VAL  36          2HG1      VAL  36  -1.544  -4.891  -2.337
  254   HG12  VAL  36          1HG1      VAL  36  -1.187  -3.404  -3.215
  255   HG13  VAL  36          3HG1      VAL  36  -0.370  -3.745  -1.690
  256   HG21  VAL  36          3HG2      VAL  36   2.158  -4.434  -4.372
  257   HG22  VAL  36          2HG2      VAL  36   1.865  -3.453  -2.936
  258   HG23  VAL  36          1HG2      VAL  36   0.954  -3.146  -4.415
  259    H    LYS  37           H        LYS  37   0.056  -6.646  -0.201
  260    HA   LYS  37           HA       LYS  37  -1.971  -8.466  -1.324
  261    HB2  LYS  37           HB2      LYS  37  -0.677  -8.490   1.411
  262    HB3  LYS  37           HB3      LYS  37  -1.990  -9.548   0.914
  263    HG2  LYS  37           HG2      LYS  37  -0.567 -10.546  -0.780
  264    HG3  LYS  37           HG3      LYS  37   0.748  -9.461  -0.329
  265    HD2  LYS  37           HD2      LYS  37   1.191 -11.533   0.736
  266    HD3  LYS  37           HD3      LYS  37   0.608 -10.441   1.989
  267    HE2  LYS  37           HE2      LYS  37  -1.164 -12.411   0.558
  268    HE3  LYS  37           HE3      LYS  37  -0.310 -12.792   2.050
  269    HZ1  LYS  37           HZ1      LYS  37  -2.420 -10.739   1.658
  270    HZ2  LYS  37           HZ2      LYS  37  -1.488 -10.858   3.069
  271    HZ3  LYS  37           HZ3      LYS  37  -2.505 -12.136   2.612
  272    H    VAL  38           H        VAL  38  -3.595  -6.953  -1.622
  273    HA   VAL  38           HA       VAL  38  -4.410  -5.310   0.621
  274    HB   VAL  38           HB       VAL  38  -4.628  -4.318  -1.572
  275   HG11  VAL  38          2HG1      VAL  38  -4.897  -6.255  -2.965
  276   HG12  VAL  38          1HG1      VAL  38  -6.274  -5.182  -3.211
  277   HG13  VAL  38          3HG1      VAL  38  -6.451  -6.625  -2.216
  278   HG21  VAL  38          3HG2      VAL  38  -6.247  -3.621   0.078
  279   HG22  VAL  38          2HG2      VAL  38  -7.318  -4.949  -0.372
  280   HG23  VAL  38          1HG2      VAL  38  -6.993  -3.650  -1.520
  281    H    GLN  39           H        GLN  39  -5.821  -5.863   2.117
  282    HA   GLN  39           HA       GLN  39  -7.221  -8.429   1.798
  283    HB2  GLN  39           HB2      GLN  39  -6.517  -6.935   4.336
  284    HB3  GLN  39           HB3      GLN  39  -7.179  -8.561   4.229
  285    HG2  GLN  39           HG2      GLN  39  -5.194  -9.482   3.570
  286    HG3  GLN  39           HG3      GLN  39  -4.619  -7.989   2.834
  287   HE21  GLN  39          1HE2      GLN  39  -4.927  -9.796   5.777
  288   HE22  GLN  39          2HE2      GLN  39  -3.844  -8.829   6.717
  289    H    LEU  40           H        LEU  40  -9.153  -7.834   0.893
  290    HA   LEU  40           HA       LEU  40 -10.599  -5.492   1.511
  291    HB2  LEU  40           HB2      LEU  40 -10.841  -6.808  -0.573
  292    HB3  LEU  40           HB3      LEU  40 -11.587  -8.100   0.340
  293    HG   LEU  40           HG       LEU  40 -13.080  -6.513  -1.046
  294   HD11  LEU  40          2HD1      LEU  40 -13.967  -8.178   0.492
  295   HD12  LEU  40          1HD1      LEU  40 -14.903  -6.685   0.574
  296   HD13  LEU  40          3HD1      LEU  40 -13.740  -7.068   1.842
  297   HD21  LEU  40          3HD2      LEU  40 -13.854  -4.524   0.150
  298   HD22  LEU  40          2HD2      LEU  40 -12.142  -4.410  -0.259
  299   HD23  LEU  40          1HD2      LEU  40 -12.631  -4.794   1.391
  300    H    ALA  41           H        ALA  41 -10.636  -8.729   2.870
  301    HA   ALA  41           HA       ALA  41 -13.067  -8.338   4.347
  302    HB1  ALA  41           HB1      ALA  41 -12.347 -10.554   3.591
  303    HB2  ALA  41           HB2      ALA  41 -10.945 -10.457   4.657
  304    HB3  ALA  41           HB3      ALA  41 -12.569 -10.503   5.340
  305    H    GLU  42           H        GLU  42  -9.709  -7.702   4.930
  306    HA   GLU  42           HA       GLU  42 -10.181  -7.520   7.819
  307    HB2  GLU  42           HB2      GLU  42  -7.593  -7.557   6.268
  308    HB3  GLU  42           HB3      GLU  42  -7.722  -7.455   8.018
  309    HG2  GLU  42           HG2      GLU  42  -8.879  -9.630   8.034
  310    HG3  GLU  42           HG3      GLU  42  -8.643  -9.740   6.291
  311    H    GLY  43           H        GLY  43  -9.649  -5.562   5.038
  312    HA2  GLY  43           HA1      GLY  43  -9.700  -3.270   4.826
  313    HA3  GLY  43           HA2      GLY  43 -10.002  -3.161   6.553
  314    H    THR  44           H        THR  44  -7.293  -4.887   5.236
  315    HA   THR  44           HA       THR  44  -5.494  -2.673   5.917
  316    HB   THR  44           HB       THR  44  -3.886  -4.404   6.841
  317    HG1  THR  44           HG1      THR  44  -4.681  -6.352   6.301
  318   HG21  THR  44          3HG2      THR  44  -5.112  -2.876   8.303
  319   HG22  THR  44          1HG2      THR  44  -4.930  -4.459   9.054
  320   HG23  THR  44          2HG2      THR  44  -6.475  -3.997   8.339
  321    H    VAL  45           H        VAL  45  -3.275  -3.044   5.014
  322    HA   VAL  45           HA       VAL  45  -3.292  -4.753   2.621
  323    HB   VAL  45           HB       VAL  45  -2.277  -1.897   2.644
  324   HG11  VAL  45          2HG1      VAL  45  -0.997  -3.313   1.160
  325   HG12  VAL  45          1HG1      VAL  45  -2.032  -2.245   0.212
  326   HG13  VAL  45          3HG1      VAL  45  -2.478  -3.936   0.431
  327   HG21  VAL  45          3HG2      VAL  45  -4.127  -1.377   1.154
  328   HG22  VAL  45          2HG2      VAL  45  -4.732  -1.990   2.692
  329   HG23  VAL  45          1HG2      VAL  45  -4.713  -3.036   1.273
  330    H    GLU  46           H        GLU  46  -1.570  -6.023   2.585
  331    HA   GLU  46           HA       GLU  46   0.750  -5.355   4.251
  332    HB2  GLU  46           HB2      GLU  46   0.055  -7.933   2.833
  333    HB3  GLU  46           HB3      GLU  46   1.395  -7.699   3.948
  334    HG2  GLU  46           HG2      GLU  46  -0.183  -7.266   5.751
  335    HG3  GLU  46           HG3      GLU  46  -1.522  -7.463   4.621
  336    H    VAL  47           H        VAL  47   2.411  -4.370   3.278
  337    HA   VAL  47           HA       VAL  47   2.909  -5.005   0.442
  338    HB   VAL  47           HB       VAL  47   3.219  -2.270   1.696
  339   HG11  VAL  47          2HG1      VAL  47   3.637  -1.519  -0.598
  340   HG12  VAL  47          1HG1      VAL  47   3.549  -3.189  -1.158
  341   HG13  VAL  47          3HG1      VAL  47   4.842  -2.693  -0.065
  342   HG21  VAL  47          3HG2      VAL  47   1.149  -3.277  -0.254
  343   HG22  VAL  47          2HG2      VAL  47   1.343  -1.603   0.267
  344   HG23  VAL  47          1HG2      VAL  47   0.867  -2.839   1.431
  345    H    THR  48           H        THR  48   4.880  -5.701   0.037
  346    HA   THR  48           HA       THR  48   7.048  -5.126   1.935
  347    HB   THR  48           HB       THR  48   7.123  -7.040  -0.411
  348    HG1  THR  48           HG1      THR  48   6.588  -8.660   1.070
  349   HG21  THR  48          3HG2      THR  48   8.985  -8.047   0.833
  350   HG22  THR  48          1HG2      THR  48   8.810  -6.818   2.086
  351   HG23  THR  48          2HG2      THR  48   9.304  -6.354   0.457
  352    H    ILE  49           H        ILE  49   8.375  -3.474   1.426
  353    HA   ILE  49           HA       ILE  49   8.475  -2.634  -1.403
  354    HB   ILE  49           HB       ILE  49   8.858  -0.359  -0.674
  355   HG12  ILE  49          2HG1      ILE  49   8.416  -1.206   2.183
  356   HG13  ILE  49          3HG1      ILE  49  10.033  -1.183   1.487
  357   HG21  ILE  49          2HG2      ILE  49   6.508  -1.598   0.752
  358   HG22  ILE  49          1HG2      ILE  49   6.551  -1.080  -0.934
  359   HG23  ILE  49          3HG2      ILE  49   6.688   0.113   0.359
  360   HD11  ILE  49          3HD1      ILE  49   9.640   0.845   2.704
  361   HD12  ILE  49          2HD1      ILE  49   8.168   1.161   1.781
  362   HD13  ILE  49          1HD1      ILE  49   9.741   1.208   0.982
  363    H    ASP  50           H        ASP  50  10.401  -1.661  -2.155
  364    HA   ASP  50           HA       ASP  50  12.854  -2.505  -0.807
  365    HB2  ASP  50           HB2      ASP  50  12.597  -2.815  -3.290
  366    HB3  ASP  50           HB3      ASP  50  12.500  -1.066  -3.457
  367    H    SER  51           H        SER  51  13.382  -1.155   0.810
  368    HA   SER  51           HA       SER  51  12.435   1.557   0.819
  369    HB2  SER  51           HB2      SER  51  12.387   0.307   2.878
  370    HB3  SER  51           HB3      SER  51  14.112  -0.010   2.781
  371    HG   SER  51           HG       SER  51  14.057   2.523   2.708
  372    H    SER  52           H        SER  52  15.008   0.184  -0.677
  373    HA   SER  52           HA       SER  52  16.829   2.411  -0.231
  374    HB2  SER  52           HB2      SER  52  17.061  -0.035  -1.999
  375    HB3  SER  52           HB3      SER  52  18.337   1.165  -1.741
  376    HG   SER  52           HG       SER  52  17.240  -0.706   0.065
  377    H    VAL  53           H        VAL  53  14.241   1.591  -2.177
  378    HA   VAL  53           HA       VAL  53  15.057   3.510  -4.255
  379    HB   VAL  53           HB       VAL  53  13.081   1.236  -4.487
  380   HG11  VAL  53          2HG1      VAL  53  13.080   1.780  -6.883
  381   HG12  VAL  53          1HG1      VAL  53  14.098   3.182  -6.553
  382   HG13  VAL  53          3HG1      VAL  53  12.460   3.108  -5.899
  383   HG21  VAL  53          3HG2      VAL  53  14.744   0.188  -5.922
  384   HG22  VAL  53          2HG2      VAL  53  15.414   0.491  -4.315
  385   HG23  VAL  53          1HG2      VAL  53  15.841   1.546  -5.664
  386    H    VAL  54           H        VAL  54  12.094   2.232  -2.700
  387    HA   VAL  54           HA       VAL  54  10.868   4.865  -3.152
  388    HB   VAL  54           HB       VAL  54   9.746   2.815  -4.111
  389   HG11  VAL  54          2HG1      VAL  54   8.420   1.419  -2.593
  390   HG12  VAL  54          1HG1      VAL  54   9.163   2.231  -1.215
  391   HG13  VAL  54          3HG1      VAL  54  10.153   1.259  -2.304
  392   HG21  VAL  54          3HG2      VAL  54   7.483   3.503  -3.456
  393   HG22  VAL  54          2HG2      VAL  54   8.523   4.883  -3.812
  394   HG23  VAL  54          1HG2      VAL  54   8.166   4.455  -2.138
  395    H    THR  55           H        THR  55   9.543   5.772  -1.414
  396    HA   THR  55           HA       THR  55  10.489   4.949   1.249
  397    HB   THR  55           HB       THR  55  10.035   7.175   2.038
  398    HG1  THR  55           HG1      THR  55   9.266   8.117  -0.508
  399   HG21  THR  55          3HG2      THR  55  12.177   6.902   0.908
  400   HG22  THR  55          1HG2      THR  55  11.539   8.523   0.637
  401   HG23  THR  55          2HG2      THR  55  11.430   7.308  -0.638
  402    H    LEU  56           H        LEU  56   8.897   5.127   3.016
  403    HA   LEU  56           HA       LEU  56   6.418   3.920   2.325
  404    HB2  LEU  56           HB2      LEU  56   7.512   3.496   4.467
  405    HB3  LEU  56           HB3      LEU  56   7.334   5.183   4.910
  406    HG   LEU  56           HG       LEU  56   4.870   4.903   4.882
  407   HD11  LEU  56          2HD1      LEU  56   4.759   3.034   3.304
  408   HD12  LEU  56          1HD1      LEU  56   3.907   2.677   4.806
  409   HD13  LEU  56          3HD1      LEU  56   5.498   1.977   4.507
  410   HD21  LEU  56          3HD2      LEU  56   6.088   4.727   6.971
  411   HD22  LEU  56          2HD2      LEU  56   6.375   3.011   6.682
  412   HD23  LEU  56          1HD2      LEU  56   4.733   3.599   6.952
  413    H    LYS  57           H        LYS  57   7.437   7.198   3.028
  414    HA   LYS  57           HA       LYS  57   4.884   8.293   3.494
  415    HB2  LYS  57           HB2      LYS  57   7.386   9.239   3.790
  416    HB3  LYS  57           HB3      LYS  57   6.938  10.053   2.296
  417    HG2  LYS  57           HG2      LYS  57   5.287  10.130   4.807
  418    HG3  LYS  57           HG3      LYS  57   6.486  11.352   4.383
  419    HD2  LYS  57           HD2      LYS  57   4.121  10.620   2.653
  420    HD3  LYS  57           HD3      LYS  57   4.126  11.956   3.808
  421    HE2  LYS  57           HE2      LYS  57   6.032  11.657   1.486
  422    HE3  LYS  57           HE3      LYS  57   4.596  12.680   1.492
  423    HZ1  LYS  57           HZ1      LYS  57   6.512  14.005   1.986
  424    HZ2  LYS  57           HZ2      LYS  57   6.985  12.967   3.242
  425    HZ3  LYS  57           HZ3      LYS  57   5.571  13.890   3.390
  426    H    ASP  58           H        ASP  58   6.846   8.034   0.538
  427    HA   ASP  58           HA       ASP  58   5.159   9.491  -1.156
  428    HB2  ASP  58           HB2      ASP  58   7.081   7.235  -1.667
  429    HB3  ASP  58           HB3      ASP  58   6.096   7.889  -2.971
  430    H    ILE  59           H        ILE  59   5.123   6.110  -0.211
  431    HA   ILE  59           HA       ILE  59   2.991   5.298  -1.874
  432    HB   ILE  59           HB       ILE  59   3.983   4.153   0.737
  433   HG12  ILE  59          2HG1      ILE  59   4.504   3.340  -2.131
  434   HG13  ILE  59          3HG1      ILE  59   5.631   4.220  -1.105
  435   HG21  ILE  59          2HG2      ILE  59   1.697   3.438   0.320
  436   HG22  ILE  59          1HG2      ILE  59   2.818   2.097   0.087
  437   HG23  ILE  59          3HG2      ILE  59   2.137   2.930  -1.310
  438   HD11  ILE  59          3HD1      ILE  59   6.195   1.863  -1.256
  439   HD12  ILE  59          2HD1      ILE  59   4.613   1.436  -0.606
  440   HD13  ILE  59          1HD1      ILE  59   5.769   2.316   0.395
  441    H    VAL  60           H        VAL  60   3.067   6.206   1.580
  442    HA   VAL  60           HA       VAL  60   0.340   5.991   2.112
  443    HB   VAL  60           HB       VAL  60   2.382   7.884   3.290
  444   HG11  VAL  60          2HG1      VAL  60  -0.382   7.208   4.289
  445   HG12  VAL  60          1HG1      VAL  60   0.166   8.777   3.699
  446   HG13  VAL  60          3HG1      VAL  60   0.835   8.113   5.189
  447   HG21  VAL  60          3HG2      VAL  60   2.426   6.274   5.138
  448   HG22  VAL  60          2HG2      VAL  60   2.901   5.530   3.611
  449   HG23  VAL  60          1HG2      VAL  60   1.288   5.248   4.265
  450    H    ALA  61           H        ALA  61   2.204   8.727   0.858
  451    HA   ALA  61           HA       ALA  61   0.186  10.647   0.785
  452    HB1  ALA  61           HB1      ALA  61   1.539  11.783  -0.894
  453    HB2  ALA  61           HB2      ALA  61   2.547  11.159   0.413
  454    HB3  ALA  61           HB3      ALA  61   2.487  10.315  -1.136
  455    H    VAL  62           H        VAL  62   1.248   8.455  -1.822
  456    HA   VAL  62           HA       VAL  62  -0.625   9.287  -3.730
  457    HB   VAL  62           HB       VAL  62   0.750   6.608  -3.453
  458   HG11  VAL  62          2HG1      VAL  62  -0.691   7.775  -5.834
  459   HG12  VAL  62          1HG1      VAL  62  -1.228   6.402  -4.865
  460   HG13  VAL  62          3HG1      VAL  62   0.246   6.279  -5.826
  461   HG21  VAL  62          3HG2      VAL  62   2.263   7.500  -5.177
  462   HG22  VAL  62          2HG2      VAL  62   2.307   8.449  -3.691
  463   HG23  VAL  62          1HG2      VAL  62   1.422   9.048  -5.094
  464    H    ILE  63           H        ILE  63  -0.793   6.662  -1.340
  465    HA   ILE  63           HA       ILE  63  -3.212   5.550  -2.269
  466    HB   ILE  63           HB       ILE  63  -1.994   5.448   0.492
  467   HG12  ILE  63          2HG1      ILE  63  -1.962   3.466  -1.797
  468   HG13  ILE  63          3HG1      ILE  63  -0.604   4.462  -1.286
  469   HG21  ILE  63          2HG2      ILE  63  -4.372   4.994   0.616
  470   HG22  ILE  63          1HG2      ILE  63  -3.459   3.505   0.858
  471   HG23  ILE  63          3HG2      ILE  63  -4.240   3.818  -0.691
  472   HD11  ILE  63          3HD1      ILE  63  -0.380   2.199  -0.463
  473   HD12  ILE  63          2HD1      ILE  63  -1.940   2.321   0.348
  474   HD13  ILE  63          1HD1      ILE  63  -0.591   3.328   0.874
  475    H    GLU  64           H        GLU  64  -2.605   7.873   0.383
  476    HA   GLU  64           HA       GLU  64  -5.341   8.076   1.103
  477    HB2  GLU  64           HB2      GLU  64  -3.109  10.054   1.598
  478    HB3  GLU  64           HB3      GLU  64  -4.679  10.059   2.390
  479    HG2  GLU  64           HG2      GLU  64  -4.115   7.729   3.208
  480    HG3  GLU  64           HG3      GLU  64  -2.472   8.050   2.659
  481    H    ASP  65           H        ASP  65  -3.327   9.721  -1.208
  482    HA   ASP  65           HA       ASP  65  -5.038  11.853  -1.867
  483    HB2  ASP  65           HB2      ASP  65  -2.712  11.796  -2.578
  484    HB3  ASP  65           HB3      ASP  65  -3.016  10.366  -3.557
  485    H    GLN  66           H        GLN  66  -5.199   8.486  -2.544
  486    HA   GLN  66           HA       GLN  66  -7.064   8.751  -4.745
  487    HB2  GLN  66           HB2      GLN  66  -6.167   6.323  -3.188
  488    HB3  GLN  66           HB3      GLN  66  -7.181   6.285  -4.621
  489    HG2  GLN  66           HG2      GLN  66  -4.367   7.345  -4.534
  490    HG3  GLN  66           HG3      GLN  66  -4.823   5.728  -5.065
  491   HE21  GLN  66          1HE2      GLN  66  -4.027   6.013  -7.126
  492   HE22  GLN  66          2HE2      GLN  66  -4.788   7.043  -8.286
  493    H    GLY  67           H        GLY  67  -7.363   9.310  -1.564
  494    HA2  GLY  67           HA1      GLY  67  -9.398   9.823  -0.507
  495    HA3  GLY  67           HA2      GLY  67 -10.234   8.802  -1.667
  496    H    TYR  68           H        TYR  68  -7.482   8.063   0.434
  497    HA   TYR  68           HA       TYR  68  -9.172   6.148   1.896
  498    HB2  TYR  68           HB2      TYR  68  -6.337   5.655   0.934
  499    HB3  TYR  68           HB3      TYR  68  -7.252   4.586   1.988
  500    HD1  TYR  68           HD2      TYR  68  -6.968   5.874  -1.449
  501    HD2  TYR  68           HD1      TYR  68  -8.948   3.132   1.122
  502    HE1  TYR  68           HE2      TYR  68  -7.888   4.713  -3.408
  503    HE2  TYR  68           HE1      TYR  68  -9.874   1.959  -0.830
  504    HH   TYR  68           HH       TYR  68  -8.785   2.571  -4.020
  505    H    ASP  69           H        ASP  69  -8.540   5.770   4.055
  506    HA   ASP  69           HA       ASP  69  -6.524   7.646   5.113
  507    HB2  ASP  69           HB2      ASP  69  -8.800   8.027   6.015
  508    HB3  ASP  69           HB3      ASP  69  -8.850   6.360   6.578
  509    H    VAL  70           H        VAL  70  -4.671   6.494   5.155
  510    HA   VAL  70           HA       VAL  70  -4.846   3.717   6.114
  511    HB   VAL  70           HB       VAL  70  -2.714   3.304   4.877
  512   HG11  VAL  70          2HG1      VAL  70  -4.864   2.623   3.968
  513   HG12  VAL  70          1HG1      VAL  70  -3.776   3.137   2.679
  514   HG13  VAL  70          3HG1      VAL  70  -5.068   4.211   3.224
  515   HG21  VAL  70          3HG2      VAL  70  -3.313   5.969   3.597
  516   HG22  VAL  70          2HG2      VAL  70  -2.029   4.848   3.137
  517   HG23  VAL  70          1HG2      VAL  70  -1.978   5.647   4.711
  518    H    GLN  71           H        GLN  71  -2.845   2.883   7.130
  519    HA   GLN  71           HA       GLN  71  -1.046   4.693   8.402
  520    HB2  GLN  71           HB2      GLN  71  -3.132   5.101   9.692
  521    HB3  GLN  71           HB3      GLN  71  -3.174   3.399  10.118
  522    HG2  GLN  71           HG2      GLN  71  -1.223   3.591  11.442
  523    HG3  GLN  71           HG3      GLN  71  -0.885   5.210  10.827
  524   HE21  GLN  71          1HE2      GLN  71  -3.711   5.968  10.936
  525   HE22  GLN  71          2HE2      GLN  71  -4.051   6.272  12.603
  Start of MODEL   10
    1    H1   SER   1           H1       SER   1  21.824  -2.960  -0.389
    2    H2   SER   1           H2       SER   1  23.130  -2.405  -1.316
    3    H3   SER   1           H3       SER   1  22.324  -3.831  -1.756
    4    HA   SER   1           HA       SER   1  21.192  -1.096  -1.788
    5    HB2  SER   1           HB2      SER   1  21.789  -2.989  -4.078
    6    HB3  SER   1           HB3      SER   1  21.220  -1.324  -4.199
    7    HG   SER   1           HG       SER   1  23.220  -0.717  -4.106
    8    H    ASN   2           H        ASN   2  19.036  -0.939  -2.051
    9    HA   ASN   2           HA       ASN   2  16.840  -1.483  -2.112
   10    HB2  ASN   2           HB2      ASN   2  17.909  -3.770  -3.772
   11    HB3  ASN   2           HB3      ASN   2  16.190  -3.464  -3.541
   12   HD21  ASN   2          1HD2      ASN   2  15.207  -1.870  -4.678
   13   HD22  ASN   2          2HD2      ASN   2  16.015  -0.897  -5.870
   14    H    ALA   3           H        ALA   3  16.859  -1.787   0.174
   15    HA   ALA   3           HA       ALA   3  16.913  -4.540   1.139
   16    HB1  ALA   3           HB1      ALA   3  17.980  -2.773   2.483
   17    HB2  ALA   3           HB2      ALA   3  16.414  -1.981   2.665
   18    HB3  ALA   3           HB3      ALA   3  16.681  -3.581   3.360
   19    H    MET   4           H        MET   4  15.149  -5.753   1.163
   20    HA   MET   4           HA       MET   4  12.594  -4.562   0.520
   21    HB2  MET   4           HB2      MET   4  13.212  -7.462   1.087
   22    HB3  MET   4           HB3      MET   4  11.782  -6.826   0.288
   23    HG2  MET   4           HG2      MET   4  14.598  -6.896  -0.751
   24    HG3  MET   4           HG3      MET   4  13.185  -7.738  -1.381
   25    HE1  MET   4           HE1      MET   4  11.078  -4.745  -2.821
   26    HE2  MET   4           HE2      MET   4  11.149  -6.493  -2.608
   27    HE3  MET   4           HE3      MET   4  10.971  -5.439  -1.204
   28    H    GLU   5           H        GLU   5  11.145  -3.936   1.940
   29    HA   GLU   5           HA       GLU   5  11.188  -5.136   4.635
   30    HB2  GLU   5           HB2      GLU   5  10.564  -2.301   3.799
   31    HB3  GLU   5           HB3      GLU   5  10.223  -2.936   5.402
   32    HG2  GLU   5           HG2      GLU   5  12.945  -2.773   4.132
   33    HG3  GLU   5           HG3      GLU   5  12.303  -1.653   5.334
   34    H    GLN   6           H        GLN   6   9.234  -5.658   5.579
   35    HA   GLN   6           HA       GLN   6   6.875  -5.469   3.822
   36    HB2  GLN   6           HB2      GLN   6   7.620  -7.591   5.830
   37    HB3  GLN   6           HB3      GLN   6   6.028  -7.467   5.099
   38    HG2  GLN   6           HG2      GLN   6   7.008  -7.790   2.891
   39    HG3  GLN   6           HG3      GLN   6   8.609  -7.911   3.619
   40   HE21  GLN   6          1HE2      GLN   6   5.533  -9.463   3.181
   41   HE22  GLN   6          2HE2      GLN   6   6.013 -11.037   3.714
   42    H    LEU   7           H        LEU   7   5.415  -4.078   4.519
   43    HA   LEU   7           HA       LEU   7   5.172  -3.618   7.424
   44    HB2  LEU   7           HB2      LEU   7   4.894  -1.619   5.178
   45    HB3  LEU   7           HB3      LEU   7   4.432  -1.294   6.833
   46    HG   LEU   7           HG       LEU   7   6.517  -0.263   6.562
   47   HD11  LEU   7          2HD1      LEU   7   8.016  -1.455   8.052
   48   HD12  LEU   7          1HD1      LEU   7   7.080  -2.934   7.833
   49   HD13  LEU   7          3HD1      LEU   7   6.351  -1.538   8.630
   50   HD21  LEU   7          3HD2      LEU   7   8.495  -1.357   5.636
   51   HD22  LEU   7          2HD2      LEU   7   7.180  -1.291   4.463
   52   HD23  LEU   7          1HD2      LEU   7   7.541  -2.801   5.299
   53    H    THR   8           H        THR   8   3.036  -2.835   8.112
   54    HA   THR   8           HA       THR   8   0.872  -3.831   6.365
   55    HB   THR   8           HB       THR   8   0.866  -3.802   9.394
   56    HG1  THR   8           HG1      THR   8   2.134  -5.455   7.809
   57   HG21  THR   8          3HG2      THR   8  -1.358  -3.627   8.382
   58   HG22  THR   8          1HG2      THR   8  -1.136  -5.202   9.145
   59   HG23  THR   8          2HG2      THR   8  -1.026  -5.047   7.393
   60    H    LEU   9           H        LEU   9  -0.268  -2.186   5.595
   61    HA   LEU   9           HA       LEU   9  -0.392   0.318   7.123
   62    HB2  LEU   9           HB2      LEU   9  -0.966  -0.312   4.227
   63    HB3  LEU   9           HB3      LEU   9  -1.298   1.245   4.953
   64    HG   LEU   9           HG       LEU   9   1.159   1.440   5.463
   65   HD11  LEU   9          2HD1      LEU   9   2.700   0.032   4.179
   66   HD12  LEU   9          1HD1      LEU   9   1.344  -0.962   3.648
   67   HD13  LEU   9          3HD1      LEU   9   1.781  -0.907   5.355
   68   HD21  LEU   9          3HD2      LEU   9   0.127   2.586   3.590
   69   HD22  LEU   9          2HD2      LEU   9   0.338   1.156   2.578
   70   HD23  LEU   9          1HD2      LEU   9   1.749   2.042   3.164
   71    H    GLN  10           H        GLN  10  -2.285   1.046   7.981
   72    HA   GLN  10           HA       GLN  10  -4.652  -0.613   7.584
   73    HB2  GLN  10           HB2      GLN  10  -5.666   0.749   9.391
   74    HB3  GLN  10           HB3      GLN  10  -4.183  -0.051   9.881
   75    HG2  GLN  10           HG2      GLN  10  -2.981   1.932   9.923
   76    HG3  GLN  10           HG3      GLN  10  -4.168   2.786   8.937
   77   HE21  GLN  10          1HE2      GLN  10  -6.416   1.708  10.434
   78   HE22  GLN  10          2HE2      GLN  10  -6.459   2.582  11.924
   79    H    VAL  11           H        VAL  11  -6.339  -0.067   6.376
   80    HA   VAL  11           HA       VAL  11  -6.202   2.549   5.022
   81    HB   VAL  11           HB       VAL  11  -7.489   0.059   3.916
   82   HG11  VAL  11          2HG1      VAL  11  -7.221   1.222   1.768
   83   HG12  VAL  11          1HG1      VAL  11  -6.545   2.613   2.620
   84   HG13  VAL  11          3HG1      VAL  11  -8.218   2.130   2.903
   85   HG21  VAL  11          3HG2      VAL  11  -5.173  -0.493   4.285
   86   HG22  VAL  11          2HG2      VAL  11  -4.657   1.012   3.518
   87   HG23  VAL  11          1HG2      VAL  11  -5.443  -0.241   2.560
   88    H    GLU  12           H        GLU  12  -7.679   3.830   5.962
   89    HA   GLU  12           HA       GLU  12 -10.272   2.717   6.718
   90    HB2  GLU  12           HB2      GLU  12  -9.135   5.486   7.156
   91    HB3  GLU  12           HB3      GLU  12 -10.660   4.891   7.800
   92    HG2  GLU  12           HG2      GLU  12  -9.437   3.203   9.096
   93    HG3  GLU  12           HG3      GLU  12  -7.918   3.846   8.473
   94    H    GLY  13           H        GLY  13 -11.956   2.844   5.404
   95    HA2  GLY  13           HA1      GLY  13 -13.507   4.208   4.184
   96    HA3  GLY  13           HA2      GLY  13 -12.154   5.160   3.601
   97    H    MET  14           H        MET  14 -12.435   1.623   3.628
   98    HA   MET  14           HA       MET  14 -11.848   1.513   0.813
   99    HB2  MET  14           HB2      MET  14 -12.501  -0.587   2.868
  100    HB3  MET  14           HB3      MET  14 -12.356  -0.981   1.161
  101    HG2  MET  14           HG2      MET  14 -10.051  -0.069   1.202
  102    HG3  MET  14           HG3      MET  14 -10.215   0.149   2.946
  103    HE1  MET  14           HE1      MET  14  -7.817  -2.993   2.424
  104    HE2  MET  14           HE2      MET  14  -7.954  -1.595   1.359
  105    HE3  MET  14           HE3      MET  14  -7.919  -1.370   3.108
  106    H    SER  15           H        SER  15 -13.260   1.625  -0.789
  107    HA   SER  15           HA       SER  15 -16.080   1.679  -0.309
  108    HB2  SER  15           HB2      SER  15 -14.597   1.614  -2.950
  109    HB3  SER  15           HB3      SER  15 -16.274   2.100  -2.699
  110    HG   SER  15           HG       SER  15 -15.072   3.957  -2.760
  111    H    CYS  16           H        CYS  16 -13.995  -0.825  -0.492
  112    HA   CYS  16           HA       CYS  16 -14.243  -3.069  -0.586
  113    HB2  CYS  16           HB2      CYS  16 -16.434  -2.737   0.488
  114    HB3  CYS  16           HB3      CYS  16 -17.174  -2.500  -1.090
  115    HG   CYS  16           HG       CYS  16 -17.453  -5.145   0.359
  116    H    GLY  17           H        GLY  17 -14.692  -4.852  -2.119
  117    HA2  GLY  17           HA1      GLY  17 -14.616  -5.810  -4.176
  118    HA3  GLY  17           HA2      GLY  17 -15.655  -4.499  -4.716
  119    H    HIS  18           H        HIS  18 -14.835  -2.964  -6.031
  120    HA   HIS  18           HA       HIS  18 -12.399  -3.544  -7.369
  121    HB2  HIS  18           HB2      HIS  18 -14.308  -2.541  -8.524
  122    HB3  HIS  18           HB3      HIS  18 -14.170  -1.094  -7.533
  123    HD1  HIS  18           HD1      HIS  18 -12.023  -3.029 -10.030
  124    HD2  HIS  18           HD2      HIS  18 -12.688   0.857  -8.691
  125    HE1  HIS  18           HE1      HIS  18 -10.597  -1.554 -11.481
  126    HE2  HIS  18           HE2      HIS  18 -11.128   0.803 -10.755
  127    H    CYS  19           H        CYS  19 -13.086  -1.806  -4.570
  128    HA   CYS  19           HA       CYS  19 -11.123   0.138  -4.433
  129    HB2  CYS  19           HB2      CYS  19 -12.814  -0.182  -2.703
  130    HB3  CYS  19           HB3      CYS  19 -12.108  -1.732  -2.264
  131    HG   CYS  19           HG       CYS  19 -10.349   1.181  -1.982
  132    H    VAL  20           H        VAL  20 -10.882  -3.340  -4.113
  133    HA   VAL  20           HA       VAL  20  -8.323  -3.607  -3.033
  134    HB   VAL  20           HB       VAL  20  -9.795  -5.394  -4.980
  135   HG11  VAL  20          2HG1      VAL  20  -8.274  -7.182  -4.277
  136   HG12  VAL  20          1HG1      VAL  20  -7.354  -6.021  -3.323
  137   HG13  VAL  20          3HG1      VAL  20  -7.404  -5.874  -5.079
  138   HG21  VAL  20          3HG2      VAL  20 -10.953  -5.100  -2.875
  139   HG22  VAL  20          2HG2      VAL  20  -9.486  -5.507  -1.984
  140   HG23  VAL  20          1HG2      VAL  20 -10.284  -6.728  -2.975
  141    H    ASN  21           H        ASN  21  -9.202  -3.937  -6.484
  142    HA   ASN  21           HA       ASN  21  -6.586  -4.035  -7.456
  143    HB2  ASN  21           HB2      ASN  21  -8.663  -4.662  -8.712
  144    HB3  ASN  21           HB3      ASN  21  -8.994  -2.947  -8.927
  145   HD21  ASN  21          1HD2      ASN  21  -7.678  -1.734 -10.316
  146   HD22  ASN  21          2HD2      ASN  21  -6.650  -2.487 -11.482
  147    H    ALA  22           H        ALA  22  -8.703  -1.284  -6.848
  148    HA   ALA  22           HA       ALA  22  -7.218   0.701  -8.145
  149    HB1  ALA  22           HB1      ALA  22  -8.890   0.986  -5.652
  150    HB2  ALA  22           HB2      ALA  22  -8.384   2.295  -6.724
  151    HB3  ALA  22           HB3      ALA  22  -9.493   1.052  -7.308
  152    H    ILE  23           H        ILE  23  -7.190  -0.109  -4.653
  153    HA   ILE  23           HA       ILE  23  -5.022   1.649  -4.118
  154    HB   ILE  23           HB       ILE  23  -6.615   1.053  -2.364
  155   HG12  ILE  23          2HG1      ILE  23  -3.806   0.130  -1.730
  156   HG13  ILE  23          3HG1      ILE  23  -4.354   1.804  -1.746
  157   HG21  ILE  23          2HG2      ILE  23  -7.054  -1.253  -2.952
  158   HG22  ILE  23          1HG2      ILE  23  -6.530  -1.143  -1.272
  159   HG23  ILE  23          3HG2      ILE  23  -5.407  -1.703  -2.511
  160   HD11  ILE  23          3HD1      ILE  23  -5.888   1.317   0.089
  161   HD12  ILE  23          2HD1      ILE  23  -4.218   0.946   0.518
  162   HD13  ILE  23          1HD1      ILE  23  -5.331  -0.357   0.105
  163    H    GLU  24           H        GLU  24  -5.250  -1.777  -4.856
  164    HA   GLU  24           HA       GLU  24  -2.678  -2.602  -4.223
  165    HB2  GLU  24           HB2      GLU  24  -4.442  -4.140  -4.944
  166    HB3  GLU  24           HB3      GLU  24  -4.396  -3.453  -6.560
  167    HG2  GLU  24           HG2      GLU  24  -2.147  -4.266  -6.883
  168    HG3  GLU  24           HG3      GLU  24  -2.108  -4.882  -5.231
  169    H    SER  25           H        SER  25  -3.883  -1.129  -7.229
  170    HA   SER  25           HA       SER  25  -1.299  -1.064  -8.425
  171    HB2  SER  25           HB2      SER  25  -3.720   0.590  -9.155
  172    HB3  SER  25           HB3      SER  25  -2.267   0.336 -10.133
  173    HG   SER  25           HG       SER  25  -4.290  -1.526  -9.431
  174    H    SER  26           H        SER  26  -3.166   1.226  -6.487
  175    HA   SER  26           HA       SER  26  -1.637   3.501  -6.899
  176    HB2  SER  26           HB2      SER  26  -2.935   2.578  -4.321
  177    HB3  SER  26           HB3      SER  26  -2.379   4.221  -4.648
  178    HG   SER  26           HG       SER  26  -3.915   3.524  -6.673
  179    H    VAL  27           H        VAL  27  -0.989   0.689  -4.895
  180    HA   VAL  27           HA       VAL  27   1.540   1.756  -3.994
  181    HB   VAL  27           HB       VAL  27   0.662  -1.127  -3.882
  182   HG11  VAL  27          2HG1      VAL  27   2.573   0.475  -2.189
  183   HG12  VAL  27          1HG1      VAL  27   3.021  -0.693  -3.434
  184   HG13  VAL  27          3HG1      VAL  27   2.180  -1.232  -1.981
  185   HG21  VAL  27          3HG2      VAL  27  -0.219  -0.664  -1.646
  186   HG22  VAL  27          2HG2      VAL  27  -1.083   0.254  -2.879
  187   HG23  VAL  27          1HG2      VAL  27   0.120   1.054  -1.868
  188    H    LYS  28           H        LYS  28   0.522  -0.865  -6.201
  189    HA   LYS  28           HA       LYS  28   3.067  -1.734  -6.932
  190    HB2  LYS  28           HB2      LYS  28   1.269  -3.167  -7.402
  191    HB3  LYS  28           HB3      LYS  28   0.397  -1.928  -8.295
  192    HG2  LYS  28           HG2      LYS  28   1.928  -2.077 -10.127
  193    HG3  LYS  28           HG3      LYS  28   2.991  -3.148  -9.216
  194    HD2  LYS  28           HD2      LYS  28   0.137  -3.859  -9.841
  195    HD3  LYS  28           HD3      LYS  28   1.467  -4.232 -10.941
  196    HE2  LYS  28           HE2      LYS  28   1.319  -5.111  -8.061
  197    HE3  LYS  28           HE3      LYS  28   0.862  -6.112  -9.440
  198    HZ1  LYS  28           HZ1      LYS  28   3.098  -6.633  -8.764
  199    HZ2  LYS  28           HZ2      LYS  28   3.569  -5.013  -8.879
  200    HZ3  LYS  28           HZ3      LYS  28   3.147  -5.873 -10.279
  201    H    GLU  29           H        GLU  29   1.097   0.814  -8.410
  202    HA   GLU  29           HA       GLU  29   2.642   1.134 -10.754
  203    HB2  GLU  29           HB2      GLU  29   0.890   3.094  -9.269
  204    HB3  GLU  29           HB3      GLU  29   1.611   3.420 -10.837
  205    HG2  GLU  29           HG2      GLU  29   0.406   1.434 -11.729
  206    HG3  GLU  29           HG3      GLU  29  -0.407   1.288 -10.174
  207    H    LEU  30           H        LEU  30   3.222   1.970  -7.518
  208    HA   LEU  30           HA       LEU  30   5.022   4.157  -8.065
  209    HB2  LEU  30           HB2      LEU  30   4.752   2.538  -5.533
  210    HB3  LEU  30           HB3      LEU  30   5.584   4.071  -5.696
  211    HG   LEU  30           HG       LEU  30   2.625   3.560  -5.848
  212   HD11  LEU  30          2HD1      LEU  30   2.565   5.146  -3.983
  213   HD12  LEU  30          1HD1      LEU  30   4.326   5.240  -4.021
  214   HD13  LEU  30          3HD1      LEU  30   3.533   3.719  -3.613
  215   HD21  LEU  30          3HD2      LEU  30   2.354   5.955  -6.288
  216   HD22  LEU  30          2HD2      LEU  30   3.203   5.143  -7.605
  217   HD23  LEU  30          1HD2      LEU  30   4.103   6.123  -6.443
  218    H    ASN  31           H        ASN  31   7.249   4.185  -7.908
  219    HA   ASN  31           HA       ASN  31   8.592   1.755  -8.677
  220    HB2  ASN  31           HB2      ASN  31   9.306   3.852  -9.674
  221    HB3  ASN  31           HB3      ASN  31   9.631   4.537  -8.085
  222   HD21  ASN  31          1HD2      ASN  31  11.763   4.970  -8.598
  223   HD22  ASN  31          2HD2      ASN  31  12.962   3.725  -8.712
  224    H    GLY  32           H        GLY  32   9.623   0.367  -7.394
  225    HA2  GLY  32           HA1      GLY  32  11.103  -0.133  -5.582
  226    HA3  GLY  32           HA2      GLY  32  10.447   1.247  -4.713
  227    H    VAL  33           H        VAL  33   8.065  -0.597  -6.256
  228    HA   VAL  33           HA       VAL  33   7.372  -1.841  -3.697
  229    HB   VAL  33           HB       VAL  33   5.664  -1.215  -6.108
  230   HG11  VAL  33          2HG1      VAL  33   4.931  -3.296  -5.039
  231   HG12  VAL  33          1HG1      VAL  33   3.768  -1.995  -4.790
  232   HG13  VAL  33          3HG1      VAL  33   4.854  -2.465  -3.484
  233   HG21  VAL  33          3HG2      VAL  33   4.563   0.353  -4.582
  234   HG22  VAL  33          2HG2      VAL  33   6.278   0.723  -4.769
  235   HG23  VAL  33          1HG2      VAL  33   5.705  -0.091  -3.313
  236    H    GLU  34           H        GLU  34   7.158  -3.999  -3.495
  237    HA   GLU  34           HA       GLU  34   8.034  -5.617  -5.786
  238    HB2  GLU  34           HB2      GLU  34   9.326  -5.762  -3.676
  239    HB3  GLU  34           HB3      GLU  34   7.881  -6.304  -2.845
  240    HG2  GLU  34           HG2      GLU  34   9.366  -8.153  -3.361
  241    HG3  GLU  34           HG3      GLU  34   7.817  -8.309  -4.188
  242    H    GLN  35           H        GLN  35   5.941  -6.172  -2.969
  243    HA   GLN  35           HA       GLN  35   3.812  -7.131  -4.718
  244    HB2  GLN  35           HB2      GLN  35   4.953  -8.803  -2.465
  245    HB3  GLN  35           HB3      GLN  35   3.538  -9.205  -3.429
  246    HG2  GLN  35           HG2      GLN  35   4.981  -9.263  -5.437
  247    HG3  GLN  35           HG3      GLN  35   6.378  -8.999  -4.395
  248   HE21  GLN  35          1HE2      GLN  35   3.603 -10.961  -3.553
  249   HE22  GLN  35          2HE2      GLN  35   4.431 -12.484  -3.574
  250    H    VAL  36           H        VAL  36   1.764  -7.119  -3.755
  251    HA   VAL  36           HA       VAL  36   1.634  -5.880  -1.094
  252    HB   VAL  36           HB       VAL  36  -0.275  -4.505  -1.835
  253   HG11  VAL  36          2HG1      VAL  36   1.938  -3.522  -1.764
  254   HG12  VAL  36          1HG1      VAL  36   1.022  -2.859  -3.117
  255   HG13  VAL  36          3HG1      VAL  36   2.263  -4.079  -3.404
  256   HG21  VAL  36          3HG2      VAL  36  -0.676  -4.188  -4.245
  257   HG22  VAL  36          2HG2      VAL  36  -1.039  -5.832  -3.713
  258   HG23  VAL  36          1HG2      VAL  36   0.457  -5.496  -4.590
  259    H    LYS  37           H        LYS  37   0.160  -6.707   0.242
  260    HA   LYS  37           HA       LYS  37  -1.841  -8.560  -0.883
  261    HB2  LYS  37           HB2      LYS  37  -0.665  -8.543   1.910
  262    HB3  LYS  37           HB3      LYS  37  -1.821  -9.706   1.279
  263    HG2  LYS  37           HG2      LYS  37  -0.217 -10.702  -0.122
  264    HG3  LYS  37           HG3      LYS  37   0.894  -9.343   0.055
  265    HD2  LYS  37           HD2      LYS  37   1.634 -11.279   1.356
  266    HD3  LYS  37           HD3      LYS  37   1.244  -9.909   2.397
  267    HE2  LYS  37           HE2      LYS  37  -1.016 -10.938   2.739
  268    HE3  LYS  37           HE3      LYS  37  -0.428 -12.362   1.883
  269    HZ1  LYS  37           HZ1      LYS  37   1.306 -12.602   3.564
  270    HZ2  LYS  37           HZ2      LYS  37  -0.241 -12.647   4.260
  271    HZ3  LYS  37           HZ3      LYS  37   0.704 -11.245   4.397
  272    H    VAL  38           H        VAL  38  -3.406  -6.969  -1.208
  273    HA   VAL  38           HA       VAL  38  -4.133  -5.287   1.047
  274    HB   VAL  38           HB       VAL  38  -4.182  -4.137  -1.032
  275   HG11  VAL  38          2HG1      VAL  38  -5.961  -6.347  -2.034
  276   HG12  VAL  38          1HG1      VAL  38  -4.353  -5.908  -2.617
  277   HG13  VAL  38          3HG1      VAL  38  -5.713  -4.820  -2.878
  278   HG21  VAL  38          3HG2      VAL  38  -6.508  -3.371  -1.166
  279   HG22  VAL  38          2HG2      VAL  38  -5.962  -3.533   0.504
  280   HG23  VAL  38          1HG2      VAL  38  -7.011  -4.761  -0.203
  281    H    GLN  39           H        GLN  39  -5.430  -5.966   2.553
  282    HA   GLN  39           HA       GLN  39  -7.299  -8.134   1.968
  283    HB2  GLN  39           HB2      GLN  39  -6.489  -6.923   4.618
  284    HB3  GLN  39           HB3      GLN  39  -7.540  -8.317   4.409
  285    HG2  GLN  39           HG2      GLN  39  -4.620  -8.135   3.716
  286    HG3  GLN  39           HG3      GLN  39  -5.340  -9.043   5.043
  287   HE21  GLN  39          1HE2      GLN  39  -4.719  -8.935   1.650
  288   HE22  GLN  39          2HE2      GLN  39  -5.214 -10.553   1.285
  289    H    LEU  40           H        LEU  40  -9.152  -7.352   1.149
  290    HA   LEU  40           HA       LEU  40 -10.147  -4.749   1.581
  291    HB2  LEU  40           HB2      LEU  40 -10.619  -6.382  -0.342
  292    HB3  LEU  40           HB3      LEU  40 -11.789  -7.129   0.722
  293    HG   LEU  40           HG       LEU  40 -12.760  -5.544  -0.960
  294   HD11  LEU  40          2HD1      LEU  40 -13.180  -4.773   1.927
  295   HD12  LEU  40          1HD1      LEU  40 -13.979  -6.099   1.082
  296   HD13  LEU  40          3HD1      LEU  40 -14.275  -4.432   0.586
  297   HD21  LEU  40          3HD2      LEU  40 -12.518  -3.146  -0.573
  298   HD22  LEU  40          2HD2      LEU  40 -10.967  -3.891  -0.954
  299   HD23  LEU  40          1HD2      LEU  40 -11.351  -3.463   0.711
  300    H    ALA  41           H        ALA  41 -11.078  -7.898   2.903
  301    HA   ALA  41           HA       ALA  41 -13.235  -7.005   4.472
  302    HB1  ALA  41           HB1      ALA  41 -12.873  -9.347   3.851
  303    HB2  ALA  41           HB2      ALA  41 -11.470  -9.406   4.920
  304    HB3  ALA  41           HB3      ALA  41 -13.081  -9.153   5.592
  305    H    GLU  42           H        GLU  42  -9.798  -7.237   5.144
  306    HA   GLU  42           HA       GLU  42 -10.134  -6.669   7.954
  307    HB2  GLU  42           HB2      GLU  42  -7.618  -6.780   6.283
  308    HB3  GLU  42           HB3      GLU  42  -7.683  -6.704   8.037
  309    HG2  GLU  42           HG2      GLU  42  -8.767  -8.950   6.349
  310    HG3  GLU  42           HG3      GLU  42  -7.234  -8.964   7.222
  311    H    GLY  43           H        GLY  43  -9.295  -4.939   5.023
  312    HA2  GLY  43           HA1      GLY  43  -9.303  -2.642   4.667
  313    HA3  GLY  43           HA2      GLY  43  -9.603  -2.402   6.382
  314    H    THR  44           H        THR  44  -7.016  -4.390   5.158
  315    HA   THR  44           HA       THR  44  -5.059  -2.290   5.750
  316    HB   THR  44           HB       THR  44  -3.660  -4.045   6.945
  317    HG1  THR  44           HG1      THR  44  -4.556  -5.941   7.442
  318   HG21  THR  44          3HG2      THR  44  -4.830  -2.253   8.155
  319   HG22  THR  44          1HG2      THR  44  -4.796  -3.750   9.090
  320   HG23  THR  44          2HG2      THR  44  -6.271  -3.267   8.251
  321    H    VAL  45           H        VAL  45  -2.976  -2.665   4.800
  322    HA   VAL  45           HA       VAL  45  -2.969  -4.732   2.698
  323    HB   VAL  45           HB       VAL  45  -1.798  -1.963   2.365
  324   HG11  VAL  45          2HG1      VAL  45  -1.627  -2.599   0.001
  325   HG12  VAL  45          1HG1      VAL  45  -2.246  -4.203   0.393
  326   HG13  VAL  45          3HG1      VAL  45  -0.692  -3.678   1.037
  327   HG21  VAL  45          3HG2      VAL  45  -4.231  -1.817   2.483
  328   HG22  VAL  45          2HG2      VAL  45  -4.374  -3.068   1.247
  329   HG23  VAL  45          1HG2      VAL  45  -3.658  -1.508   0.844
  330    H    GLU  46           H        GLU  46  -1.377  -6.103   2.977
  331    HA   GLU  46           HA       GLU  46   1.016  -5.384   4.480
  332    HB2  GLU  46           HB2      GLU  46   0.211  -7.974   3.132
  333    HB3  GLU  46           HB3      GLU  46   1.632  -7.759   4.142
  334    HG2  GLU  46           HG2      GLU  46   0.309  -7.420   6.082
  335    HG3  GLU  46           HG3      GLU  46  -1.171  -7.308   5.127
  336    H    VAL  47           H        VAL  47   2.622  -4.354   3.407
  337    HA   VAL  47           HA       VAL  47   2.886  -4.925   0.522
  338    HB   VAL  47           HB       VAL  47   3.616  -2.329   1.873
  339   HG11  VAL  47          2HG1      VAL  47   4.876  -2.752  -0.148
  340   HG12  VAL  47          1HG1      VAL  47   3.694  -1.473  -0.436
  341   HG13  VAL  47          3HG1      VAL  47   3.391  -3.107  -1.031
  342   HG21  VAL  47          3HG2      VAL  47   1.607  -1.391   0.832
  343   HG22  VAL  47          2HG2      VAL  47   1.209  -2.657   1.993
  344   HG23  VAL  47          1HG2      VAL  47   1.156  -3.000   0.263
  345    H    THR  48           H        THR  48   4.801  -5.508  -0.267
  346    HA   THR  48           HA       THR  48   7.169  -5.375   1.477
  347    HB   THR  48           HB       THR  48   6.954  -6.838  -1.162
  348    HG1  THR  48           HG1      THR  48   5.603  -7.393   1.029
  349   HG21  THR  48          3HG2      THR  48   8.767  -7.196   1.230
  350   HG22  THR  48          1HG2      THR  48   9.215  -6.450  -0.306
  351   HG23  THR  48          2HG2      THR  48   8.801  -8.164  -0.246
  352    H    ILE  49           H        ILE  49   8.426  -3.639   1.151
  353    HA   ILE  49           HA       ILE  49   8.461  -2.450  -1.551
  354    HB   ILE  49           HB       ILE  49   8.826  -0.253  -0.490
  355   HG12  ILE  49          2HG1      ILE  49   8.104  -1.612   2.113
  356   HG13  ILE  49          3HG1      ILE  49   9.755  -1.208   1.656
  357   HG21  ILE  49          2HG2      ILE  49   6.524   0.084   0.310
  358   HG22  ILE  49          1HG2      ILE  49   6.304  -1.665   0.365
  359   HG23  ILE  49          3HG2      ILE  49   6.591  -0.861  -1.178
  360   HD11  ILE  49          3HD1      ILE  49   9.145   1.159   1.583
  361   HD12  ILE  49          2HD1      ILE  49   8.835   0.448   3.166
  362   HD13  ILE  49          1HD1      ILE  49   7.497   0.744   2.054
  363    H    ASP  50           H        ASP  50  10.354  -1.474  -2.257
  364    HA   ASP  50           HA       ASP  50  12.854  -2.261  -1.068
  365    HB2  ASP  50           HB2      ASP  50  12.202  -0.315  -3.302
  366    HB3  ASP  50           HB3      ASP  50  13.825  -0.784  -2.833
  367    H    SER  51           H        SER  51  13.117  -1.319   0.932
  368    HA   SER  51           HA       SER  51  12.120   1.268   1.554
  369    HB2  SER  51           HB2      SER  51  13.343   0.977   3.688
  370    HB3  SER  51           HB3      SER  51  12.368  -0.433   3.276
  371    HG   SER  51           HG       SER  51  14.163  -1.560   2.771
  372    H    SER  52           H        SER  52  14.832   0.277  -0.129
  373    HA   SER  52           HA       SER  52  16.475   2.571   0.514
  374    HB2  SER  52           HB2      SER  52  16.860   0.579  -1.724
  375    HB3  SER  52           HB3      SER  52  18.080   1.615  -0.982
  376    HG   SER  52           HG       SER  52  18.399   0.104   0.428
  377    H    VAL  53           H        VAL  53  13.769   2.069  -1.327
  378    HA   VAL  53           HA       VAL  53  14.534   4.166  -3.254
  379    HB   VAL  53           HB       VAL  53  12.723   1.809  -3.812
  380   HG11  VAL  53          2HG1      VAL  53  12.046   3.846  -4.985
  381   HG12  VAL  53          1HG1      VAL  53  12.676   2.635  -6.102
  382   HG13  VAL  53          3HG1      VAL  53  13.676   4.013  -5.639
  383   HG21  VAL  53          3HG2      VAL  53  15.494   2.426  -4.837
  384   HG22  VAL  53          2HG2      VAL  53  14.479   1.079  -5.354
  385   HG23  VAL  53          1HG2      VAL  53  15.071   1.151  -3.692
  386    H    VAL  54           H        VAL  54  11.592   2.471  -2.124
  387    HA   VAL  54           HA       VAL  54  10.260   5.091  -2.104
  388    HB   VAL  54           HB       VAL  54   9.301   3.320  -3.604
  389   HG11  VAL  54          2HG1      VAL  54   7.971   1.528  -2.617
  390   HG12  VAL  54          1HG1      VAL  54   8.560   1.978  -1.015
  391   HG13  VAL  54          3HG1      VAL  54   9.684   1.368  -2.228
  392   HG21  VAL  54          3HG2      VAL  54   7.946   5.187  -2.854
  393   HG22  VAL  54          2HG2      VAL  54   7.495   4.297  -1.402
  394   HG23  VAL  54          1HG2      VAL  54   6.975   3.721  -2.987
  395    H    THR  55           H        THR  55   9.285   5.832  -0.232
  396    HA   THR  55           HA       THR  55   9.942   4.316   2.184
  397    HB   THR  55           HB       THR  55   9.366   6.365   3.425
  398    HG1  THR  55           HG1      THR  55   8.834   7.411   0.813
  399   HG21  THR  55          3HG2      THR  55  11.662   6.075   2.682
  400   HG22  THR  55          1HG2      THR  55  11.215   7.780   2.607
  401   HG23  THR  55          2HG2      THR  55  11.277   6.816   1.130
  402    H    LEU  56           H        LEU  56   8.270   4.353   3.953
  403    HA   LEU  56           HA       LEU  56   5.950   3.056   3.060
  404    HB2  LEU  56           HB2      LEU  56   6.976   2.709   5.277
  405    HB3  LEU  56           HB3      LEU  56   6.487   4.323   5.751
  406    HG   LEU  56           HG       LEU  56   4.348   2.442   4.866
  407   HD11  LEU  56          2HD1      LEU  56   4.193   1.511   7.128
  408   HD12  LEU  56          1HD1      LEU  56   5.703   2.316   7.556
  409   HD13  LEU  56          3HD1      LEU  56   5.695   1.048   6.329
  410   HD21  LEU  56          3HD2      LEU  56   3.805   4.748   5.466
  411   HD22  LEU  56          2HD2      LEU  56   4.546   4.516   7.050
  412   HD23  LEU  56          1HD2      LEU  56   3.097   3.610   6.612
  413    H    LYS  57           H        LYS  57   6.534   6.400   4.065
  414    HA   LYS  57           HA       LYS  57   3.805   7.156   4.053
  415    HB2  LYS  57           HB2      LYS  57   5.975   8.372   5.003
  416    HB3  LYS  57           HB3      LYS  57   5.872   9.208   3.458
  417    HG2  LYS  57           HG2      LYS  57   3.571   9.007   5.387
  418    HG3  LYS  57           HG3      LYS  57   4.725  10.342   5.391
  419    HD2  LYS  57           HD2      LYS  57   4.093  10.913   3.106
  420    HD3  LYS  57           HD3      LYS  57   2.984   9.541   3.054
  421    HE2  LYS  57           HE2      LYS  57   2.754  11.806   5.030
  422    HE3  LYS  57           HE3      LYS  57   1.920  11.781   3.480
  423    HZ1  LYS  57           HZ1      LYS  57   1.602   9.660   5.538
  424    HZ2  LYS  57           HZ2      LYS  57   0.664   9.897   4.144
  425    HZ3  LYS  57           HZ3      LYS  57   0.584  11.006   5.414
  426    H    ASP  58           H        ASP  58   6.250   7.009   1.504
  427    HA   ASP  58           HA       ASP  58   4.932   8.474  -0.478
  428    HB2  ASP  58           HB2      ASP  58   6.635   5.990  -0.716
  429    HB3  ASP  58           HB3      ASP  58   6.010   6.852  -2.115
  430    H    ILE  59           H        ILE  59   4.720   5.023   0.254
  431    HA   ILE  59           HA       ILE  59   2.707   4.282  -1.501
  432    HB   ILE  59           HB       ILE  59   3.048   3.234   1.317
  433   HG12  ILE  59          2HG1      ILE  59   5.205   3.214   0.153
  434   HG13  ILE  59          3HG1      ILE  59   4.594   1.575   0.356
  435   HG21  ILE  59          2HG2      ILE  59   2.134   1.162   0.418
  436   HG22  ILE  59          1HG2      ILE  59   1.962   1.918  -1.168
  437   HG23  ILE  59          3HG2      ILE  59   1.008   2.503   0.197
  438   HD11  ILE  59          3HD1      ILE  59   3.854   1.567  -1.967
  439   HD12  ILE  59          2HD1      ILE  59   5.582   1.889  -1.837
  440   HD13  ILE  59          1HD1      ILE  59   4.461   3.209  -2.168
  441    H    VAL  60           H        VAL  60   2.436   5.372   1.862
  442    HA   VAL  60           HA       VAL  60  -0.344   5.312   2.086
  443    HB   VAL  60           HB       VAL  60   1.606   7.143   3.493
  444   HG11  VAL  60          2HG1      VAL  60  -0.675   7.964   3.690
  445   HG12  VAL  60          1HG1      VAL  60  -0.109   7.315   5.230
  446   HG13  VAL  60          3HG1      VAL  60  -1.213   6.374   4.228
  447   HG21  VAL  60          3HG2      VAL  60   2.154   4.802   3.816
  448   HG22  VAL  60          2HG2      VAL  60   0.487   4.459   4.281
  449   HG23  VAL  60          1HG2      VAL  60   1.493   5.486   5.301
  450    H    ALA  61           H        ALA  61   1.801   7.949   1.069
  451    HA   ALA  61           HA       ALA  61  -0.085   9.999   0.967
  452    HB1  ALA  61           HB1      ALA  61   1.477  11.168  -0.476
  453    HB2  ALA  61           HB2      ALA  61   2.337  10.359   0.833
  454    HB3  ALA  61           HB3      ALA  61   2.343   9.665  -0.788
  455    H    VAL  62           H        VAL  62   0.887   7.689  -1.554
  456    HA   VAL  62           HA       VAL  62  -0.850   8.803  -3.526
  457    HB   VAL  62           HB       VAL  62   0.333   6.022  -3.406
  458   HG11  VAL  62          2HG1      VAL  62  -1.523   6.120  -4.961
  459   HG12  VAL  62          1HG1      VAL  62  -0.003   6.036  -5.850
  460   HG13  VAL  62          3HG1      VAL  62  -0.855   7.573  -5.707
  461   HG21  VAL  62          3HG2      VAL  62   2.056   6.933  -4.897
  462   HG22  VAL  62          2HG2      VAL  62   2.049   7.741  -3.330
  463   HG23  VAL  62          1HG2      VAL  62   1.339   8.536  -4.733
  464    H    ILE  63           H        ILE  63  -1.168   6.250  -1.125
  465    HA   ILE  63           HA       ILE  63  -3.679   5.272  -1.992
  466    HB   ILE  63           HB       ILE  63  -2.371   5.180   0.732
  467   HG12  ILE  63          2HG1      ILE  63  -2.634   3.098  -1.449
  468   HG13  ILE  63          3HG1      ILE  63  -1.170   3.993  -1.059
  469   HG21  ILE  63          2HG2      ILE  63  -4.709   4.922   1.093
  470   HG22  ILE  63          1HG2      ILE  63  -3.975   3.326   1.193
  471   HG23  ILE  63          3HG2      ILE  63  -4.856   3.800  -0.257
  472   HD11  ILE  63          3HD1      ILE  63  -1.133   2.955   1.152
  473   HD12  ILE  63          2HD1      ILE  63  -1.098   1.754  -0.140
  474   HD13  ILE  63          1HD1      ILE  63  -2.594   2.054   0.747
  475    H    GLU  64           H        GLU  64  -2.760   7.834   0.265
  476    HA   GLU  64           HA       GLU  64  -5.427   8.352   1.149
  477    HB2  GLU  64           HB2      GLU  64  -3.022  10.181   1.250
  478    HB3  GLU  64           HB3      GLU  64  -4.546  10.423   2.095
  479    HG2  GLU  64           HG2      GLU  64  -4.163   8.452   3.433
  480    HG3  GLU  64           HG3      GLU  64  -2.669   8.119   2.551
  481    H    ASP  65           H        ASP  65  -3.308   9.727  -1.308
  482    HA   ASP  65           HA       ASP  65  -5.013  11.798  -2.172
  483    HB2  ASP  65           HB2      ASP  65  -2.625  11.608  -2.811
  484    HB3  ASP  65           HB3      ASP  65  -3.015  10.208  -3.803
  485    H    GLN  66           H        GLN  66  -5.141   8.414  -2.527
  486    HA   GLN  66           HA       GLN  66  -6.897   8.383  -4.808
  487    HB2  GLN  66           HB2      GLN  66  -5.219   6.552  -3.642
  488    HB3  GLN  66           HB3      GLN  66  -6.801   5.999  -3.101
  489    HG2  GLN  66           HG2      GLN  66  -6.135   4.905  -5.171
  490    HG3  GLN  66           HG3      GLN  66  -7.587   5.883  -5.391
  491   HE21  GLN  66          1HE2      GLN  66  -4.229   5.529  -6.131
  492   HE22  GLN  66          2HE2      GLN  66  -4.159   6.724  -7.387
  493    H    GLY  67           H        GLY  67  -7.314   9.270  -1.665
  494    HA2  GLY  67           HA1      GLY  67  -9.444  10.053  -0.928
  495    HA3  GLY  67           HA2      GLY  67 -10.201   8.778  -1.871
  496    H    TYR  68           H        TYR  68  -7.465   7.808  -0.058
  497    HA   TYR  68           HA       TYR  68  -9.263   6.522   1.868
  498    HB2  TYR  68           HB2      TYR  68  -6.511   5.671   0.994
  499    HB3  TYR  68           HB3      TYR  68  -7.519   4.815   2.152
  500    HD1  TYR  68           HD1      TYR  68  -9.795   3.942   1.289
  501    HD2  TYR  68           HD2      TYR  68  -6.626   5.162  -1.270
  502    HE1  TYR  68           HE1      TYR  68 -10.777   2.632  -0.547
  503    HE2  TYR  68           HE2      TYR  68  -7.600   3.863  -3.112
  504    HH   TYR  68           HH       TYR  68  -9.073   2.000  -3.461
  505    H    ASP  69           H        ASP  69  -8.557   6.245   4.041
  506    HA   ASP  69           HA       ASP  69  -6.696   8.357   4.901
  507    HB2  ASP  69           HB2      ASP  69  -8.948   7.019   6.424
  508    HB3  ASP  69           HB3      ASP  69  -7.849   8.213   7.103
  509    H    VAL  70           H        VAL  70  -4.739   7.498   5.189
  510    HA   VAL  70           HA       VAL  70  -4.546   4.960   6.671
  511    HB   VAL  70           HB       VAL  70  -2.781   5.832   4.369
  512   HG11  VAL  70          2HG1      VAL  70  -1.532   4.641   6.117
  513   HG12  VAL  70          1HG1      VAL  70  -1.655   3.693   4.634
  514   HG13  VAL  70          3HG1      VAL  70  -2.681   3.305   6.016
  515   HG21  VAL  70          3HG2      VAL  70  -3.685   3.875   3.210
  516   HG22  VAL  70          2HG2      VAL  70  -4.964   5.017   3.630
  517   HG23  VAL  70          1HG2      VAL  70  -4.744   3.547   4.583
  518    H    GLN  71           H        GLN  71  -3.355   5.086   8.467
  519    HA   GLN  71           HA       GLN  71  -1.253   7.111   8.655
  520    HB2  GLN  71           HB2      GLN  71  -3.317   8.088   9.609
  521    HB3  GLN  71           HB3      GLN  71  -3.423   6.739  10.731
  522    HG2  GLN  71           HG2      GLN  71  -1.287   7.416  11.724
  523    HG3  GLN  71           HG3      GLN  71  -1.222   8.790  10.618
  524   HE21  GLN  71          1HE2      GLN  71  -2.858   7.390  13.355
  525   HE22  GLN  71          2HE2      GLN  71  -3.638   8.843  13.876
  Start of MODEL   11
    1    H1   SER   1           H1       SER   1  17.534  -4.909  -6.247
    2    H2   SER   1           H2       SER   1  17.574  -3.214  -6.231
    3    H3   SER   1           H3       SER   1  16.145  -4.027  -6.661
    4    HA   SER   1           HA       SER   1  15.959  -3.175  -4.445
    5    HB2  SER   1           HB2      SER   1  14.877  -5.333  -4.997
    6    HB3  SER   1           HB3      SER   1  16.334  -6.184  -4.491
    7    HG   SER   1           HG       SER   1  15.143  -4.408  -2.675
    8    H    ASN   2           H        ASN   2  16.806  -2.817  -2.446
    9    HA   ASN   2           HA       ASN   2  19.591  -3.685  -1.996
   10    HB2  ASN   2           HB2      ASN   2  19.540  -1.350  -2.778
   11    HB3  ASN   2           HB3      ASN   2  18.415  -0.939  -1.489
   12   HD21  ASN   2          1HD2      ASN   2  19.727   0.543  -0.517
   13   HD22  ASN   2          2HD2      ASN   2  21.197   0.123   0.303
   14    H    ALA   3           H        ALA   3  16.544  -2.585  -0.630
   15    HA   ALA   3           HA       ALA   3  16.977  -4.142   1.762
   16    HB1  ALA   3           HB1      ALA   3  16.713  -2.283   3.314
   17    HB2  ALA   3           HB2      ALA   3  18.143  -2.050   2.310
   18    HB3  ALA   3           HB3      ALA   3  16.667  -1.147   1.968
   19    H    MET   4           H        MET   4  15.105  -5.249   1.549
   20    HA   MET   4           HA       MET   4  12.685  -3.703   0.933
   21    HB2  MET   4           HB2      MET   4  11.691  -5.884   0.290
   22    HB3  MET   4           HB3      MET   4  13.092  -5.434  -0.670
   23    HG2  MET   4           HG2      MET   4  14.427  -6.911   0.935
   24    HG3  MET   4           HG3      MET   4  12.861  -7.548   1.436
   25    HE1  MET   4           HE1      MET   4  11.080  -8.535  -0.428
   26    HE2  MET   4           HE2      MET   4  11.390  -7.165  -1.496
   27    HE3  MET   4           HE3      MET   4  11.528  -8.814  -2.111
   28    H    GLU   5           H        GLU   5  11.377  -3.231   2.478
   29    HA   GLU   5           HA       GLU   5  11.393  -4.745   4.987
   30    HB2  GLU   5           HB2      GLU   5  10.960  -1.951   4.228
   31    HB3  GLU   5           HB3      GLU   5   9.752  -2.557   5.350
   32    HG2  GLU   5           HG2      GLU   5  11.613  -1.464   6.474
   33    HG3  GLU   5           HG3      GLU   5  11.458  -3.154   6.937
   34    H    GLN   6           H        GLN   6   9.491  -5.499   5.921
   35    HA   GLN   6           HA       GLN   6   7.189  -5.752   4.112
   36    HB2  GLN   6           HB2      GLN   6   7.888  -7.248   6.653
   37    HB3  GLN   6           HB3      GLN   6   6.398  -7.470   5.755
   38    HG2  GLN   6           HG2      GLN   6   7.711  -9.247   5.085
   39    HG3  GLN   6           HG3      GLN   6   7.895  -8.081   3.780
   40   HE21  GLN   6          1HE2      GLN   6   9.881  -7.155   3.421
   41   HE22  GLN   6          2HE2      GLN   6  11.328  -7.693   4.195
   42    H    LEU   7           H        LEU   7   5.484  -4.439   4.453
   43    HA   LEU   7           HA       LEU   7   5.179  -3.264   7.141
   44    HB2  LEU   7           HB2      LEU   7   4.874  -1.863   4.487
   45    HB3  LEU   7           HB3      LEU   7   4.466  -1.160   6.041
   46    HG   LEU   7           HG       LEU   7   7.239  -2.021   5.202
   47   HD11  LEU   7          2HD1      LEU   7   5.994   0.714   5.416
   48   HD12  LEU   7          1HD1      LEU   7   6.497  -0.098   3.934
   49   HD13  LEU   7          3HD1      LEU   7   7.703   0.389   5.126
   50   HD21  LEU   7          3HD2      LEU   7   6.902  -2.190   7.607
   51   HD22  LEU   7          2HD2      LEU   7   6.269  -0.543   7.648
   52   HD23  LEU   7          1HD2      LEU   7   7.957  -0.830   7.222
   53    H    THR   8           H        THR   8   3.144  -3.025   7.916
   54    HA   THR   8           HA       THR   8   0.923  -3.973   6.219
   55    HB   THR   8           HB       THR   8   1.113  -4.078   9.241
   56    HG1  THR   8           HG1      THR   8   1.146  -6.407   7.667
   57   HG21  THR   8          3HG2      THR   8  -0.834  -5.573   9.058
   58   HG22  THR   8          1HG2      THR   8  -0.867  -5.305   7.317
   59   HG23  THR   8          2HG2      THR   8  -1.179  -3.966   8.419
   60    H    LEU   9           H        LEU   9  -0.086  -2.166   5.502
   61    HA   LEU   9           HA       LEU   9  -0.220   0.190   7.214
   62    HB2  LEU   9           HB2      LEU   9  -0.902  -0.293   4.322
   63    HB3  LEU   9           HB3      LEU   9  -1.318   1.200   5.139
   64    HG   LEU   9           HG       LEU   9   1.162   1.459   5.647
   65   HD11  LEU   9          2HD1      LEU   9   1.872  -0.824   5.242
   66   HD12  LEU   9          1HD1      LEU   9   2.706   0.287   4.159
   67   HD13  LEU   9          3HD1      LEU   9   1.374  -0.697   3.555
   68   HD21  LEU   9          3HD2      LEU   9   0.029   2.786   3.970
   69   HD22  LEU   9          2HD2      LEU   9   0.227   1.495   2.785
   70   HD23  LEU   9          1HD2      LEU   9   1.641   2.342   3.410
   71    H    GLN  10           H        GLN  10  -1.996   0.931   8.194
   72    HA   GLN  10           HA       GLN  10  -4.430  -0.657   8.049
   73    HB2  GLN  10           HB2      GLN  10  -3.935   1.807   9.726
   74    HB3  GLN  10           HB3      GLN  10  -5.190   0.593   9.951
   75    HG2  GLN  10           HG2      GLN  10  -2.237   0.073  10.238
   76    HG3  GLN  10           HG3      GLN  10  -3.329   0.432  11.573
   77   HE21  GLN  10          1HE2      GLN  10  -1.699  -1.942  10.970
   78   HE22  GLN  10          2HE2      GLN  10  -2.801  -3.279  10.960
   79    H    VAL  11           H        VAL  11  -5.929  -0.197   6.594
   80    HA   VAL  11           HA       VAL  11  -5.995   2.526   5.467
   81    HB   VAL  11           HB       VAL  11  -6.971   0.012   4.123
   82   HG11  VAL  11          2HG1      VAL  11  -7.926   2.043   3.244
   83   HG12  VAL  11          1HG1      VAL  11  -6.778   1.377   2.081
   84   HG13  VAL  11          3HG1      VAL  11  -6.324   2.763   3.075
   85   HG21  VAL  11          3HG2      VAL  11  -4.256   1.307   3.957
   86   HG22  VAL  11          2HG2      VAL  11  -4.858   0.111   2.805
   87   HG23  VAL  11          1HG2      VAL  11  -4.639  -0.331   4.502
   88    H    GLU  12           H        GLU  12  -7.611   3.547   6.530
   89    HA   GLU  12           HA       GLU  12 -10.183   2.156   6.774
   90    HB2  GLU  12           HB2      GLU  12  -9.153   4.671   8.094
   91    HB3  GLU  12           HB3      GLU  12 -10.792   4.059   8.282
   92    HG2  GLU  12           HG2      GLU  12  -9.922   2.004   9.261
   93    HG3  GLU  12           HG3      GLU  12  -8.276   2.599   9.056
   94    H    GLY  13           H        GLY  13 -11.847   2.674   5.517
   95    HA2  GLY  13           HA1      GLY  13 -13.143   4.554   4.524
   96    HA3  GLY  13           HA2      GLY  13 -11.612   5.126   3.878
   97    H    MET  14           H        MET  14 -12.470   1.735   3.966
   98    HA   MET  14           HA       MET  14 -11.961   1.376   1.204
   99    HB2  MET  14           HB2      MET  14 -13.312  -0.395   3.234
  100    HB3  MET  14           HB3      MET  14 -12.947  -0.905   1.591
  101    HG2  MET  14           HG2      MET  14 -10.928  -0.031   3.649
  102    HG3  MET  14           HG3      MET  14 -11.294  -1.698   3.211
  103    HE1  MET  14           HE1      MET  14  -8.871  -2.358   2.631
  104    HE2  MET  14           HE2      MET  14  -7.787  -1.389   1.635
  105    HE3  MET  14           HE3      MET  14  -8.342  -0.772   3.190
  106    H    SER  15           H        SER  15 -13.245   1.634  -0.512
  107    HA   SER  15           HA       SER  15 -16.014   2.399  -0.037
  108    HB2  SER  15           HB2      SER  15 -14.687   3.905  -1.412
  109    HB3  SER  15           HB3      SER  15 -14.310   2.595  -2.532
  110    HG   SER  15           HG       SER  15 -16.397   4.236  -2.565
  111    H    CYS  16           H        CYS  16 -14.586   0.599  -2.782
  112    HA   CYS  16           HA       CYS  16 -16.579  -1.495  -2.382
  113    HB2  CYS  16           HB2      CYS  16 -17.358  -1.323  -4.709
  114    HB3  CYS  16           HB3      CYS  16 -17.694   0.147  -3.804
  115    HG   CYS  16           HG       CYS  16 -15.657   1.635  -4.955
  116    H    GLY  17           H        GLY  17 -16.296  -2.943  -4.635
  117    HA2  GLY  17           HA1      GLY  17 -13.885  -4.318  -4.067
  118    HA3  GLY  17           HA2      GLY  17 -15.012  -4.696  -5.358
  119    H    HIS  18           H        HIS  18 -14.814  -2.200  -6.763
  120    HA   HIS  18           HA       HIS  18 -12.505  -2.745  -8.316
  121    HB2  HIS  18           HB2      HIS  18 -14.576  -1.664  -9.208
  122    HB3  HIS  18           HB3      HIS  18 -14.147  -0.205  -8.322
  123    HD1  HIS  18           HD1      HIS  18 -12.587   1.398  -9.455
  124    HD2  HIS  18           HD2      HIS  18 -12.667  -2.331 -11.301
  125    HE1  HIS  18           HE1      HIS  18 -11.246   1.655 -11.569
  126    HE2  HIS  18           HE2      HIS  18 -11.139  -0.658 -12.560
  127    H    CYS  19           H        CYS  19 -13.176  -0.564  -5.678
  128    HA   CYS  19           HA       CYS  19 -10.898   1.084  -5.917
  129    HB2  CYS  19           HB2      CYS  19 -12.430   0.316  -3.425
  130    HB3  CYS  19           HB3      CYS  19 -11.329   1.682  -3.580
  131    HG   CYS  19           HG       CYS  19 -12.917   3.294  -4.954
  132    H    VAL  20           H        VAL  20 -11.413  -2.103  -4.647
  133    HA   VAL  20           HA       VAL  20  -9.070  -2.426  -3.121
  134    HB   VAL  20           HB       VAL  20 -10.565  -4.513  -4.728
  135   HG11  VAL  20          2HG1      VAL  20  -9.630  -6.125  -3.148
  136   HG12  VAL  20          1HG1      VAL  20  -8.710  -4.833  -2.377
  137   HG13  VAL  20          3HG1      VAL  20  -8.363  -5.287  -4.046
  138   HG21  VAL  20          3HG2      VAL  20 -12.056  -3.367  -3.208
  139   HG22  VAL  20          2HG2      VAL  20 -10.933  -3.620  -1.874
  140   HG23  VAL  20          1HG2      VAL  20 -11.736  -4.998  -2.622
  141    H    ASN  21           H        ASN  21  -9.770  -3.120  -6.525
  142    HA   ASN  21           HA       ASN  21  -7.185  -4.034  -7.215
  143    HB2  ASN  21           HB2      ASN  21  -9.203  -2.702  -9.035
  144    HB3  ASN  21           HB3      ASN  21  -7.880  -3.750  -9.528
  145   HD21  ASN  21          1HD2      ASN  21  -8.357  -5.617  -7.289
  146   HD22  ASN  21          2HD2      ASN  21  -9.784  -6.500  -7.717
  147    H    ALA  22           H        ALA  22  -8.752  -0.885  -7.340
  148    HA   ALA  22           HA       ALA  22  -6.786   0.553  -8.680
  149    HB1  ALA  22           HB1      ALA  22  -9.027   1.415  -8.264
  150    HB2  ALA  22           HB2      ALA  22  -8.664   1.551  -6.544
  151    HB3  ALA  22           HB3      ALA  22  -7.794   2.546  -7.711
  152    H    ILE  23           H        ILE  23  -7.258   0.293  -5.134
  153    HA   ILE  23           HA       ILE  23  -4.967   1.814  -4.503
  154    HB   ILE  23           HB       ILE  23  -6.711   1.522  -2.847
  155   HG12  ILE  23          2HG1      ILE  23  -4.110   0.249  -1.975
  156   HG13  ILE  23          3HG1      ILE  23  -4.449   1.976  -2.040
  157   HG21  ILE  23          2HG2      ILE  23  -7.040  -0.609  -1.668
  158   HG22  ILE  23          1HG2      ILE  23  -5.934  -1.387  -2.799
  159   HG23  ILE  23          3HG2      ILE  23  -7.459  -0.716  -3.378
  160   HD11  ILE  23          3HD1      ILE  23  -6.164   1.697  -0.321
  161   HD12  ILE  23          2HD1      ILE  23  -4.582   1.149   0.232
  162   HD13  ILE  23          1HD1      ILE  23  -5.804  -0.028  -0.250
  163    H    GLU  24           H        GLU  24  -5.470  -1.638  -4.973
  164    HA   GLU  24           HA       GLU  24  -3.061  -2.645  -4.063
  165    HB2  GLU  24           HB2      GLU  24  -4.865  -4.088  -4.778
  166    HB3  GLU  24           HB3      GLU  24  -4.724  -3.506  -6.434
  167    HG2  GLU  24           HG2      GLU  24  -2.423  -4.461  -6.492
  168    HG3  GLU  24           HG3      GLU  24  -2.738  -5.167  -4.907
  169    H    SER  25           H        SER  25  -3.794  -1.639  -7.428
  170    HA   SER  25           HA       SER  25  -1.061  -1.906  -8.200
  171    HB2  SER  25           HB2      SER  25  -1.845  -0.592 -10.249
  172    HB3  SER  25           HB3      SER  25  -2.549  -2.195  -9.980
  173    HG   SER  25           HG       SER  25  -4.440  -1.307  -9.449
  174    H    SER  26           H        SER  26  -3.004   0.773  -7.027
  175    HA   SER  26           HA       SER  26  -1.339   2.881  -7.732
  176    HB2  SER  26           HB2      SER  26  -2.946   2.502  -5.215
  177    HB3  SER  26           HB3      SER  26  -2.217   4.028  -5.705
  178    HG   SER  26           HG       SER  26  -4.240   2.544  -7.043
  179    H    VAL  27           H        VAL  27  -1.048   0.519  -5.151
  180    HA   VAL  27           HA       VAL  27   1.435   1.642  -4.189
  181    HB   VAL  27           HB       VAL  27   0.205  -1.067  -3.648
  182   HG11  VAL  27          2HG1      VAL  27   2.401   0.421  -2.211
  183   HG12  VAL  27          1HG1      VAL  27   2.603  -1.028  -3.195
  184   HG13  VAL  27          3HG1      VAL  27   1.685  -1.103  -1.691
  185   HG21  VAL  27          3HG2      VAL  27   0.091   1.485  -2.046
  186   HG22  VAL  27          2HG2      VAL  27  -0.546  -0.077  -1.535
  187   HG23  VAL  27          1HG2      VAL  27  -1.250   0.752  -2.926
  188    H    LYS  28           H        LYS  28   0.427  -1.093  -6.191
  189    HA   LYS  28           HA       LYS  28   2.910  -2.362  -6.442
  190    HB2  LYS  28           HB2      LYS  28   0.427  -3.037  -7.124
  191    HB3  LYS  28           HB3      LYS  28   0.957  -2.472  -8.698
  192    HG2  LYS  28           HG2      LYS  28   2.343  -4.614  -7.096
  193    HG3  LYS  28           HG3      LYS  28   1.184  -4.911  -8.390
  194    HD2  LYS  28           HD2      LYS  28   2.798  -4.741  -9.904
  195    HD3  LYS  28           HD3      LYS  28   3.195  -3.117  -9.335
  196    HE2  LYS  28           HE2      LYS  28   5.160  -4.485  -9.173
  197    HE3  LYS  28           HE3      LYS  28   4.571  -4.138  -7.549
  198    HZ1  LYS  28           HZ1      LYS  28   3.565  -6.330  -7.471
  199    HZ2  LYS  28           HZ2      LYS  28   5.219  -6.464  -7.800
  200    HZ3  LYS  28           HZ3      LYS  28   4.088  -6.661  -9.049
  201    H    GLU  29           H        GLU  29   1.399   0.130  -8.463
  202    HA   GLU  29           HA       GLU  29   3.237   0.047 -10.590
  203    HB2  GLU  29           HB2      GLU  29   1.332   2.144  -9.603
  204    HB3  GLU  29           HB3      GLU  29   2.393   2.444 -10.975
  205    HG2  GLU  29           HG2      GLU  29   0.633   0.040 -10.875
  206    HG3  GLU  29           HG3      GLU  29   0.024   1.601 -11.434
  207    H    LEU  30           H        LEU  30   3.422   1.410  -7.460
  208    HA   LEU  30           HA       LEU  30   5.372   3.410  -7.993
  209    HB2  LEU  30           HB2      LEU  30   4.937   1.924  -5.405
  210    HB3  LEU  30           HB3      LEU  30   5.812   3.430  -5.599
  211    HG   LEU  30           HG       LEU  30   2.860   2.949  -5.792
  212   HD11  LEU  30          2HD1      LEU  30   4.530   4.881  -4.198
  213   HD12  LEU  30          1HD1      LEU  30   3.775   3.406  -3.592
  214   HD13  LEU  30          3HD1      LEU  30   2.772   4.746  -4.149
  215   HD21  LEU  30          3HD2      LEU  30   4.382   5.361  -6.767
  216   HD22  LEU  30          2HD2      LEU  30   2.639   5.316  -6.498
  217   HD23  LEU  30          1HD2      LEU  30   3.367   4.282  -7.727
  218    H    ASN  31           H        ASN  31   7.595   3.400  -7.782
  219    HA   ASN  31           HA       ASN  31   8.827   0.918  -8.573
  220    HB2  ASN  31           HB2      ASN  31   9.486   3.105  -9.562
  221    HB3  ASN  31           HB3      ASN  31  10.115   3.596  -7.992
  222   HD21  ASN  31          1HD2      ASN  31  10.597   1.603 -10.781
  223   HD22  ASN  31          2HD2      ASN  31  12.223   1.129 -10.412
  224    H    GLY  32           H        GLY  32   9.983  -0.442  -7.342
  225    HA2  GLY  32           HA1      GLY  32  11.450  -0.926  -5.513
  226    HA3  GLY  32           HA2      GLY  32  10.747   0.431  -4.644
  227    H    VAL  33           H        VAL  33   8.096  -0.760  -5.848
  228    HA   VAL  33           HA       VAL  33   7.495  -2.330  -3.493
  229    HB   VAL  33           HB       VAL  33   5.769  -1.380  -5.782
  230   HG11  VAL  33          2HG1      VAL  33   4.901  -3.511  -4.992
  231   HG12  VAL  33          1HG1      VAL  33   3.851  -2.195  -4.476
  232   HG13  VAL  33          3HG1      VAL  33   4.960  -2.940  -3.325
  233   HG21  VAL  33          3HG2      VAL  33   4.757   0.018  -4.025
  234   HG22  VAL  33          2HG2      VAL  33   6.473   0.360  -4.254
  235   HG23  VAL  33          1HG2      VAL  33   5.945  -0.604  -2.877
  236    H    GLU  34           H        GLU  34   7.645  -4.420  -3.398
  237    HA   GLU  34           HA       GLU  34   8.160  -5.969  -5.799
  238    HB2  GLU  34           HB2      GLU  34   8.107  -6.719  -2.874
  239    HB3  GLU  34           HB3      GLU  34   8.531  -7.826  -4.174
  240    HG2  GLU  34           HG2      GLU  34   9.995  -5.298  -3.469
  241    HG3  GLU  34           HG3      GLU  34  10.494  -6.939  -3.055
  242    H    GLN  35           H        GLN  35   6.126  -6.577  -2.964
  243    HA   GLN  35           HA       GLN  35   3.978  -7.471  -4.743
  244    HB2  GLN  35           HB2      GLN  35   5.024  -8.944  -2.316
  245    HB3  GLN  35           HB3      GLN  35   3.533  -9.349  -3.156
  246    HG2  GLN  35           HG2      GLN  35   4.791  -9.836  -5.178
  247    HG3  GLN  35           HG3      GLN  35   6.290  -9.399  -4.359
  248   HE21  GLN  35          1HE2      GLN  35   5.444 -11.921  -5.596
  249   HE22  GLN  35          2HE2      GLN  35   5.582 -13.121  -4.351
  250    H    VAL  36           H        VAL  36   1.974  -6.939  -4.100
  251    HA   VAL  36           HA       VAL  36   1.637  -5.714  -1.456
  252    HB   VAL  36           HB       VAL  36   1.883  -3.835  -2.923
  253   HG11  VAL  36          2HG1      VAL  36   1.549  -4.928  -5.059
  254   HG12  VAL  36          1HG1      VAL  36   0.499  -3.516  -4.928
  255   HG13  VAL  36          3HG1      VAL  36  -0.168  -5.135  -4.710
  256   HG21  VAL  36          3HG2      VAL  36   0.100  -3.631  -1.278
  257   HG22  VAL  36          2HG2      VAL  36  -1.054  -4.308  -2.430
  258   HG23  VAL  36          1HG2      VAL  36  -0.299  -2.747  -2.751
  259    H    LYS  37           H        LYS  37  -0.045  -6.566  -0.398
  260    HA   LYS  37           HA       LYS  37  -2.230  -7.657  -2.027
  261    HB2  LYS  37           HB2      LYS  37  -2.548  -9.448  -0.367
  262    HB3  LYS  37           HB3      LYS  37  -0.982  -9.533  -1.153
  263    HG2  LYS  37           HG2      LYS  37   0.001  -8.431   0.859
  264    HG3  LYS  37           HG3      LYS  37  -1.575  -8.590   1.641
  265    HD2  LYS  37           HD2      LYS  37  -1.444 -11.057   1.157
  266    HD3  LYS  37           HD3      LYS  37   0.230 -10.797   0.664
  267    HE2  LYS  37           HE2      LYS  37   0.285 -11.513   2.922
  268    HE3  LYS  37           HE3      LYS  37   0.628  -9.784   2.929
  269    HZ1  LYS  37           HZ1      LYS  37  -1.924 -11.120   3.642
  270    HZ2  LYS  37           HZ2      LYS  37  -1.781  -9.448   3.426
  271    HZ3  LYS  37           HZ3      LYS  37  -0.910 -10.212   4.658
  272    H    VAL  38           H        VAL  38  -3.872  -6.357  -1.802
  273    HA   VAL  38           HA       VAL  38  -4.290  -4.907   0.669
  274    HB   VAL  38           HB       VAL  38  -4.652  -3.638  -1.333
  275   HG11  VAL  38          2HG1      VAL  38  -5.119  -5.498  -2.852
  276   HG12  VAL  38          1HG1      VAL  38  -6.320  -4.214  -3.002
  277   HG13  VAL  38          3HG1      VAL  38  -6.711  -5.690  -2.119
  278   HG21  VAL  38          3HG2      VAL  38  -6.951  -2.864  -1.017
  279   HG22  VAL  38          2HG2      VAL  38  -6.143  -3.133   0.527
  280   HG23  VAL  38          1HG2      VAL  38  -7.309  -4.312  -0.074
  281    H    GLN  39           H        GLN  39  -5.610  -5.500   2.230
  282    HA   GLN  39           HA       GLN  39  -7.271  -7.882   1.790
  283    HB2  GLN  39           HB2      GLN  39  -6.210  -6.720   4.376
  284    HB3  GLN  39           HB3      GLN  39  -7.089  -8.235   4.205
  285    HG2  GLN  39           HG2      GLN  39  -5.317  -9.271   3.079
  286    HG3  GLN  39           HG3      GLN  39  -4.517  -7.738   2.754
  287   HE21  GLN  39          1HE2      GLN  39  -5.879  -8.601   5.861
  288   HE22  GLN  39          2HE2      GLN  39  -4.373  -8.724   6.690
  289    H    LEU  40           H        LEU  40  -9.144  -7.011   1.059
  290    HA   LEU  40           HA       LEU  40 -10.252  -4.568   1.922
  291    HB2  LEU  40           HB2      LEU  40 -10.705  -5.821  -0.234
  292    HB3  LEU  40           HB3      LEU  40 -11.743  -6.885   0.687
  293    HG   LEU  40           HG       LEU  40 -12.867  -5.030  -0.653
  294   HD11  LEU  40          2HD1      LEU  40 -14.546  -4.584   1.069
  295   HD12  LEU  40          1HD1      LEU  40 -13.448  -5.213   2.299
  296   HD13  LEU  40          3HD1      LEU  40 -14.071  -6.283   1.043
  297   HD21  LEU  40          3HD2      LEU  40 -11.785  -3.357   1.609
  298   HD22  LEU  40          2HD2      LEU  40 -12.991  -2.837   0.431
  299   HD23  LEU  40          1HD2      LEU  40 -11.353  -3.220  -0.098
  300    H    ALA  41           H        ALA  41 -10.669  -7.873   2.963
  301    HA   ALA  41           HA       ALA  41 -12.995  -7.597   4.491
  302    HB1  ALA  41           HB1      ALA  41 -10.719  -9.532   4.887
  303    HB2  ALA  41           HB2      ALA  41 -12.356  -9.701   5.523
  304    HB3  ALA  41           HB3      ALA  41 -12.077  -9.748   3.783
  305    H    GLU  42           H        GLU  42  -9.679  -6.796   5.249
  306    HA   GLU  42           HA       GLU  42 -10.410  -6.427   8.071
  307    HB2  GLU  42           HB2      GLU  42  -7.762  -6.868   6.720
  308    HB3  GLU  42           HB3      GLU  42  -7.870  -6.256   8.363
  309    HG2  GLU  42           HG2      GLU  42  -9.195  -8.269   8.964
  310    HG3  GLU  42           HG3      GLU  42  -8.918  -8.885   7.338
  311    H    GLY  43           H        GLY  43  -9.258  -4.750   5.241
  312    HA2  GLY  43           HA1      GLY  43  -9.302  -2.416   4.928
  313    HA3  GLY  43           HA2      GLY  43  -9.484  -2.212   6.670
  314    H    THR  44           H        THR  44  -7.069  -4.232   5.128
  315    HA   THR  44           HA       THR  44  -5.008  -2.251   5.813
  316    HB   THR  44           HB       THR  44  -3.602  -4.323   6.483
  317    HG1  THR  44           HG1      THR  44  -5.112  -5.922   7.492
  318   HG21  THR  44          3HG2      THR  44  -4.275  -2.593   8.061
  319   HG22  THR  44          1HG2      THR  44  -4.407  -4.190   8.799
  320   HG23  THR  44          2HG2      THR  44  -5.856  -3.355   8.240
  321    H    VAL  45           H        VAL  45  -2.984  -2.572   4.745
  322    HA   VAL  45           HA       VAL  45  -3.041  -4.360   2.416
  323    HB   VAL  45           HB       VAL  45  -2.058  -1.494   2.344
  324   HG11  VAL  45          2HG1      VAL  45  -0.726  -2.975   0.947
  325   HG12  VAL  45          1HG1      VAL  45  -1.710  -1.899  -0.044
  326   HG13  VAL  45          3HG1      VAL  45  -2.189  -3.583   0.173
  327   HG21  VAL  45          3HG2      VAL  45  -4.496  -1.605   2.338
  328   HG22  VAL  45          2HG2      VAL  45  -4.450  -2.746   0.996
  329   HG23  VAL  45          1HG2      VAL  45  -3.882  -1.092   0.768
  330    H    GLU  46           H        GLU  46  -1.426  -5.756   2.733
  331    HA   GLU  46           HA       GLU  46   0.977  -4.841   4.132
  332    HB2  GLU  46           HB2      GLU  46   0.105  -7.630   3.357
  333    HB3  GLU  46           HB3      GLU  46   1.607  -7.246   4.186
  334    HG2  GLU  46           HG2      GLU  46   0.134  -6.142   5.953
  335    HG3  GLU  46           HG3      GLU  46  -1.201  -7.006   5.194
  336    H    VAL  47           H        VAL  47   2.761  -4.345   3.091
  337    HA   VAL  47           HA       VAL  47   3.044  -5.205   0.284
  338    HB   VAL  47           HB       VAL  47   3.802  -2.449   1.238
  339   HG11  VAL  47          2HG1      VAL  47   3.344  -3.571  -1.522
  340   HG12  VAL  47          1HG1      VAL  47   4.912  -3.261  -0.777
  341   HG13  VAL  47          3HG1      VAL  47   3.826  -1.918  -1.138
  342   HG21  VAL  47          3HG2      VAL  47   1.227  -3.241  -0.115
  343   HG22  VAL  47          2HG2      VAL  47   1.766  -1.589   0.190
  344   HG23  VAL  47          1HG2      VAL  47   1.400  -2.662   1.540
  345    H    THR  48           H        THR  48   5.093  -5.711  -0.361
  346    HA   THR  48           HA       THR  48   7.264  -5.368   1.591
  347    HB   THR  48           HB       THR  48   7.554  -6.886  -0.991
  348    HG1  THR  48           HG1      THR  48   5.926  -7.512   1.152
  349   HG21  THR  48          3HG2      THR  48   8.753  -7.219   1.764
  350   HG22  THR  48          1HG2      THR  48   9.540  -6.465   0.381
  351   HG23  THR  48          2HG2      THR  48   9.152  -8.185   0.342
  352    H    ILE  49           H        ILE  49   8.263  -3.436   1.332
  353    HA   ILE  49           HA       ILE  49   8.592  -2.442  -1.429
  354    HB   ILE  49           HB       ILE  49   8.563  -0.179  -0.617
  355   HG12  ILE  49          2HG1      ILE  49   8.063  -1.243   2.170
  356   HG13  ILE  49          3HG1      ILE  49   9.649  -0.736   1.600
  357   HG21  ILE  49          2HG2      ILE  49   6.408  -1.171  -1.123
  358   HG22  ILE  49          1HG2      ILE  49   6.264  -0.007   0.195
  359   HG23  ILE  49          3HG2      ILE  49   6.260  -1.739   0.542
  360   HD11  ILE  49          3HD1      ILE  49   7.205   1.012   1.796
  361   HD12  ILE  49          2HD1      ILE  49   8.794   1.518   1.220
  362   HD13  ILE  49          1HD1      ILE  49   8.585   1.013   2.896
  363    H    ASP  50           H        ASP  50  10.555  -1.621  -2.051
  364    HA   ASP  50           HA       ASP  50  12.832  -2.216  -0.370
  365    HB2  ASP  50           HB2      ASP  50  12.816  -2.499  -2.898
  366    HB3  ASP  50           HB3      ASP  50  12.855  -0.742  -3.013
  367    H    SER  51           H        SER  51  13.138  -0.874   1.282
  368    HA   SER  51           HA       SER  51  11.999   1.748   1.319
  369    HB2  SER  51           HB2      SER  51  12.955   1.822   3.618
  370    HB3  SER  51           HB3      SER  51  11.985   0.381   3.316
  371    HG   SER  51           HG       SER  51  13.709  -0.632   4.002
  372    H    SER  52           H        SER  52  14.830   0.605   0.053
  373    HA   SER  52           HA       SER  52  16.460   2.922   0.646
  374    HB2  SER  52           HB2      SER  52  17.440   0.637   0.352
  375    HB3  SER  52           HB3      SER  52  16.939   0.681  -1.336
  376    HG   SER  52           HG       SER  52  18.407   2.873  -0.496
  377    H    VAL  53           H        VAL  53  13.912   2.243  -1.339
  378    HA   VAL  53           HA       VAL  53  14.666   4.384  -3.217
  379    HB   VAL  53           HB       VAL  53  13.025   1.930  -3.873
  380   HG11  VAL  53          2HG1      VAL  53  13.879   4.236  -5.616
  381   HG12  VAL  53          1HG1      VAL  53  12.238   3.899  -5.064
  382   HG13  VAL  53          3HG1      VAL  53  13.045   2.783  -6.167
  383   HG21  VAL  53          3HG2      VAL  53  15.775   2.738  -4.810
  384   HG22  VAL  53          2HG2      VAL  53  14.870   1.323  -5.353
  385   HG23  VAL  53          1HG2      VAL  53  15.412   1.438  -3.675
  386    H    VAL  54           H        VAL  54  11.762   2.505  -2.346
  387    HA   VAL  54           HA       VAL  54  10.244   5.007  -2.306
  388    HB   VAL  54           HB       VAL  54   9.355   3.210  -3.722
  389   HG11  VAL  54          2HG1      VAL  54  10.153   1.270  -2.510
  390   HG12  VAL  54          1HG1      VAL  54   8.404   1.182  -2.738
  391   HG13  VAL  54          3HG1      VAL  54   9.069   1.641  -1.170
  392   HG21  VAL  54          3HG2      VAL  54   7.787   4.786  -2.775
  393   HG22  VAL  54          2HG2      VAL  54   7.635   3.801  -1.320
  394   HG23  VAL  54          1HG2      VAL  54   7.055   3.185  -2.868
  395    H    THR  55           H        THR  55   9.237   5.766  -0.493
  396    HA   THR  55           HA       THR  55  10.000   4.455   2.024
  397    HB   THR  55           HB       THR  55   9.424   6.615   3.100
  398    HG1  THR  55           HG1      THR  55   8.789   7.319   0.413
  399   HG21  THR  55          3HG2      THR  55  11.319   7.896   2.232
  400   HG22  THR  55          1HG2      THR  55  11.369   6.861   0.805
  401   HG23  THR  55          2HG2      THR  55  11.725   6.190   2.395
  402    H    LEU  56           H        LEU  56   8.179   5.245   3.816
  403    HA   LEU  56           HA       LEU  56   5.867   3.719   3.103
  404    HB2  LEU  56           HB2      LEU  56   6.203   5.528   5.504
  405    HB3  LEU  56           HB3      LEU  56   4.943   4.345   5.269
  406    HG   LEU  56           HG       LEU  56   6.830   2.593   5.212
  407   HD11  LEU  56          2HD1      LEU  56   8.770   3.250   6.651
  408   HD12  LEU  56          1HD1      LEU  56   8.289   4.931   6.420
  409   HD13  LEU  56          3HD1      LEU  56   8.767   3.947   5.036
  410   HD21  LEU  56          3HD2      LEU  56   6.803   2.432   7.659
  411   HD22  LEU  56          2HD2      LEU  56   5.203   2.761   6.990
  412   HD23  LEU  56          1HD2      LEU  56   6.128   4.059   7.745
  413    H    LYS  57           H        LYS  57   6.629   7.117   3.571
  414    HA   LYS  57           HA       LYS  57   4.116   8.236   3.419
  415    HB2  LYS  57           HB2      LYS  57   6.706   9.182   3.502
  416    HB3  LYS  57           HB3      LYS  57   6.097   9.797   1.970
  417    HG2  LYS  57           HG2      LYS  57   4.778  10.152   4.647
  418    HG3  LYS  57           HG3      LYS  57   5.735  11.376   3.805
  419    HD2  LYS  57           HD2      LYS  57   4.092  11.195   1.909
  420    HD3  LYS  57           HD3      LYS  57   3.106  10.167   2.957
  421    HE2  LYS  57           HE2      LYS  57   3.946  13.000   3.577
  422    HE3  LYS  57           HE3      LYS  57   2.366  12.524   2.958
  423    HZ1  LYS  57           HZ1      LYS  57   1.927  11.315   4.944
  424    HZ2  LYS  57           HZ2      LYS  57   2.452  12.862   5.398
  425    HZ3  LYS  57           HZ3      LYS  57   3.507  11.541   5.519
  426    H    ASP  58           H        ASP  58   6.232   7.241   0.746
  427    HA   ASP  58           HA       ASP  58   4.730   8.241  -1.393
  428    HB2  ASP  58           HB2      ASP  58   6.352   5.694  -1.215
  429    HB3  ASP  58           HB3      ASP  58   5.694   6.336  -2.713
  430    H    ILE  59           H        ILE  59   4.551   5.068   0.171
  431    HA   ILE  59           HA       ILE  59   2.339   4.124  -1.315
  432    HB   ILE  59           HB       ILE  59   3.075   3.281   1.494
  433   HG12  ILE  59          2HG1      ILE  59   5.095   3.255   0.081
  434   HG13  ILE  59          3HG1      ILE  59   4.587   1.625   0.510
  435   HG21  ILE  59          2HG2      ILE  59   1.768   1.797  -0.781
  436   HG22  ILE  59          1HG2      ILE  59   0.966   2.406   0.668
  437   HG23  ILE  59          3HG2      ILE  59   2.164   1.117   0.798
  438   HD11  ILE  59          3HD1      ILE  59   5.308   1.751  -1.800
  439   HD12  ILE  59          2HD1      ILE  59   4.098   2.992  -2.126
  440   HD13  ILE  59          1HD1      ILE  59   3.593   1.357  -1.701
  441    H    VAL  60           H        VAL  60   2.627   5.575   1.894
  442    HA   VAL  60           HA       VAL  60  -0.038   5.444   2.686
  443    HB   VAL  60           HB       VAL  60   1.982   7.589   3.387
  444   HG11  VAL  60          2HG1      VAL  60  -0.270   8.207   4.049
  445   HG12  VAL  60          1HG1      VAL  60   0.717   7.813   5.460
  446   HG13  VAL  60          3HG1      VAL  60  -0.470   6.653   4.861
  447   HG21  VAL  60          3HG2      VAL  60   1.415   4.942   4.710
  448   HG22  VAL  60          2HG2      VAL  60   2.478   6.199   5.345
  449   HG23  VAL  60          1HG2      VAL  60   2.880   5.386   3.832
  450    H    ALA  61           H        ALA  61   1.677   8.166   1.145
  451    HA   ALA  61           HA       ALA  61  -0.563   9.867   1.063
  452    HB1  ALA  61           HB1      ALA  61   1.744  10.676   0.912
  453    HB2  ALA  61           HB2      ALA  61   1.889   9.948  -0.688
  454    HB3  ALA  61           HB3      ALA  61   0.749  11.267  -0.419
  455    H    VAL  62           H        VAL  62   0.796   7.672  -1.400
  456    HA   VAL  62           HA       VAL  62  -0.953   8.487  -3.461
  457    HB   VAL  62           HB       VAL  62   1.166   7.192  -3.794
  458   HG11  VAL  62          2HG1      VAL  62   0.993   4.726  -3.764
  459   HG12  VAL  62          1HG1      VAL  62  -0.536   4.895  -2.899
  460   HG13  VAL  62          3HG1      VAL  62   0.962   5.481  -2.169
  461   HG21  VAL  62          3HG2      VAL  62  -0.376   7.539  -5.620
  462   HG22  VAL  62          2HG2      VAL  62  -1.320   6.137  -5.119
  463   HG23  VAL  62          1HG2      VAL  62   0.322   5.924  -5.723
  464    H    ILE  63           H        ILE  63  -1.239   6.127  -0.901
  465    HA   ILE  63           HA       ILE  63  -3.693   4.986  -1.785
  466    HB   ILE  63           HB       ILE  63  -2.437   5.088   0.960
  467   HG12  ILE  63          2HG1      ILE  63  -2.745   2.841  -1.045
  468   HG13  ILE  63          3HG1      ILE  63  -1.256   3.724  -0.716
  469   HG21  ILE  63          2HG2      ILE  63  -4.846   4.943   1.218
  470   HG22  ILE  63          1HG2      ILE  63  -4.094   3.402   1.632
  471   HG23  ILE  63          3HG2      ILE  63  -4.909   3.598   0.081
  472   HD11  ILE  63          3HD1      ILE  63  -1.254   1.573   0.397
  473   HD12  ILE  63          2HD1      ILE  63  -2.753   1.983   1.228
  474   HD13  ILE  63          1HD1      ILE  63  -1.278   2.879   1.582
  475    H    GLU  64           H        GLU  64  -2.970   7.437   0.706
  476    HA   GLU  64           HA       GLU  64  -5.617   7.801   1.531
  477    HB2  GLU  64           HB2      GLU  64  -3.354   9.796   1.637
  478    HB3  GLU  64           HB3      GLU  64  -4.841   9.879   2.573
  479    HG2  GLU  64           HG2      GLU  64  -4.223   7.716   3.629
  480    HG3  GLU  64           HG3      GLU  64  -2.681   7.798   2.779
  481    H    ASP  65           H        ASP  65  -3.818   9.312  -1.066
  482    HA   ASP  65           HA       ASP  65  -5.516  11.485  -1.575
  483    HB2  ASP  65           HB2      ASP  65  -3.273  11.302  -2.528
  484    HB3  ASP  65           HB3      ASP  65  -3.783   9.930  -3.506
  485    H    GLN  66           H        GLN  66  -5.876   8.120  -2.303
  486    HA   GLN  66           HA       GLN  66  -7.762   8.428  -4.443
  487    HB2  GLN  66           HB2      GLN  66  -7.417   6.002  -2.686
  488    HB3  GLN  66           HB3      GLN  66  -8.022   6.061  -4.336
  489    HG2  GLN  66           HG2      GLN  66  -5.860   6.568  -5.184
  490    HG3  GLN  66           HG3      GLN  66  -5.218   6.794  -3.557
  491   HE21  GLN  66          1HE2      GLN  66  -3.672   5.259  -3.684
  492   HE22  GLN  66          2HE2      GLN  66  -4.012   3.565  -3.786
  493    H    GLY  67           H        GLY  67  -7.960   8.941  -1.155
  494    HA2  GLY  67           HA1      GLY  67 -10.068   9.765  -0.258
  495    HA3  GLY  67           HA2      GLY  67 -10.878   8.500  -1.173
  496    H    TYR  68           H        TYR  68  -7.938   8.134   0.724
  497    HA   TYR  68           HA       TYR  68  -9.432   6.415   2.594
  498    HB2  TYR  68           HB2      TYR  68  -6.668   5.887   1.482
  499    HB3  TYR  68           HB3      TYR  68  -7.484   4.913   2.696
  500    HD1  TYR  68           HD2      TYR  68  -9.778   3.886   1.969
  501    HD2  TYR  68           HD1      TYR  68  -6.830   5.298  -0.748
  502    HE1  TYR  68           HE2      TYR  68 -10.745   2.491   0.191
  503    HE2  TYR  68           HE1      TYR  68  -7.792   3.906  -2.529
  504    HH   TYR  68           HH       TYR  68  -9.153   1.884  -2.737
  505    H    ASP  69           H        ASP  69  -8.114   5.964   4.595
  506    HA   ASP  69           HA       ASP  69  -6.261   8.139   5.280
  507    HB2  ASP  69           HB2      ASP  69  -8.366   8.736   6.315
  508    HB3  ASP  69           HB3      ASP  69  -8.555   7.110   6.963
  509    H    VAL  70           H        VAL  70  -4.369   7.320   5.931
  510    HA   VAL  70           HA       VAL  70  -4.364   4.570   6.999
  511    HB   VAL  70           HB       VAL  70  -2.133   5.850   5.405
  512   HG11  VAL  70          2HG1      VAL  70  -1.347   4.137   6.922
  513   HG12  VAL  70          1HG1      VAL  70  -1.276   3.536   5.264
  514   HG13  VAL  70          3HG1      VAL  70  -2.577   3.012   6.340
  515   HG21  VAL  70          3HG2      VAL  70  -4.062   5.532   3.966
  516   HG22  VAL  70          2HG2      VAL  70  -4.213   3.859   4.501
  517   HG23  VAL  70          1HG2      VAL  70  -2.806   4.362   3.565
  518    H    GLN  71           H        GLN  71  -3.408   4.264   8.910
  519    HA   GLN  71           HA       GLN  71  -1.700   6.396   9.982
  520    HB2  GLN  71           HB2      GLN  71  -3.945   6.644  10.954
  521    HB3  GLN  71           HB3      GLN  71  -3.902   4.970  11.491
  522    HG2  GLN  71           HG2      GLN  71  -2.123   5.434  13.015
  523    HG3  GLN  71           HG3      GLN  71  -1.947   7.072  12.384
  524   HE21  GLN  71          1HE2      GLN  71  -3.462   8.627  12.918
  525   HE22  GLN  71          2HE2      GLN  71  -4.561   8.427  14.249
  Start of MODEL   12
    1    H1   SER   1           H1       SER   1  21.725  -0.478   0.690
    2    H2   SER   1           H2       SER   1  23.182  -1.140   0.126
    3    H3   SER   1           H3       SER   1  21.879  -2.158   0.505
    4    HA   SER   1           HA       SER   1  21.938  -0.156  -1.673
    5    HB2  SER   1           HB2      SER   1  21.987  -3.182  -1.793
    6    HB3  SER   1           HB3      SER   1  21.992  -2.088  -3.176
    7    HG   SER   1           HG       SER   1  24.048  -2.843  -1.503
    8    H    ASN   2           H        ASN   2  20.186  -2.866  -0.156
    9    HA   ASN   2           HA       ASN   2  17.695  -1.558  -1.012
   10    HB2  ASN   2           HB2      ASN   2  16.662  -3.808  -1.292
   11    HB3  ASN   2           HB3      ASN   2  17.946  -3.489  -2.451
   12   HD21  ASN   2          1HD2      ASN   2  18.170  -5.721  -2.799
   13   HD22  ASN   2          2HD2      ASN   2  19.000  -6.731  -1.653
   14    H    ALA   3           H        ALA   3  15.833  -2.108   0.332
   15    HA   ALA   3           HA       ALA   3  16.328  -3.417   2.868
   16    HB1  ALA   3           HB1      ALA   3  15.557  -0.498   2.821
   17    HB2  ALA   3           HB2      ALA   3  15.641  -1.525   4.251
   18    HB3  ALA   3           HB3      ALA   3  17.109  -1.147   3.350
   19    H    MET   4           H        MET   4  14.709  -4.830   2.555
   20    HA   MET   4           HA       MET   4  12.232  -4.047   1.341
   21    HB2  MET   4           HB2      MET   4  12.920  -6.651   2.707
   22    HB3  MET   4           HB3      MET   4  11.559  -6.363   1.632
   23    HG2  MET   4           HG2      MET   4  14.479  -6.347   0.910
   24    HG3  MET   4           HG3      MET   4  13.269  -7.540   0.444
   25    HE1  MET   4           HE1      MET   4  11.009  -5.505  -2.015
   26    HE2  MET   4           HE2      MET   4  11.314  -7.078  -1.278
   27    HE3  MET   4           HE3      MET   4  10.766  -5.726  -0.284
   28    H    GLU   5           H        GLU   5  10.611  -3.125   2.330
   29    HA   GLU   5           HA       GLU   5  10.377  -3.370   5.252
   30    HB2  GLU   5           HB2      GLU   5   9.092  -1.343   3.413
   31    HB3  GLU   5           HB3      GLU   5   9.042  -1.334   5.168
   32    HG2  GLU   5           HG2      GLU   5  11.471  -0.939   3.442
   33    HG3  GLU   5           HG3      GLU   5  10.616   0.296   4.364
   34    H    GLN   6           H        GLN   6   9.029  -4.965   5.795
   35    HA   GLN   6           HA       GLN   6   6.619  -5.479   4.247
   36    HB2  GLN   6           HB2      GLN   6   7.611  -6.735   6.808
   37    HB3  GLN   6           HB3      GLN   6   6.245  -7.296   5.855
   38    HG2  GLN   6           HG2      GLN   6   7.670  -7.915   4.048
   39    HG3  GLN   6           HG3      GLN   6   9.060  -7.153   4.819
   40   HE21  GLN   6          1HE2      GLN   6  10.000  -8.134   6.615
   41   HE22  GLN   6          2HE2      GLN   6   9.750  -9.810   6.973
   42    H    LEU   7           H        LEU   7   5.053  -4.001   4.536
   43    HA   LEU   7           HA       LEU   7   4.601  -3.016   7.281
   44    HB2  LEU   7           HB2      LEU   7   4.179  -1.525   4.690
   45    HB3  LEU   7           HB3      LEU   7   3.885  -0.896   6.299
   46    HG   LEU   7           HG       LEU   7   6.596  -1.710   5.250
   47   HD11  LEU   7          2HD1      LEU   7   5.395   1.031   5.603
   48   HD12  LEU   7          1HD1      LEU   7   5.723   0.232   4.066
   49   HD13  LEU   7          3HD1      LEU   7   7.058   0.680   5.129
   50   HD21  LEU   7          3HD2      LEU   7   5.777  -0.271   7.772
   51   HD22  LEU   7          2HD2      LEU   7   7.435  -0.547   7.238
   52   HD23  LEU   7          1HD2      LEU   7   6.408  -1.914   7.670
   53    H    THR   8           H        THR   8   2.609  -3.179   8.090
   54    HA   THR   8           HA       THR   8   0.424  -3.981   6.294
   55    HB   THR   8           HB       THR   8   0.642  -4.173   9.306
   56    HG1  THR   8           HG1      THR   8   1.750  -5.684   7.616
   57   HG21  THR   8          3HG2      THR   8  -1.549  -5.120   7.452
   58   HG22  THR   8          1HG2      THR   8  -1.672  -3.790   8.605
   59   HG23  THR   8          2HG2      THR   8  -1.458  -5.442   9.184
   60    H    LEU   9           H        LEU   9  -0.572  -2.227   5.544
   61    HA   LEU   9           HA       LEU   9  -0.841   0.140   7.236
   62    HB2  LEU   9           HB2      LEU   9  -1.430  -0.337   4.313
   63    HB3  LEU   9           HB3      LEU   9  -1.748   1.177   5.131
   64    HG   LEU   9           HG       LEU   9   0.742   1.283   5.640
   65   HD11  LEU   9          2HD1      LEU   9   2.212  -0.006   4.171
   66   HD12  LEU   9          1HD1      LEU   9   0.820  -0.896   3.559
   67   HD13  LEU   9          3HD1      LEU   9   1.294  -1.057   5.251
   68   HD21  LEU   9          3HD2      LEU   9  -0.303   2.651   3.931
   69   HD22  LEU   9          2HD2      LEU   9  -0.175   1.327   2.770
   70   HD23  LEU   9          1HD2      LEU   9   1.284   2.101   3.390
   71    H    GLN  10           H        GLN  10  -2.684   0.599   8.288
   72    HA   GLN  10           HA       GLN  10  -5.057  -0.964   7.766
   73    HB2  GLN  10           HB2      GLN  10  -6.059   0.270   9.641
   74    HB3  GLN  10           HB3      GLN  10  -4.506  -0.425  10.079
   75    HG2  GLN  10           HG2      GLN  10  -3.433   1.684   9.965
   76    HG3  GLN  10           HG3      GLN  10  -4.861   2.440   9.259
   77   HE21  GLN  10          1HE2      GLN  10  -3.399   3.152  11.676
   78   HE22  GLN  10          2HE2      GLN  10  -4.554   3.060  12.969
   79    H    VAL  11           H        VAL  11  -6.758  -0.375   6.575
   80    HA   VAL  11           HA       VAL  11  -6.472   2.178   5.153
   81    HB   VAL  11           HB       VAL  11  -8.015  -0.277   4.316
   82   HG11  VAL  11          2HG1      VAL  11  -7.262   2.209   2.785
   83   HG12  VAL  11          1HG1      VAL  11  -8.881   1.773   3.336
   84   HG13  VAL  11          3HG1      VAL  11  -8.070   0.791   2.115
   85   HG21  VAL  11          3HG2      VAL  11  -5.293   0.686   3.452
   86   HG22  VAL  11          2HG2      VAL  11  -6.181  -0.655   2.728
   87   HG23  VAL  11          1HG2      VAL  11  -5.639  -0.759   4.404
   88    H    GLU  12           H        GLU  12  -7.657   3.659   6.215
   89    HA   GLU  12           HA       GLU  12 -10.402   3.046   6.978
   90    HB2  GLU  12           HB2      GLU  12  -8.696   5.523   7.275
   91    HB3  GLU  12           HB3      GLU  12 -10.388   5.453   7.750
   92    HG2  GLU  12           HG2      GLU  12  -8.256   3.639   8.847
   93    HG3  GLU  12           HG3      GLU  12  -8.777   5.141   9.613
   94    H    GLY  13           H        GLY  13 -11.875   3.087   5.411
   95    HA2  GLY  13           HA1      GLY  13 -13.188   4.745   4.105
   96    HA3  GLY  13           HA2      GLY  13 -11.659   5.240   3.396
   97    H    MET  14           H        MET  14 -12.530   1.894   4.013
   98    HA   MET  14           HA       MET  14 -12.067   1.083   1.340
   99    HB2  MET  14           HB2      MET  14 -13.364  -0.239   3.710
  100    HB3  MET  14           HB3      MET  14 -13.346  -1.022   2.138
  101    HG2  MET  14           HG2      MET  14 -10.888  -0.115   3.613
  102    HG3  MET  14           HG3      MET  14 -11.537  -1.753   3.656
  103    HE1  MET  14           HE1      MET  14  -8.560  -1.384   2.877
  104    HE2  MET  14           HE2      MET  14  -9.421  -2.924   2.840
  105    HE3  MET  14           HE3      MET  14  -8.458  -2.416   1.450
  106    H    SER  15           H        SER  15 -13.427   0.776  -0.356
  107    HA   SER  15           HA       SER  15 -16.074   1.941  -0.149
  108    HB2  SER  15           HB2      SER  15 -14.680   2.581  -2.056
  109    HB3  SER  15           HB3      SER  15 -14.552   0.893  -2.550
  110    HG   SER  15           HG       SER  15 -16.726   2.658  -2.729
  111    H    CYS  16           H        CYS  16 -15.246  -0.805  -2.212
  112    HA   CYS  16           HA       CYS  16 -16.914  -2.599  -0.661
  113    HB2  CYS  16           HB2      CYS  16 -17.609  -1.863  -3.514
  114    HB3  CYS  16           HB3      CYS  16 -18.360  -3.163  -2.591
  115    HG   CYS  16           HG       CYS  16 -18.658  -0.548  -0.736
  116    H    GLY  17           H        GLY  17 -15.837  -2.597  -4.073
  117    HA2  GLY  17           HA1      GLY  17 -14.097  -4.880  -3.389
  118    HA3  GLY  17           HA2      GLY  17 -15.235  -4.992  -4.720
  119    H    HIS  18           H        HIS  18 -14.931  -2.530  -5.947
  120    HA   HIS  18           HA       HIS  18 -12.588  -3.091  -7.461
  121    HB2  HIS  18           HB2      HIS  18 -13.265  -1.426  -8.948
  122    HB3  HIS  18           HB3      HIS  18 -14.785  -1.977  -8.259
  123    HD1  HIS  18           HD1      HIS  18 -12.658   0.989  -8.688
  124    HD2  HIS  18           HD2      HIS  18 -15.969  -0.096  -6.414
  125    HE1  HIS  18           HE1      HIS  18 -13.636   3.147  -7.834
  126    HE2  HIS  18           HE2      HIS  18 -15.575   2.462  -6.369
  127    H    CYS  19           H        CYS  19 -13.111  -1.316  -4.646
  128    HA   CYS  19           HA       CYS  19 -11.137   0.675  -4.837
  129    HB2  CYS  19           HB2      CYS  19 -11.182   0.551  -2.302
  130    HB3  CYS  19           HB3      CYS  19 -12.733   0.851  -3.081
  131    HG   CYS  19           HG       CYS  19 -11.825  -1.624  -1.073
  132    H    VAL  20           H        VAL  20 -11.013  -2.736  -4.114
  133    HA   VAL  20           HA       VAL  20  -8.422  -2.862  -3.007
  134    HB   VAL  20           HB       VAL  20  -9.904  -4.969  -4.597
  135   HG11  VAL  20          2HG1      VAL  20  -7.542  -5.491  -4.475
  136   HG12  VAL  20          1HG1      VAL  20  -8.444  -6.569  -3.410
  137   HG13  VAL  20          3HG1      VAL  20  -7.543  -5.213  -2.733
  138   HG21  VAL  20          3HG2      VAL  20  -9.768  -4.486  -1.622
  139   HG22  VAL  20          2HG2      VAL  20 -10.549  -5.861  -2.403
  140   HG23  VAL  20          1HG2      VAL  20 -11.172  -4.231  -2.659
  141    H    ASN  21           H        ASN  21  -9.549  -3.556  -6.309
  142    HA   ASN  21           HA       ASN  21  -7.151  -3.894  -7.609
  143    HB2  ASN  21           HB2      ASN  21  -9.226  -4.257  -8.768
  144    HB3  ASN  21           HB3      ASN  21  -9.704  -2.575  -8.560
  145   HD21  ASN  21          1HD2      ASN  21  -9.977  -2.199 -10.733
  146   HD22  ASN  21          2HD2      ASN  21  -8.645  -2.115 -11.849
  147    H    ALA  22           H        ALA  22  -8.885  -0.857  -7.045
  148    HA   ALA  22           HA       ALA  22  -7.148   0.879  -8.335
  149    HB1  ALA  22           HB1      ALA  22  -8.140   2.641  -6.993
  150    HB2  ALA  22           HB2      ALA  22  -9.377   1.505  -7.531
  151    HB3  ALA  22           HB3      ALA  22  -8.786   1.444  -5.870
  152    H    ILE  23           H        ILE  23  -7.258   0.280  -4.800
  153    HA   ILE  23           HA       ILE  23  -4.952   1.831  -4.305
  154    HB   ILE  23           HB       ILE  23  -6.567   1.456  -2.544
  155   HG12  ILE  23          2HG1      ILE  23  -3.868   0.249  -1.899
  156   HG13  ILE  23          3HG1      ILE  23  -4.272   1.963  -1.888
  157   HG21  ILE  23          2HG2      ILE  23  -7.286  -0.792  -3.071
  158   HG22  ILE  23          1HG2      ILE  23  -6.742  -0.714  -1.394
  159   HG23  ILE  23          3HG2      ILE  23  -5.703  -1.430  -2.627
  160   HD11  ILE  23          3HD1      ILE  23  -5.443  -0.127  -0.066
  161   HD12  ILE  23          2HD1      ILE  23  -5.825   1.594  -0.050
  162   HD13  ILE  23          1HD1      ILE  23  -4.200   1.049   0.362
  163    H    GLU  24           H        GLU  24  -5.396  -1.627  -4.844
  164    HA   GLU  24           HA       GLU  24  -2.895  -2.564  -4.087
  165    HB2  GLU  24           HB2      GLU  24  -4.692  -4.074  -4.707
  166    HB3  GLU  24           HB3      GLU  24  -4.661  -3.479  -6.362
  167    HG2  GLU  24           HG2      GLU  24  -2.306  -4.334  -6.513
  168    HG3  GLU  24           HG3      GLU  24  -2.572  -5.115  -4.954
  169    H    SER  25           H        SER  25  -3.911  -1.516  -7.356
  170    HA   SER  25           HA       SER  25  -1.242  -1.705  -8.327
  171    HB2  SER  25           HB2      SER  25  -2.176  -0.378 -10.291
  172    HB3  SER  25           HB3      SER  25  -2.848  -1.990 -10.004
  173    HG   SER  25           HG       SER  25  -4.633  -1.007  -8.978
  174    H    SER  26           H        SER  26  -3.161   0.891  -6.943
  175    HA   SER  26           HA       SER  26  -1.641   3.083  -7.703
  176    HB2  SER  26           HB2      SER  26  -2.964   2.574  -5.024
  177    HB3  SER  26           HB3      SER  26  -2.372   4.142  -5.573
  178    HG   SER  26           HG       SER  26  -4.322   2.593  -6.947
  179    H    VAL  27           H        VAL  27  -1.055   0.685  -5.190
  180    HA   VAL  27           HA       VAL  27   1.487   1.852  -4.458
  181    HB   VAL  27           HB       VAL  27   0.378  -0.878  -3.782
  182   HG11  VAL  27          2HG1      VAL  27   2.611   0.711  -2.524
  183   HG12  VAL  27          1HG1      VAL  27   2.794  -0.736  -3.515
  184   HG13  VAL  27          3HG1      VAL  27   1.995  -0.836  -1.946
  185   HG21  VAL  27          3HG2      VAL  27   0.246   1.710  -2.236
  186   HG22  VAL  27          2HG2      VAL  27  -0.228   0.129  -1.613
  187   HG23  VAL  27          1HG2      VAL  27  -1.109   0.847  -2.961
  188    H    LYS  28           H        LYS  28   0.374  -0.967  -6.313
  189    HA   LYS  28           HA       LYS  28   2.898  -2.155  -6.665
  190    HB2  LYS  28           HB2      LYS  28   0.571  -3.172  -6.979
  191    HB3  LYS  28           HB3      LYS  28   0.603  -2.457  -8.586
  192    HG2  LYS  28           HG2      LYS  28   2.688  -3.713  -9.048
  193    HG3  LYS  28           HG3      LYS  28   2.506  -4.510  -7.482
  194    HD2  LYS  28           HD2      LYS  28   0.207  -5.223  -8.267
  195    HD3  LYS  28           HD3      LYS  28   0.686  -4.668  -9.872
  196    HE2  LYS  28           HE2      LYS  28   2.007  -6.818  -8.230
  197    HE3  LYS  28           HE3      LYS  28   1.047  -7.046  -9.690
  198    HZ1  LYS  28           HZ1      LYS  28   2.757  -5.669 -10.862
  199    HZ2  LYS  28           HZ2      LYS  28   3.310  -7.174 -10.308
  200    HZ3  LYS  28           HZ3      LYS  28   3.714  -5.762  -9.461
  201    H    GLU  29           H        GLU  29   1.226   0.298  -8.545
  202    HA   GLU  29           HA       GLU  29   2.882   0.163 -10.846
  203    HB2  GLU  29           HB2      GLU  29   1.188   2.393  -9.721
  204    HB3  GLU  29           HB3      GLU  29   2.041   2.507 -11.253
  205    HG2  GLU  29           HG2      GLU  29   0.775   0.582 -12.095
  206    HG3  GLU  29           HG3      GLU  29  -0.106   0.510 -10.569
  207    H    LEU  30           H        LEU  30   3.240   1.548  -7.734
  208    HA   LEU  30           HA       LEU  30   5.147   3.553  -8.370
  209    HB2  LEU  30           HB2      LEU  30   4.844   2.078  -5.755
  210    HB3  LEU  30           HB3      LEU  30   5.678   3.601  -5.996
  211    HG   LEU  30           HG       LEU  30   2.714   3.096  -6.203
  212   HD11  LEU  30          2HD1      LEU  30   3.563   3.297  -3.935
  213   HD12  LEU  30          1HD1      LEU  30   2.585   4.699  -4.369
  214   HD13  LEU  30          3HD1      LEU  30   4.344   4.824  -4.350
  215   HD21  LEU  30          3HD2      LEU  30   4.295   5.574  -6.866
  216   HD22  LEU  30          2HD2      LEU  30   2.545   5.536  -6.637
  217   HD23  LEU  30          1HD2      LEU  30   3.280   4.626  -7.957
  218    H    ASN  31           H        ASN  31   7.348   3.555  -8.381
  219    HA   ASN  31           HA       ASN  31   8.647   1.064  -8.975
  220    HB2  ASN  31           HB2      ASN  31   9.248   3.059 -10.225
  221    HB3  ASN  31           HB3      ASN  31   9.713   3.887  -8.744
  222   HD21  ASN  31          1HD2      ASN  31  11.781   4.267  -9.403
  223   HD22  ASN  31          2HD2      ASN  31  12.968   3.019  -9.591
  224    H    GLY  32           H        GLY  32   9.550  -0.248  -7.545
  225    HA2  GLY  32           HA1      GLY  32  11.239  -0.533  -5.800
  226    HA3  GLY  32           HA2      GLY  32  10.585   0.906  -5.029
  227    H    VAL  33           H        VAL  33   8.163  -1.001  -6.339
  228    HA   VAL  33           HA       VAL  33   7.500  -2.009  -3.682
  229    HB   VAL  33           HB       VAL  33   5.724  -1.368  -6.038
  230   HG11  VAL  33          2HG1      VAL  33   4.981  -2.570  -3.370
  231   HG12  VAL  33          1HG1      VAL  33   4.907  -3.387  -4.932
  232   HG13  VAL  33          3HG1      VAL  33   3.844  -2.018  -4.601
  233   HG21  VAL  33          3HG2      VAL  33   6.472   0.559  -4.770
  234   HG22  VAL  33          2HG2      VAL  33   5.962  -0.213  -3.267
  235   HG23  VAL  33          1HG2      VAL  33   4.758   0.262  -4.468
  236    H    GLU  34           H        GLU  34   7.888  -4.002  -3.376
  237    HA   GLU  34           HA       GLU  34   8.480  -5.828  -5.506
  238    HB2  GLU  34           HB2      GLU  34   9.800  -5.971  -3.544
  239    HB3  GLU  34           HB3      GLU  34   8.385  -6.009  -2.509
  240    HG2  GLU  34           HG2      GLU  34   9.351  -8.188  -2.550
  241    HG3  GLU  34           HG3      GLU  34   7.838  -8.246  -3.454
  242    H    GLN  35           H        GLN  35   5.971  -5.579  -3.010
  243    HA   GLN  35           HA       GLN  35   4.063  -6.926  -4.692
  244    HB2  GLN  35           HB2      GLN  35   3.570  -8.710  -3.055
  245    HB3  GLN  35           HB3      GLN  35   5.188  -8.853  -3.734
  246    HG2  GLN  35           HG2      GLN  35   6.104  -7.794  -1.747
  247    HG3  GLN  35           HG3      GLN  35   4.490  -7.688  -1.055
  248   HE21  GLN  35          1HE2      GLN  35   5.651 -10.396  -2.927
  249   HE22  GLN  35          2HE2      GLN  35   5.680 -11.534  -1.618
  250    H    VAL  36           H        VAL  36   1.907  -7.018  -3.665
  251    HA   VAL  36           HA       VAL  36   1.440  -5.432  -1.317
  252    HB   VAL  36           HB       VAL  36   1.781  -3.584  -2.810
  253   HG11  VAL  36          2HG1      VAL  36   1.540  -4.700  -4.942
  254   HG12  VAL  36          1HG1      VAL  36   0.484  -3.290  -4.879
  255   HG13  VAL  36          3HG1      VAL  36  -0.188  -4.906  -4.667
  256   HG21  VAL  36          3HG2      VAL  36  -1.167  -4.059  -2.400
  257   HG22  VAL  36          2HG2      VAL  36  -0.430  -2.505  -2.792
  258   HG23  VAL  36          1HG2      VAL  36  -0.051  -3.301  -1.265
  259    H    LYS  37           H        LYS  37  -0.136  -6.520  -0.343
  260    HA   LYS  37           HA       LYS  37  -2.287  -7.631  -2.022
  261    HB2  LYS  37           HB2      LYS  37  -1.218  -8.747   0.577
  262    HB3  LYS  37           HB3      LYS  37  -2.620  -9.363  -0.280
  263    HG2  LYS  37           HG2      LYS  37  -1.074 -10.825  -1.042
  264    HG3  LYS  37           HG3      LYS  37  -0.863  -9.561  -2.255
  265    HD2  LYS  37           HD2      LYS  37   1.294 -10.336  -1.425
  266    HD3  LYS  37           HD3      LYS  37   1.021  -8.654  -0.958
  267    HE2  LYS  37           HE2      LYS  37   0.411  -9.315   1.268
  268    HE3  LYS  37           HE3      LYS  37   0.469 -11.021   0.825
  269    HZ1  LYS  37           HZ1      LYS  37   2.442 -10.237   2.056
  270    HZ2  LYS  37           HZ2      LYS  37   2.817  -9.209   0.763
  271    HZ3  LYS  37           HZ3      LYS  37   2.820 -10.884   0.534
  272    H    VAL  38           H        VAL  38  -4.099  -6.552  -1.788
  273    HA   VAL  38           HA       VAL  38  -4.628  -5.088   0.691
  274    HB   VAL  38           HB       VAL  38  -6.238  -5.135  -1.868
  275   HG11  VAL  38          2HG1      VAL  38  -7.524  -4.407   0.053
  276   HG12  VAL  38          1HG1      VAL  38  -7.195  -3.040  -1.011
  277   HG13  VAL  38          3HG1      VAL  38  -6.270  -3.241   0.479
  278   HG21  VAL  38          3HG2      VAL  38  -5.161  -3.014  -2.416
  279   HG22  VAL  38          2HG2      VAL  38  -3.980  -4.318  -2.292
  280   HG23  VAL  38          1HG2      VAL  38  -4.148  -3.153  -0.978
  281    H    GLN  39           H        GLN  39  -5.679  -6.157   2.258
  282    HA   GLN  39           HA       GLN  39  -7.478  -8.318   1.484
  283    HB2  GLN  39           HB2      GLN  39  -6.468  -7.523   4.218
  284    HB3  GLN  39           HB3      GLN  39  -7.532  -8.884   3.897
  285    HG2  GLN  39           HG2      GLN  39  -5.633 -10.058   3.850
  286    HG3  GLN  39           HG3      GLN  39  -5.492  -9.428   2.211
  287   HE21  GLN  39          1HE2      GLN  39  -5.142  -7.468   5.066
  288   HE22  GLN  39          2HE2      GLN  39  -3.444  -7.177   4.904
  289    H    LEU  40           H        LEU  40  -9.511  -7.767   1.097
  290    HA   LEU  40           HA       LEU  40 -10.637  -5.307   1.954
  291    HB2  LEU  40           HB2      LEU  40 -11.193  -6.691  -0.130
  292    HB3  LEU  40           HB3      LEU  40 -12.170  -7.688   0.925
  293    HG   LEU  40           HG       LEU  40 -13.378  -5.916  -0.427
  294   HD11  LEU  40          2HD1      LEU  40 -14.891  -5.307   1.402
  295   HD12  LEU  40          1HD1      LEU  40 -13.702  -5.892   2.567
  296   HD13  LEU  40          3HD1      LEU  40 -14.458  -7.016   1.435
  297   HD21  LEU  40          3HD2      LEU  40 -13.362  -3.645   0.458
  298   HD22  LEU  40          2HD2      LEU  40 -11.765  -4.120  -0.116
  299   HD23  LEU  40          1HD2      LEU  40 -12.108  -4.098   1.612
  300    H    ALA  41           H        ALA  41 -10.939  -8.645   3.065
  301    HA   ALA  41           HA       ALA  41 -13.038  -8.192   4.911
  302    HB1  ALA  41           HB1      ALA  41 -12.442 -10.426   4.097
  303    HB2  ALA  41           HB2      ALA  41 -10.911 -10.329   4.965
  304    HB3  ALA  41           HB3      ALA  41 -12.429 -10.349   5.859
  305    H    GLU  42           H        GLU  42  -9.533  -8.052   5.173
  306    HA   GLU  42           HA       GLU  42  -9.569  -7.588   8.011
  307    HB2  GLU  42           HB2      GLU  42  -7.338  -7.323   5.989
  308    HB3  GLU  42           HB3      GLU  42  -7.137  -7.193   7.731
  309    HG2  GLU  42           HG2      GLU  42  -8.162  -9.636   6.306
  310    HG3  GLU  42           HG3      GLU  42  -6.491  -9.391   6.809
  311    H    GLY  43           H        GLY  43  -9.415  -5.635   5.101
  312    HA2  GLY  43           HA1      GLY  43  -9.754  -3.355   4.863
  313    HA3  GLY  43           HA2      GLY  43  -9.912  -3.225   6.611
  314    H    THR  44           H        THR  44  -7.201  -4.883   5.336
  315    HA   THR  44           HA       THR  44  -5.478  -2.547   5.770
  316    HB   THR  44           HB       THR  44  -3.811  -4.054   6.859
  317    HG1  THR  44           HG1      THR  44  -4.201  -6.126   6.904
  318   HG21  THR  44          3HG2      THR  44  -4.910  -4.156   9.042
  319   HG22  THR  44          1HG2      THR  44  -6.477  -3.910   8.271
  320   HG23  THR  44          2HG2      THR  44  -5.265  -2.632   8.231
  321    H    VAL  45           H        VAL  45  -3.344  -2.791   4.790
  322    HA   VAL  45           HA       VAL  45  -3.322  -4.705   2.551
  323    HB   VAL  45           HB       VAL  45  -2.244  -1.876   2.452
  324   HG11  VAL  45          2HG1      VAL  45  -1.013  -3.420   1.041
  325   HG12  VAL  45          1HG1      VAL  45  -1.992  -2.336   0.052
  326   HG13  VAL  45          3HG1      VAL  45  -2.519  -3.996   0.324
  327   HG21  VAL  45          3HG2      VAL  45  -4.677  -1.873   2.512
  328   HG22  VAL  45          2HG2      VAL  45  -4.725  -3.040   1.192
  329   HG23  VAL  45          1HG2      VAL  45  -4.091  -1.418   0.911
  330    H    GLU  46           H        GLU  46  -1.653  -6.054   2.660
  331    HA   GLU  46           HA       GLU  46   0.679  -5.302   4.253
  332    HB2  GLU  46           HB2      GLU  46  -0.304  -7.554   4.567
  333    HB3  GLU  46           HB3      GLU  46   0.052  -7.928   2.885
  334    HG2  GLU  46           HG2      GLU  46   2.426  -7.707   3.312
  335    HG3  GLU  46           HG3      GLU  46   2.103  -7.249   4.982
  336    H    VAL  47           H        VAL  47   2.191  -4.181   3.266
  337    HA   VAL  47           HA       VAL  47   2.720  -4.712   0.410
  338    HB   VAL  47           HB       VAL  47   3.199  -2.107   1.867
  339   HG11  VAL  47          2HG1      VAL  47   3.247  -2.797  -1.067
  340   HG12  VAL  47          1HG1      VAL  47   4.646  -2.442  -0.052
  341   HG13  VAL  47          3HG1      VAL  47   3.456  -1.183  -0.387
  342   HG21  VAL  47          3HG2      VAL  47   1.251  -1.240   0.636
  343   HG22  VAL  47          2HG2      VAL  47   0.816  -2.508   1.780
  344   HG23  VAL  47          1HG2      VAL  47   0.912  -2.871   0.057
  345    H    THR  48           H        THR  48   4.780  -5.127  -0.193
  346    HA   THR  48           HA       THR  48   6.900  -4.756   1.821
  347    HB   THR  48           HB       THR  48   6.926  -6.847  -0.367
  348    HG1  THR  48           HG1      THR  48   6.129  -8.271   1.087
  349   HG21  THR  48          3HG2      THR  48   8.762  -7.809   0.918
  350   HG22  THR  48          1HG2      THR  48   8.605  -6.534   2.126
  351   HG23  THR  48          2HG2      THR  48   9.128  -6.138   0.488
  352    H    ILE  49           H        ILE  49   8.027  -3.020   1.243
  353    HA   ILE  49           HA       ILE  49   8.529  -2.549  -1.631
  354    HB   ILE  49           HB       ILE  49   8.755  -0.164  -1.112
  355   HG12  ILE  49          2HG1      ILE  49   7.778  -0.809   1.671
  356   HG13  ILE  49          3HG1      ILE  49   9.484  -0.613   1.290
  357   HG21  ILE  49          2HG2      ILE  49   6.171  -1.354  -0.113
  358   HG22  ILE  49          1HG2      ILE  49   6.576  -0.988  -1.788
  359   HG23  ILE  49          3HG2      ILE  49   6.399   0.321  -0.619
  360   HD11  ILE  49          3HD1      ILE  49   9.065   1.677   0.569
  361   HD12  ILE  49          2HD1      ILE  49   8.543   1.419   2.233
  362   HD13  ILE  49          1HD1      ILE  49   7.350   1.481   0.934
  363    H    ASP  50           H        ASP  50  10.542  -1.275  -2.048
  364    HA   ASP  50           HA       ASP  50  12.700  -1.967  -0.170
  365    HB2  ASP  50           HB2      ASP  50  12.963  -2.539  -2.628
  366    HB3  ASP  50           HB3      ASP  50  12.972  -0.813  -2.956
  367    H    SER  51           H        SER  51  12.914  -0.413   1.334
  368    HA   SER  51           HA       SER  51  11.972   2.242   0.877
  369    HB2  SER  51           HB2      SER  51  12.870   2.673   3.172
  370    HB3  SER  51           HB3      SER  51  11.760   1.311   3.081
  371    HG   SER  51           HG       SER  51  13.305   0.022   3.691
  372    H    SER  52           H        SER  52  14.816   0.702   0.038
  373    HA   SER  52           HA       SER  52  16.457   3.104   0.161
  374    HB2  SER  52           HB2      SER  52  17.104   0.427  -1.087
  375    HB3  SER  52           HB3      SER  52  18.243   1.714  -0.688
  376    HG   SER  52           HG       SER  52  16.847  -0.032   1.024
  377    H    VAL  53           H        VAL  53  14.015   2.101  -1.670
  378    HA   VAL  53           HA       VAL  53  15.002   3.563  -4.027
  379    HB   VAL  53           HB       VAL  53  13.165   1.159  -3.993
  380   HG11  VAL  53          2HG1      VAL  53  13.977   2.903  -6.323
  381   HG12  VAL  53          1HG1      VAL  53  12.374   2.850  -5.583
  382   HG13  VAL  53          3HG1      VAL  53  13.012   1.429  -6.415
  383   HG21  VAL  53          3HG2      VAL  53  15.843   1.579  -5.313
  384   HG22  VAL  53          2HG2      VAL  53  14.885   0.099  -5.325
  385   HG23  VAL  53          1HG2      VAL  53  15.580   0.692  -3.813
  386    H    VAL  54           H        VAL  54  11.951   2.337  -2.645
  387    HA   VAL  54           HA       VAL  54  10.826   5.025  -3.022
  388    HB   VAL  54           HB       VAL  54   9.687   3.248  -4.339
  389   HG11  VAL  54          2HG1      VAL  54  10.019   1.358  -2.868
  390   HG12  VAL  54          1HG1      VAL  54   8.298   1.585  -3.185
  391   HG13  VAL  54          3HG1      VAL  54   8.987   2.098  -1.643
  392   HG21  VAL  54          3HG2      VAL  54   8.430   5.213  -3.688
  393   HG22  VAL  54          2HG2      VAL  54   8.017   4.466  -2.145
  394   HG23  VAL  54          1HG2      VAL  54   7.392   3.786  -3.648
  395    H    THR  55           H        THR  55   9.976   6.053  -1.236
  396    HA   THR  55           HA       THR  55  10.691   4.920   1.323
  397    HB   THR  55           HB       THR  55  10.089   7.029   2.292
  398    HG1  THR  55           HG1      THR  55   9.042   7.816  -0.250
  399   HG21  THR  55          3HG2      THR  55  11.399   7.491  -0.391
  400   HG22  THR  55          1HG2      THR  55  12.217   6.991   1.088
  401   HG23  THR  55          2HG2      THR  55  11.467   8.583   0.992
  402    H    LEU  56           H        LEU  56   9.189   4.772   3.117
  403    HA   LEU  56           HA       LEU  56   6.862   3.335   2.360
  404    HB2  LEU  56           HB2      LEU  56   6.391   3.170   4.763
  405    HB3  LEU  56           HB3      LEU  56   8.034   2.715   4.370
  406    HG   LEU  56           HG       LEU  56   7.754   5.527   5.154
  407   HD11  LEU  56          2HD1      LEU  56   7.178   3.330   7.141
  408   HD12  LEU  56          1HD1      LEU  56   6.041   4.567   6.606
  409   HD13  LEU  56          3HD1      LEU  56   7.470   5.024   7.535
  410   HD21  LEU  56          3HD2      LEU  56   9.908   4.420   4.853
  411   HD22  LEU  56          2HD2      LEU  56   9.481   3.237   6.089
  412   HD23  LEU  56          1HD2      LEU  56   9.695   4.932   6.526
  413    H    LYS  57           H        LYS  57   7.460   6.636   3.365
  414    HA   LYS  57           HA       LYS  57   4.750   7.273   3.921
  415    HB2  LYS  57           HB2      LYS  57   7.113   8.602   4.261
  416    HB3  LYS  57           HB3      LYS  57   6.383   9.495   2.931
  417    HG2  LYS  57           HG2      LYS  57   5.065   8.913   5.570
  418    HG3  LYS  57           HG3      LYS  57   5.800  10.451   5.111
  419    HD2  LYS  57           HD2      LYS  57   4.166  10.799   3.406
  420    HD3  LYS  57           HD3      LYS  57   3.548   9.156   3.581
  421    HE2  LYS  57           HE2      LYS  57   2.882   9.743   5.913
  422    HE3  LYS  57           HE3      LYS  57   3.337  11.411   5.566
  423    HZ1  LYS  57           HZ1      LYS  57   1.236   9.848   4.159
  424    HZ2  LYS  57           HZ2      LYS  57   1.686  11.436   3.779
  425    HZ3  LYS  57           HZ3      LYS  57   0.973  11.089   5.275
  426    H    ASP  58           H        ASP  58   6.694   7.308   0.970
  427    HA   ASP  58           HA       ASP  58   4.869   8.683  -0.666
  428    HB2  ASP  58           HB2      ASP  58   7.052   6.721  -1.204
  429    HB3  ASP  58           HB3      ASP  58   5.900   7.059  -2.493
  430    H    ILE  59           H        ILE  59   5.174   5.249   0.101
  431    HA   ILE  59           HA       ILE  59   3.086   4.249  -1.444
  432    HB   ILE  59           HB       ILE  59   3.876   3.325   1.326
  433   HG12  ILE  59          2HG1      ILE  59   5.822   3.419  -0.146
  434   HG13  ILE  59          3HG1      ILE  59   5.374   1.747   0.170
  435   HG21  ILE  59          2HG2      ILE  59   2.497   1.857  -0.919
  436   HG22  ILE  59          1HG2      ILE  59   1.760   2.383   0.597
  437   HG23  ILE  59          3HG2      ILE  59   3.017   1.143   0.610
  438   HD11  ILE  59          3HD1      ILE  59   4.753   3.307  -2.325
  439   HD12  ILE  59          2HD1      ILE  59   4.289   1.634  -2.015
  440   HD13  ILE  59          1HD1      ILE  59   5.995   2.067  -2.149
  441    H    VAL  60           H        VAL  60   3.019   5.332   1.945
  442    HA   VAL  60           HA       VAL  60   0.259   5.016   2.345
  443    HB   VAL  60           HB       VAL  60   2.070   7.006   3.728
  444   HG11  VAL  60          2HG1      VAL  60   0.500   6.782   5.598
  445   HG12  VAL  60          1HG1      VAL  60  -0.518   5.735   4.610
  446   HG13  VAL  60          3HG1      VAL  60  -0.284   7.422   4.154
  447   HG21  VAL  60          3HG2      VAL  60   3.034   4.785   3.849
  448   HG22  VAL  60          2HG2      VAL  60   1.496   4.122   4.400
  449   HG23  VAL  60          1HG2      VAL  60   2.386   5.250   5.423
  450    H    ALA  61           H        ALA  61   2.144   7.856   1.346
  451    HA   ALA  61           HA       ALA  61   0.098   9.750   1.393
  452    HB1  ALA  61           HB1      ALA  61   1.500  11.076  -0.096
  453    HB2  ALA  61           HB2      ALA  61   2.463  10.325   1.176
  454    HB3  ALA  61           HB3      ALA  61   2.479   9.653  -0.453
  455    H    VAL  62           H        VAL  62   1.209   7.722  -1.323
  456    HA   VAL  62           HA       VAL  62  -0.616   8.681  -3.219
  457    HB   VAL  62           HB       VAL  62   0.631   5.930  -3.010
  458   HG11  VAL  62          2HG1      VAL  62   0.116   5.710  -5.399
  459   HG12  VAL  62          1HG1      VAL  62  -0.763   7.238  -5.345
  460   HG13  VAL  62          3HG1      VAL  62  -1.349   5.851  -4.426
  461   HG21  VAL  62          3HG2      VAL  62   2.203   6.779  -4.687
  462   HG22  VAL  62          2HG2      VAL  62   2.264   7.731  -3.202
  463   HG23  VAL  62          1HG2      VAL  62   1.419   8.357  -4.619
  464    H    ILE  63           H        ILE  63  -0.859   5.945  -0.962
  465    HA   ILE  63           HA       ILE  63  -3.401   5.061  -1.707
  466    HB   ILE  63           HB       ILE  63  -2.038   4.988   0.986
  467   HG12  ILE  63          2HG1      ILE  63  -2.407   2.886  -1.160
  468   HG13  ILE  63          3HG1      ILE  63  -0.912   3.744  -0.804
  469   HG21  ILE  63          2HG2      ILE  63  -4.424   4.829   1.341
  470   HG22  ILE  63          1HG2      ILE  63  -3.672   3.256   1.598
  471   HG23  ILE  63          3HG2      ILE  63  -4.553   3.580   0.105
  472   HD11  ILE  63          3HD1      ILE  63  -2.355   1.859   1.044
  473   HD12  ILE  63          2HD1      ILE  63  -0.869   2.732   1.418
  474   HD13  ILE  63          1HD1      ILE  63  -0.881   1.517   0.139
  475    H    GLU  64           H        GLU  64  -2.467   7.465   0.738
  476    HA   GLU  64           HA       GLU  64  -5.084   7.998   1.643
  477    HB2  GLU  64           HB2      GLU  64  -2.648   9.790   1.696
  478    HB3  GLU  64           HB3      GLU  64  -4.134  10.070   2.595
  479    HG2  GLU  64           HG2      GLU  64  -3.774   7.941   3.790
  480    HG3  GLU  64           HG3      GLU  64  -2.237   7.762   2.942
  481    H    ASP  65           H        ASP  65  -3.082   9.495  -0.847
  482    HA   ASP  65           HA       ASP  65  -4.800  11.636  -1.459
  483    HB2  ASP  65           HB2      ASP  65  -2.453  11.566  -2.164
  484    HB3  ASP  65           HB3      ASP  65  -2.809  10.223  -3.244
  485    H    GLN  66           H        GLN  66  -4.863   8.282  -2.368
  486    HA   GLN  66           HA       GLN  66  -6.673   8.605  -4.571
  487    HB2  GLN  66           HB2      GLN  66  -5.857   6.166  -2.986
  488    HB3  GLN  66           HB3      GLN  66  -6.898   6.115  -4.403
  489    HG2  GLN  66           HG2      GLN  66  -4.049   7.082  -4.329
  490    HG3  GLN  66           HG3      GLN  66  -4.607   5.535  -4.962
  491   HE21  GLN  66          1HE2      GLN  66  -6.997   6.689  -6.170
  492   HE22  GLN  66          2HE2      GLN  66  -6.465   7.562  -7.563
  493    H    GLY  67           H        GLY  67  -7.189   9.183  -1.424
  494    HA2  GLY  67           HA1      GLY  67  -9.393   9.838  -0.734
  495    HA3  GLY  67           HA2      GLY  67 -10.045   8.538  -1.720
  496    H    TYR  68           H        TYR  68  -7.292   8.034   0.359
  497    HA   TYR  68           HA       TYR  68  -9.011   6.534   2.215
  498    HB2  TYR  68           HB2      TYR  68  -6.275   5.729   1.217
  499    HB3  TYR  68           HB3      TYR  68  -7.210   4.865   2.435
  500    HD1  TYR  68           HD1      TYR  68  -9.460   3.888   1.731
  501    HD2  TYR  68           HD2      TYR  68  -6.570   5.275  -1.063
  502    HE1  TYR  68           HE1      TYR  68 -10.545   2.572  -0.039
  503    HE2  TYR  68           HE2      TYR  68  -7.648   3.964  -2.840
  504    HH   TYR  68           HH       TYR  68  -9.095   2.003  -3.055
  505    H    ASP  69           H        ASP  69  -8.001   6.180   4.347
  506    HA   ASP  69           HA       ASP  69  -6.040   8.266   5.036
  507    HB2  ASP  69           HB2      ASP  69  -8.433   8.814   5.725
  508    HB3  ASP  69           HB3      ASP  69  -8.333   7.444   6.825
  509    H    VAL  70           H        VAL  70  -4.252   7.304   5.788
  510    HA   VAL  70           HA       VAL  70  -4.566   4.697   7.122
  511    HB   VAL  70           HB       VAL  70  -2.450   5.478   5.113
  512   HG11  VAL  70          2HG1      VAL  70  -1.465   4.171   6.921
  513   HG12  VAL  70          1HG1      VAL  70  -1.544   3.226   5.433
  514   HG13  VAL  70          3HG1      VAL  70  -2.711   2.941   6.724
  515   HG21  VAL  70          3HG2      VAL  70  -3.361   3.642   3.786
  516   HG22  VAL  70          2HG2      VAL  70  -4.607   4.843   4.132
  517   HG23  VAL  70          1HG2      VAL  70  -4.567   3.325   5.034
  518    H    GLN  71           H        GLN  71  -3.887   4.769   9.124
  519    HA   GLN  71           HA       GLN  71  -1.732   6.628   9.848
  520    HB2  GLN  71           HB2      GLN  71  -3.816   5.302  11.599
  521    HB3  GLN  71           HB3      GLN  71  -2.552   6.386  12.168
  522    HG2  GLN  71           HG2      GLN  71  -3.500   8.206  10.871
  523    HG3  GLN  71           HG3      GLN  71  -4.741   7.125  10.237
  524   HE21  GLN  71          1HE2      GLN  71  -3.595   7.023  13.536
  525   HE22  GLN  71          2HE2      GLN  71  -5.066   7.586  14.258
  Start of MODEL   13
    1    H1   SER   1           H1       SER   1  21.196   0.331  -3.145
    2    H2   SER   1           H2       SER   1  21.138  -0.822  -4.389
    3    H3   SER   1           H3       SER   1  22.592  -0.541  -3.563
    4    HA   SER   1           HA       SER   1  21.599  -2.579  -2.821
    5    HB2  SER   1           HB2      SER   1  22.862  -1.145  -1.213
    6    HB3  SER   1           HB3      SER   1  21.342  -0.394  -0.733
    7    HG   SER   1           HG       SER   1  22.388  -2.876  -0.093
    8    H    ASN   2           H        ASN   2  19.852  -3.232  -1.032
    9    HA   ASN   2           HA       ASN   2  17.258  -2.093  -1.750
   10    HB2  ASN   2           HB2      ASN   2  16.301  -4.277  -2.261
   11    HB3  ASN   2           HB3      ASN   2  17.658  -3.960  -3.335
   12   HD21  ASN   2          1HD2      ASN   2  16.440  -5.911  -0.757
   13   HD22  ASN   2          2HD2      ASN   2  17.718  -7.077  -0.747
   14    H    ALA   3           H        ALA   3  15.646  -2.440  -0.232
   15    HA   ALA   3           HA       ALA   3  16.359  -3.944   2.189
   16    HB1  ALA   3           HB1      ALA   3  15.295  -1.118   2.204
   17    HB2  ALA   3           HB2      ALA   3  15.587  -2.124   3.622
   18    HB3  ALA   3           HB3      ALA   3  16.941  -1.598   2.620
   19    H    MET   4           H        MET   4  14.813  -5.472   2.242
   20    HA   MET   4           HA       MET   4  12.210  -4.957   1.076
   21    HB2  MET   4           HB2      MET   4  13.400  -7.411   2.365
   22    HB3  MET   4           HB3      MET   4  11.759  -7.345   1.748
   23    HG2  MET   4           HG2      MET   4  14.213  -6.873   0.075
   24    HG3  MET   4           HG3      MET   4  13.399  -8.425   0.239
   25    HE1  MET   4           HE1      MET   4  12.437  -4.603  -0.564
   26    HE2  MET   4           HE2      MET   4  13.677  -5.188  -1.671
   27    HE3  MET   4           HE3      MET   4  12.057  -4.841  -2.268
   28    H    GLU   5           H        GLU   5  11.185  -3.516   2.393
   29    HA   GLU   5           HA       GLU   5  10.698  -4.289   5.179
   30    HB2  GLU   5           HB2      GLU   5  10.757  -1.763   3.686
   31    HB3  GLU   5           HB3      GLU   5   9.395  -1.902   4.787
   32    HG2  GLU   5           HG2      GLU   5  11.373  -0.788   5.753
   33    HG3  GLU   5           HG3      GLU   5  10.837  -2.201   6.654
   34    H    GLN   6           H        GLN   6   8.943  -5.475   5.569
   35    HA   GLN   6           HA       GLN   6   6.676  -5.335   3.733
   36    HB2  GLN   6           HB2      GLN   6   7.270  -7.175   6.055
   37    HB3  GLN   6           HB3      GLN   6   5.783  -7.234   5.116
   38    HG2  GLN   6           HG2      GLN   6   7.141  -7.666   3.091
   39    HG3  GLN   6           HG3      GLN   6   8.576  -7.730   4.111
   40   HE21  GLN   6          1HE2      GLN   6   5.460  -8.962   5.108
   41   HE22  GLN   6          2HE2      GLN   6   5.908 -10.640   5.084
   42    H    LEU   7           H        LEU   7   5.362  -3.685   4.101
   43    HA   LEU   7           HA       LEU   7   4.933  -2.723   6.812
   44    HB2  LEU   7           HB2      LEU   7   4.493  -1.657   4.068
   45    HB3  LEU   7           HB3      LEU   7   3.503  -1.045   5.364
   46    HG   LEU   7           HG       LEU   7   5.588  -0.389   6.580
   47   HD11  LEU   7          2HD1      LEU   7   7.678  -0.291   5.343
   48   HD12  LEU   7          1HD1      LEU   7   6.917  -1.091   3.966
   49   HD13  LEU   7          3HD1      LEU   7   7.115  -1.956   5.490
   50   HD21  LEU   7          3HD2      LEU   7   5.206   0.787   3.834
   51   HD22  LEU   7          2HD2      LEU   7   6.033   1.562   5.186
   52   HD23  LEU   7          1HD2      LEU   7   4.305   1.222   5.286
   53    H    THR   8           H        THR   8   2.873  -2.430   7.685
   54    HA   THR   8           HA       THR   8   0.653  -3.819   6.353
   55    HB   THR   8           HB       THR   8   1.084  -4.018   9.329
   56    HG1  THR   8           HG1      THR   8   1.826  -6.077   7.509
   57   HG21  THR   8          3HG2      THR   8  -0.479  -5.687   7.355
   58   HG22  THR   8          1HG2      THR   8  -1.151  -4.514   8.491
   59   HG23  THR   8          2HG2      THR   8  -0.377  -5.982   9.091
   60    H    LEU   9           H        LEU   9  -0.651  -2.105   5.920
   61    HA   LEU   9           HA       LEU   9  -1.045  -0.131   8.070
   62    HB2  LEU   9           HB2      LEU   9  -1.779   1.374   6.110
   63    HB3  LEU   9           HB3      LEU   9  -0.071   1.125   6.392
   64    HG   LEU   9           HG       LEU   9  -0.464  -0.806   4.591
   65   HD11  LEU   9          2HD1      LEU   9  -2.015  -0.002   2.860
   66   HD12  LEU   9          1HD1      LEU   9  -2.567   1.256   3.964
   67   HD13  LEU   9          3HD1      LEU   9  -2.836  -0.441   4.357
   68   HD21  LEU   9          3HD2      LEU   9   1.151   1.023   4.428
   69   HD22  LEU   9          2HD2      LEU   9  -0.136   2.118   3.923
   70   HD23  LEU   9          1HD2      LEU   9   0.323   0.761   2.893
   71    H    GLN  10           H        GLN  10  -3.090   0.555   8.583
   72    HA   GLN  10           HA       GLN  10  -5.259  -1.190   7.789
   73    HB2  GLN  10           HB2      GLN  10  -5.250   1.228   9.604
   74    HB3  GLN  10           HB3      GLN  10  -6.599   0.116   9.392
   75    HG2  GLN  10           HG2      GLN  10  -5.323  -1.668  10.369
   76    HG3  GLN  10           HG3      GLN  10  -3.893  -0.643  10.442
   77   HE21  GLN  10          1HE2      GLN  10  -7.025  -1.288  11.827
   78   HE22  GLN  10          2HE2      GLN  10  -6.799  -0.349  13.267
   79    H    VAL  11           H        VAL  11  -7.149  -0.522   6.726
   80    HA   VAL  11           HA       VAL  11  -6.733   1.868   5.047
   81    HB   VAL  11           HB       VAL  11  -8.281  -0.600   4.270
   82   HG11  VAL  11          2HG1      VAL  11  -8.937   1.408   3.078
   83   HG12  VAL  11          1HG1      VAL  11  -8.078   0.305   2.002
   84   HG13  VAL  11          3HG1      VAL  11  -7.257   1.726   2.649
   85   HG21  VAL  11          3HG2      VAL  11  -6.363  -1.210   2.879
   86   HG22  VAL  11          2HG2      VAL  11  -5.957  -1.211   4.595
   87   HG23  VAL  11          1HG2      VAL  11  -5.442   0.129   3.567
   88    H    GLU  12           H        GLU  12  -8.006   3.399   5.927
   89    HA   GLU  12           HA       GLU  12 -10.793   2.749   6.510
   90    HB2  GLU  12           HB2      GLU  12  -9.625   4.117   8.162
   91    HB3  GLU  12           HB3      GLU  12  -9.190   5.285   6.922
   92    HG2  GLU  12           HG2      GLU  12 -11.019   6.110   8.262
   93    HG3  GLU  12           HG3      GLU  12 -11.547   5.821   6.606
   94    H    GLY  13           H        GLY  13 -12.081   2.744   4.789
   95    HA2  GLY  13           HA1      GLY  13 -13.139   4.570   3.326
   96    HA3  GLY  13           HA2      GLY  13 -11.534   4.669   2.620
   97    H    MET  14           H        MET  14 -13.027   1.651   3.637
   98    HA   MET  14           HA       MET  14 -12.778   0.600   0.950
   99    HB2  MET  14           HB2      MET  14 -13.656  -0.588   3.574
  100    HB3  MET  14           HB3      MET  14 -13.816  -1.469   2.063
  101    HG2  MET  14           HG2      MET  14 -11.215  -0.385   3.113
  102    HG3  MET  14           HG3      MET  14 -11.791  -2.028   3.391
  103    HE1  MET  14           HE1      MET  14  -9.000  -2.763   0.818
  104    HE2  MET  14           HE2      MET  14  -8.974  -1.649   2.186
  105    HE3  MET  14           HE3      MET  14  -9.744  -3.227   2.349
  106    H    SER  15           H        SER  15 -14.287   1.567  -0.356
  107    HA   SER  15           HA       SER  15 -17.040   1.742   0.563
  108    HB2  SER  15           HB2      SER  15 -17.374   2.985  -1.594
  109    HB3  SER  15           HB3      SER  15 -16.190   3.712  -0.508
  110    HG   SER  15           HG       SER  15 -15.014   3.673  -2.271
  111    H    CYS  16           H        CYS  16 -15.086  -0.086  -1.673
  112    HA   CYS  16           HA       CYS  16 -17.217  -1.948  -2.141
  113    HB2  CYS  16           HB2      CYS  16 -17.175  -1.644  -4.636
  114    HB3  CYS  16           HB3      CYS  16 -17.915  -0.309  -3.756
  115    HG   CYS  16           HG       CYS  16 -15.600   1.308  -3.912
  116    H    GLY  17           H        GLY  17 -16.438  -3.519  -4.010
  117    HA2  GLY  17           HA1      GLY  17 -13.938  -4.596  -3.180
  118    HA3  GLY  17           HA2      GLY  17 -14.908  -5.148  -4.539
  119    H    HIS  18           H        HIS  18 -14.778  -2.230  -5.527
  120    HA   HIS  18           HA       HIS  18 -12.668  -2.571  -7.361
  121    HB2  HIS  18           HB2      HIS  18 -14.241  -0.123  -6.558
  122    HB3  HIS  18           HB3      HIS  18 -13.006  -0.085  -7.808
  123    HD1  HIS  18           HD1      HIS  18 -15.731   0.698  -8.667
  124    HD2  HIS  18           HD2      HIS  18 -14.466  -3.265  -8.689
  125    HE1  HIS  18           HE1      HIS  18 -17.209  -0.479 -10.333
  126    HE2  HIS  18           HE2      HIS  18 -16.317  -2.833 -10.450
  127    H    CYS  19           H        CYS  19 -12.814  -1.187  -4.182
  128    HA   CYS  19           HA       CYS  19 -10.574   0.459  -4.184
  129    HB2  CYS  19           HB2      CYS  19 -11.627  -1.245  -1.918
  130    HB3  CYS  19           HB3      CYS  19 -10.549   0.137  -1.748
  131    HG   CYS  19           HG       CYS  19 -12.599   1.817  -3.054
  132    H    VAL  20           H        VAL  20 -10.836  -3.030  -3.799
  133    HA   VAL  20           HA       VAL  20  -8.321  -3.765  -3.012
  134    HB   VAL  20           HB       VAL  20 -10.061  -5.079  -5.110
  135   HG11  VAL  20          2HG1      VAL  20  -8.789  -7.117  -4.714
  136   HG12  VAL  20          1HG1      VAL  20  -7.722  -6.249  -3.608
  137   HG13  VAL  20          3HG1      VAL  20  -7.740  -5.837  -5.324
  138   HG21  VAL  20          3HG2      VAL  20  -9.710  -5.634  -2.167
  139   HG22  VAL  20          2HG2      VAL  20 -10.727  -6.551  -3.275
  140   HG23  VAL  20          1HG2      VAL  20 -11.109  -4.866  -2.919
  141    H    ASN  21           H        ASN  21  -9.310  -3.437  -6.437
  142    HA   ASN  21           HA       ASN  21  -6.668  -3.715  -7.424
  143    HB2  ASN  21           HB2      ASN  21  -8.604  -4.234  -8.820
  144    HB3  ASN  21           HB3      ASN  21  -9.128  -2.556  -8.752
  145   HD21  ASN  21          1HD2      ASN  21  -6.869  -4.805 -10.131
  146   HD22  ASN  21          2HD2      ASN  21  -6.225  -3.730 -11.326
  147    H    ALA  22           H        ALA  22  -8.660  -0.948  -6.589
  148    HA   ALA  22           HA       ALA  22  -7.135   1.063  -7.796
  149    HB1  ALA  22           HB1      ALA  22  -9.403   1.421  -6.975
  150    HB2  ALA  22           HB2      ALA  22  -8.833   1.249  -5.315
  151    HB3  ALA  22           HB3      ALA  22  -8.282   2.603  -6.300
  152    H    ILE  23           H        ILE  23  -7.111   0.060  -4.345
  153    HA   ILE  23           HA       ILE  23  -4.897   1.759  -3.768
  154    HB   ILE  23           HB       ILE  23  -6.516   1.103  -2.030
  155   HG12  ILE  23          2HG1      ILE  23  -3.704   0.198  -1.388
  156   HG13  ILE  23          3HG1      ILE  23  -4.212   1.881  -1.481
  157   HG21  ILE  23          2HG2      ILE  23  -6.892  -1.214  -2.647
  158   HG22  ILE  23          1HG2      ILE  23  -6.349  -1.110  -0.971
  159   HG23  ILE  23          3HG2      ILE  23  -5.224  -1.616  -2.232
  160   HD11  ILE  23          3HD1      ILE  23  -5.732   1.549   0.374
  161   HD12  ILE  23          2HD1      ILE  23  -4.096   1.071   0.823
  162   HD13  ILE  23          1HD1      ILE  23  -5.304  -0.158   0.443
  163    H    GLU  24           H        GLU  24  -5.202  -1.628  -4.658
  164    HA   GLU  24           HA       GLU  24  -2.640  -2.499  -4.012
  165    HB2  GLU  24           HB2      GLU  24  -4.476  -3.984  -4.736
  166    HB3  GLU  24           HB3      GLU  24  -4.332  -3.351  -6.369
  167    HG2  GLU  24           HG2      GLU  24  -1.960  -4.599  -5.065
  168    HG3  GLU  24           HG3      GLU  24  -3.241  -5.624  -5.706
  169    H    SER  25           H        SER  25  -3.799  -1.046  -7.064
  170    HA   SER  25           HA       SER  25  -1.186  -1.011  -8.182
  171    HB2  SER  25           HB2      SER  25  -2.203   0.595  -9.846
  172    HB3  SER  25           HB3      SER  25  -2.913  -1.027  -9.781
  173    HG   SER  25           HG       SER  25  -4.664  -0.223  -8.679
  174    H    SER  26           H        SER  26  -3.052   1.263  -6.287
  175    HA   SER  26           HA       SER  26  -1.562   3.566  -6.739
  176    HB2  SER  26           HB2      SER  26  -2.862   2.645  -4.162
  177    HB3  SER  26           HB3      SER  26  -2.308   4.290  -4.489
  178    HG   SER  26           HG       SER  26  -4.332   2.850  -5.877
  179    H    VAL  27           H        VAL  27  -0.930   0.818  -4.634
  180    HA   VAL  27           HA       VAL  27   1.616   1.899  -3.768
  181    HB   VAL  27           HB       VAL  27   0.650  -0.951  -3.497
  182   HG11  VAL  27          2HG1      VAL  27   2.641   0.669  -1.918
  183   HG12  VAL  27          1HG1      VAL  27   3.014  -0.622  -3.061
  184   HG13  VAL  27          3HG1      VAL  27   2.153  -0.990  -1.567
  185   HG21  VAL  27          3HG2      VAL  27   0.180   1.363  -1.623
  186   HG22  VAL  27          2HG2      VAL  27  -0.182  -0.329  -1.277
  187   HG23  VAL  27          1HG2      VAL  27  -1.045   0.511  -2.564
  188    H    LYS  28           H        LYS  28   0.463  -0.586  -6.024
  189    HA   LYS  28           HA       LYS  28   2.967  -1.721  -6.601
  190    HB2  LYS  28           HB2      LYS  28   0.857  -2.855  -7.044
  191    HB3  LYS  28           HB3      LYS  28   0.455  -1.663  -8.267
  192    HG2  LYS  28           HG2      LYS  28   1.202  -3.629  -9.365
  193    HG3  LYS  28           HG3      LYS  28   2.444  -2.392  -9.558
  194    HD2  LYS  28           HD2      LYS  28   3.500  -4.493  -9.058
  195    HD3  LYS  28           HD3      LYS  28   3.683  -3.420  -7.669
  196    HE2  LYS  28           HE2      LYS  28   3.080  -5.778  -7.094
  197    HE3  LYS  28           HE3      LYS  28   1.968  -4.560  -6.469
  198    HZ1  LYS  28           HZ1      LYS  28   0.334  -5.150  -7.964
  199    HZ2  LYS  28           HZ2      LYS  28   1.027  -6.659  -7.606
  200    HZ3  LYS  28           HZ3      LYS  28   1.422  -5.866  -9.055
  201    H    GLU  29           H        GLU  29   1.254   0.967  -8.143
  202    HA   GLU  29           HA       GLU  29   2.950   1.177 -10.395
  203    HB2  GLU  29           HB2      GLU  29   1.052   3.056  -9.047
  204    HB3  GLU  29           HB3      GLU  29   2.094   3.627 -10.347
  205    HG2  GLU  29           HG2      GLU  29   0.280   1.256 -10.585
  206    HG3  GLU  29           HG3      GLU  29  -0.190   2.891 -11.058
  207    H    LEU  30           H        LEU  30   3.308   2.022  -7.127
  208    HA   LEU  30           HA       LEU  30   5.323   4.024  -7.398
  209    HB2  LEU  30           HB2      LEU  30   4.250   2.374  -5.186
  210    HB3  LEU  30           HB3      LEU  30   5.879   2.981  -4.974
  211    HG   LEU  30           HG       LEU  30   4.090   4.402  -3.956
  212   HD11  LEU  30          2HD1      LEU  30   5.765   5.658  -6.121
  213   HD12  LEU  30          1HD1      LEU  30   6.267   5.327  -4.463
  214   HD13  LEU  30          3HD1      LEU  30   5.009   6.521  -4.781
  215   HD21  LEU  30          3HD2      LEU  30   2.396   4.118  -5.702
  216   HD22  LEU  30          2HD2      LEU  30   3.417   5.010  -6.830
  217   HD23  LEU  30          1HD2      LEU  30   2.755   5.820  -5.410
  218    H    ASN  31           H        ASN  31   7.347   3.831  -7.994
  219    HA   ASN  31           HA       ASN  31   8.521   1.368  -8.730
  220    HB2  ASN  31           HB2      ASN  31   9.152   3.434  -9.831
  221    HB3  ASN  31           HB3      ASN  31   9.745   4.103  -8.316
  222   HD21  ASN  31          1HD2      ASN  31  11.777   4.456  -9.113
  223   HD22  ASN  31          2HD2      ASN  31  12.893   3.173  -9.441
  224    H    GLY  32           H        GLY  32   9.224  -0.147  -7.387
  225    HA2  GLY  32           HA1      GLY  32  11.169  -0.603  -5.889
  226    HA3  GLY  32           HA2      GLY  32  10.543   0.696  -4.884
  227    H    VAL  33           H        VAL  33   7.815  -0.601  -5.896
  228    HA   VAL  33           HA       VAL  33   7.510  -2.169  -3.481
  229    HB   VAL  33           HB       VAL  33   5.514  -1.312  -5.580
  230   HG11  VAL  33          2HG1      VAL  33   3.793  -2.086  -3.994
  231   HG12  VAL  33          1HG1      VAL  33   5.062  -2.784  -2.988
  232   HG13  VAL  33          3HG1      VAL  33   4.785  -3.406  -4.613
  233   HG21  VAL  33          3HG2      VAL  33   6.084  -0.374  -2.775
  234   HG22  VAL  33          2HG2      VAL  33   4.692   0.132  -3.733
  235   HG23  VAL  33          1HG2      VAL  33   6.325   0.528  -4.271
  236    H    GLU  34           H        GLU  34   7.323  -4.304  -3.351
  237    HA   GLU  34           HA       GLU  34   7.831  -5.888  -5.737
  238    HB2  GLU  34           HB2      GLU  34   7.732  -6.603  -2.804
  239    HB3  GLU  34           HB3      GLU  34   8.078  -7.755  -4.085
  240    HG2  GLU  34           HG2      GLU  34   9.710  -5.285  -3.551
  241    HG3  GLU  34           HG3      GLU  34  10.081  -6.887  -2.909
  242    H    GLN  35           H        GLN  35   5.671  -6.331  -2.935
  243    HA   GLN  35           HA       GLN  35   3.548  -7.170  -4.779
  244    HB2  GLN  35           HB2      GLN  35   4.437  -8.644  -2.297
  245    HB3  GLN  35           HB3      GLN  35   2.948  -8.984  -3.167
  246    HG2  GLN  35           HG2      GLN  35   5.691  -9.155  -4.380
  247    HG3  GLN  35           HG3      GLN  35   4.829 -10.524  -3.681
  248   HE21  GLN  35          1HE2      GLN  35   4.819 -11.615  -5.639
  249   HE22  GLN  35          2HE2      GLN  35   3.779 -11.153  -6.950
  250    H    VAL  36           H        VAL  36   1.459  -6.772  -4.088
  251    HA   VAL  36           HA       VAL  36   1.189  -5.183  -1.624
  252    HB   VAL  36           HB       VAL  36  -0.360  -4.637  -4.160
  253   HG11  VAL  36          2HG1      VAL  36  -1.507  -3.938  -2.178
  254   HG12  VAL  36          1HG1      VAL  36  -0.880  -2.507  -2.999
  255   HG13  VAL  36          3HG1      VAL  36  -0.061  -3.134  -1.571
  256   HG21  VAL  36          3HG2      VAL  36   1.043  -2.652  -4.463
  257   HG22  VAL  36          2HG2      VAL  36   1.982  -4.139  -4.585
  258   HG23  VAL  36          1HG2      VAL  36   2.057  -3.166  -3.116
  259    H    LYS  37           H        LYS  37   0.180  -6.697  -0.370
  260    HA   LYS  37           HA       LYS  37  -2.084  -8.137  -1.542
  261    HB2  LYS  37           HB2      LYS  37  -0.772  -8.537   1.150
  262    HB3  LYS  37           HB3      LYS  37  -1.983  -9.575   0.412
  263    HG2  LYS  37           HG2      LYS  37  -0.385 -10.073  -1.411
  264    HG3  LYS  37           HG3      LYS  37   0.831  -9.124  -0.552
  265    HD2  LYS  37           HD2      LYS  37  -0.566 -11.580   0.513
  266    HD3  LYS  37           HD3      LYS  37   1.081 -11.524  -0.120
  267    HE2  LYS  37           HE2      LYS  37   1.747 -10.018   1.655
  268    HE3  LYS  37           HE3      LYS  37   0.091  -9.952   2.257
  269    HZ1  LYS  37           HZ1      LYS  37   0.206 -12.283   2.802
  270    HZ2  LYS  37           HZ2      LYS  37   1.505 -11.475   3.534
  271    HZ3  LYS  37           HZ3      LYS  37   1.764 -12.408   2.141
  272    H    VAL  38           H        VAL  38  -3.661  -6.571  -1.573
  273    HA   VAL  38           HA       VAL  38  -4.333  -5.121   0.823
  274    HB   VAL  38           HB       VAL  38  -4.729  -3.973  -1.239
  275   HG11  VAL  38          2HG1      VAL  38  -4.942  -5.875  -2.729
  276   HG12  VAL  38          1HG1      VAL  38  -6.317  -4.784  -2.928
  277   HG13  VAL  38          3HG1      VAL  38  -6.503  -6.282  -2.011
  278   HG21  VAL  38          3HG2      VAL  38  -7.113  -3.422  -1.062
  279   HG22  VAL  38          2HG2      VAL  38  -6.346  -3.530   0.524
  280   HG23  VAL  38          1HG2      VAL  38  -7.361  -4.849  -0.057
  281    H    GLN  39           H        GLN  39  -5.481  -5.885   2.417
  282    HA   GLN  39           HA       GLN  39  -7.010  -8.342   2.051
  283    HB2  GLN  39           HB2      GLN  39  -6.364  -6.859   4.608
  284    HB3  GLN  39           HB3      GLN  39  -7.005  -8.490   4.473
  285    HG2  GLN  39           HG2      GLN  39  -4.323  -7.696   3.377
  286    HG3  GLN  39           HG3      GLN  39  -4.556  -8.279   5.023
  287   HE21  GLN  39          1HE2      GLN  39  -3.249 -10.055   4.649
  288   HE22  GLN  39          2HE2      GLN  39  -3.786 -11.410   3.698
  289    H    LEU  40           H        LEU  40  -8.919  -7.745   1.146
  290    HA   LEU  40           HA       LEU  40 -10.365  -5.399   1.646
  291    HB2  LEU  40           HB2      LEU  40 -10.594  -7.382  -0.137
  292    HB3  LEU  40           HB3      LEU  40 -11.841  -7.896   0.979
  293    HG   LEU  40           HG       LEU  40 -11.731  -5.265  -0.499
  294   HD11  LEU  40          2HD1      LEU  40 -13.587  -7.625  -0.741
  295   HD12  LEU  40          1HD1      LEU  40 -12.345  -7.150  -1.899
  296   HD13  LEU  40          3HD1      LEU  40 -13.735  -6.102  -1.618
  297   HD21  LEU  40          3HD2      LEU  40 -13.897  -4.776   0.476
  298   HD22  LEU  40          2HD2      LEU  40 -12.689  -4.990   1.743
  299   HD23  LEU  40          1HD2      LEU  40 -13.846  -6.278   1.398
  300    H    ALA  41           H        ALA  41 -10.657  -8.649   3.041
  301    HA   ALA  41           HA       ALA  41 -12.917  -7.956   4.655
  302    HB1  ALA  41           HB1      ALA  41 -12.577 -10.220   3.791
  303    HB2  ALA  41           HB2      ALA  41 -11.130 -10.375   4.787
  304    HB3  ALA  41           HB3      ALA  41 -12.711 -10.205   5.550
  305    H    GLU  42           H        GLU  42  -9.450  -8.120   5.168
  306    HA   GLU  42           HA       GLU  42  -9.676  -8.005   8.028
  307    HB2  GLU  42           HB2      GLU  42  -7.314  -7.832   6.159
  308    HB3  GLU  42           HB3      GLU  42  -7.187  -7.823   7.906
  309    HG2  GLU  42           HG2      GLU  42  -8.351 -10.046   6.252
  310    HG3  GLU  42           HG3      GLU  42  -6.740 -10.030   6.968
  311    H    GLY  43           H        GLY  43  -9.475  -5.718   5.447
  312    HA2  GLY  43           HA1      GLY  43  -9.729  -3.413   5.567
  313    HA3  GLY  43           HA2      GLY  43  -9.769  -3.549   7.316
  314    H    THR  44           H        THR  44  -7.161  -4.973   5.566
  315    HA   THR  44           HA       THR  44  -5.405  -2.710   6.197
  316    HB   THR  44           HB       THR  44  -3.688  -4.471   6.952
  317    HG1  THR  44           HG1      THR  44  -5.320  -6.183   8.059
  318   HG21  THR  44          3HG2      THR  44  -6.103  -3.876   8.663
  319   HG22  THR  44          1HG2      THR  44  -4.656  -2.882   8.505
  320   HG23  THR  44          2HG2      THR  44  -4.556  -4.469   9.267
  321    H    VAL  45           H        VAL  45  -3.210  -3.020   5.192
  322    HA   VAL  45           HA       VAL  45  -3.269  -4.753   2.818
  323    HB   VAL  45           HB       VAL  45  -2.379  -1.857   2.858
  324   HG11  VAL  45          2HG1      VAL  45  -1.871  -2.189   0.469
  325   HG12  VAL  45          1HG1      VAL  45  -2.212  -3.910   0.646
  326   HG13  VAL  45          3HG1      VAL  45  -0.854  -3.186   1.507
  327   HG21  VAL  45          3HG2      VAL  45  -4.554  -3.230   1.281
  328   HG22  VAL  45          2HG2      VAL  45  -4.117  -1.525   1.191
  329   HG23  VAL  45          1HG2      VAL  45  -4.806  -2.182   2.676
  330    H    GLU  46           H        GLU  46  -1.519  -5.971   2.644
  331    HA   GLU  46           HA       GLU  46   0.831  -5.310   4.292
  332    HB2  GLU  46           HB2      GLU  46  -0.062  -7.983   3.186
  333    HB3  GLU  46           HB3      GLU  46   1.346  -7.713   4.208
  334    HG2  GLU  46           HG2      GLU  46  -0.064  -7.014   6.033
  335    HG3  GLU  46           HG3      GLU  46  -1.497  -7.149   5.017
  336    H    VAL  47           H        VAL  47   2.512  -4.534   3.194
  337    HA   VAL  47           HA       VAL  47   2.818  -5.306   0.361
  338    HB   VAL  47           HB       VAL  47   3.253  -2.530   1.477
  339   HG11  VAL  47          2HG1      VAL  47   3.416  -3.586  -1.342
  340   HG12  VAL  47          1HG1      VAL  47   4.759  -3.024  -0.348
  341   HG13  VAL  47          3HG1      VAL  47   3.522  -1.888  -0.881
  342   HG21  VAL  47          3HG2      VAL  47   1.051  -3.566  -0.301
  343   HG22  VAL  47          2HG2      VAL  47   1.310  -1.878   0.138
  344   HG23  VAL  47          1HG2      VAL  47   0.884  -3.057   1.380
  345    H    THR  48           H        THR  48   4.796  -5.960  -0.201
  346    HA   THR  48           HA       THR  48   7.040  -5.484   1.617
  347    HB   THR  48           HB       THR  48   7.159  -7.062  -0.954
  348    HG1  THR  48           HG1      THR  48   5.980  -7.731   1.505
  349   HG21  THR  48          3HG2      THR  48   9.283  -6.506   0.164
  350   HG22  THR  48          1HG2      THR  48   8.965  -8.241   0.196
  351   HG23  THR  48          2HG2      THR  48   8.695  -7.269   1.643
  352    H    ILE  49           H        ILE  49   8.128  -3.629   1.295
  353    HA   ILE  49           HA       ILE  49   8.344  -2.624  -1.474
  354    HB   ILE  49           HB       ILE  49   8.550  -0.374  -0.601
  355   HG12  ILE  49          2HG1      ILE  49   8.044  -1.463   2.168
  356   HG13  ILE  49          3HG1      ILE  49   9.667  -1.159   1.559
  357   HG21  ILE  49          2HG2      ILE  49   6.310  -1.160  -1.046
  358   HG22  ILE  49          1HG2      ILE  49   6.302  -0.080   0.350
  359   HG23  ILE  49          3HG2      ILE  49   6.192  -1.827   0.584
  360   HD11  ILE  49          3HD1      ILE  49   7.480   0.864   1.972
  361   HD12  ILE  49          2HD1      ILE  49   9.031   1.210   1.207
  362   HD13  ILE  49          1HD1      ILE  49   8.975   0.696   2.893
  363    H    ASP  50           H        ASP  50  10.306  -1.621  -2.085
  364    HA   ASP  50           HA       ASP  50  12.638  -2.406  -0.509
  365    HB2  ASP  50           HB2      ASP  50  12.570  -2.658  -3.050
  366    HB3  ASP  50           HB3      ASP  50  12.620  -0.901  -3.135
  367    H    SER  51           H        SER  51  12.736  -1.070   1.216
  368    HA   SER  51           HA       SER  51  11.897   1.660   1.073
  369    HB2  SER  51           HB2      SER  51  11.655   0.201   3.097
  370    HB3  SER  51           HB3      SER  51  13.399   0.289   3.312
  371    HG   SER  51           HG       SER  51  13.258   2.425   3.787
  372    H    SER  52           H        SER  52  14.705   0.152   0.110
  373    HA   SER  52           HA       SER  52  16.486   2.347   0.727
  374    HB2  SER  52           HB2      SER  52  17.289  -0.025   0.548
  375    HB3  SER  52           HB3      SER  52  16.927   0.031  -1.177
  376    HG   SER  52           HG       SER  52  18.382   1.924  -1.199
  377    H    VAL  53           H        VAL  53  14.045   1.775  -1.440
  378    HA   VAL  53           HA       VAL  53  15.126   3.751  -3.342
  379    HB   VAL  53           HB       VAL  53  13.173   1.514  -3.928
  380   HG11  VAL  53          2HG1      VAL  53  12.728   3.484  -5.276
  381   HG12  VAL  53          1HG1      VAL  53  13.415   2.197  -6.270
  382   HG13  VAL  53          3HG1      VAL  53  14.423   3.553  -5.766
  383   HG21  VAL  53          3HG2      VAL  53  14.962   0.522  -5.245
  384   HG22  VAL  53          2HG2      VAL  53  15.468   0.714  -3.565
  385   HG23  VAL  53          1HG2      VAL  53  16.046   1.838  -4.794
  386    H    VAL  54           H        VAL  54  11.943   2.334  -2.606
  387    HA   VAL  54           HA       VAL  54  10.791   5.019  -2.677
  388    HB   VAL  54           HB       VAL  54   9.735   3.226  -4.029
  389   HG11  VAL  54          2HG1      VAL  54   9.046   2.000  -1.366
  390   HG12  VAL  54          1HG1      VAL  54  10.151   1.330  -2.565
  391   HG13  VAL  54          3HG1      VAL  54   8.431   1.472  -2.932
  392   HG21  VAL  54          3HG2      VAL  54   7.413   3.664  -3.323
  393   HG22  VAL  54          2HG2      VAL  54   8.400   5.125  -3.359
  394   HG23  VAL  54          1HG2      VAL  54   8.022   4.354  -1.819
  395    H    THR  55           H        THR  55   9.655   5.901  -0.925
  396    HA   THR  55           HA       THR  55  10.260   4.603   1.636
  397    HB   THR  55           HB       THR  55   9.845   6.763   2.691
  398    HG1  THR  55           HG1      THR  55   9.297   7.664   0.030
  399   HG21  THR  55          3HG2      THR  55  11.721   8.024   1.746
  400   HG22  THR  55          1HG2      THR  55  11.681   7.004   0.309
  401   HG23  THR  55          2HG2      THR  55  12.100   6.308   1.873
  402    H    LEU  56           H        LEU  56   8.608   4.703   3.324
  403    HA   LEU  56           HA       LEU  56   6.125   3.732   2.451
  404    HB2  LEU  56           HB2      LEU  56   5.417   4.052   4.835
  405    HB3  LEU  56           HB3      LEU  56   6.861   3.090   4.603
  406    HG   LEU  56           HG       LEU  56   8.093   5.366   5.075
  407   HD11  LEU  56          2HD1      LEU  56   6.907   6.742   6.713
  408   HD12  LEU  56          1HD1      LEU  56   5.448   5.784   6.460
  409   HD13  LEU  56          3HD1      LEU  56   6.100   6.760   5.145
  410   HD21  LEU  56          3HD2      LEU  56   6.775   3.720   7.228
  411   HD22  LEU  56          2HD2      LEU  56   8.172   4.774   7.447
  412   HD23  LEU  56          1HD2      LEU  56   8.294   3.349   6.416
  413    H    LYS  57           H        LYS  57   7.244   6.960   3.112
  414    HA   LYS  57           HA       LYS  57   4.711   8.190   3.395
  415    HB2  LYS  57           HB2      LYS  57   7.403   9.016   3.487
  416    HB3  LYS  57           HB3      LYS  57   6.605  10.012   2.274
  417    HG2  LYS  57           HG2      LYS  57   5.638   9.585   5.082
  418    HG3  LYS  57           HG3      LYS  57   6.516  11.008   4.511
  419    HD2  LYS  57           HD2      LYS  57   4.677  11.441   2.908
  420    HD3  LYS  57           HD3      LYS  57   3.798  10.062   3.577
  421    HE2  LYS  57           HE2      LYS  57   3.919  11.171   5.808
  422    HE3  LYS  57           HE3      LYS  57   4.601  12.585   5.008
  423    HZ1  LYS  57           HZ1      LYS  57   2.528  12.558   3.590
  424    HZ2  LYS  57           HZ2      LYS  57   2.324  13.008   5.210
  425    HZ3  LYS  57           HZ3      LYS  57   1.881  11.452   4.706
  426    H    ASP  58           H        ASP  58   6.858   7.711   0.599
  427    HA   ASP  58           HA       ASP  58   5.475   9.177  -1.311
  428    HB2  ASP  58           HB2      ASP  58   6.858   6.503  -1.691
  429    HB3  ASP  58           HB3      ASP  58   6.364   7.565  -2.999
  430    H    ILE  59           H        ILE  59   5.081   5.803  -0.397
  431    HA   ILE  59           HA       ILE  59   2.977   5.190  -2.144
  432    HB   ILE  59           HB       ILE  59   3.704   3.898   0.485
  433   HG12  ILE  59          2HG1      ILE  59   4.515   3.193  -2.342
  434   HG13  ILE  59          3HG1      ILE  59   5.545   4.019  -1.178
  435   HG21  ILE  59          2HG2      ILE  59   2.553   1.933  -0.365
  436   HG22  ILE  59          1HG2      ILE  59   2.114   2.805  -1.832
  437   HG23  ILE  59          3HG2      ILE  59   1.450   3.307  -0.278
  438   HD11  ILE  59          3HD1      ILE  59   5.507   2.073   0.261
  439   HD12  ILE  59          2HD1      ILE  59   6.069   1.647  -1.354
  440   HD13  ILE  59          1HD1      ILE  59   4.425   1.248  -0.858
  441    H    VAL  60           H        VAL  60   2.914   5.957   1.346
  442    HA   VAL  60           HA       VAL  60   0.142   5.805   1.668
  443    HB   VAL  60           HB       VAL  60   2.168   7.451   3.196
  444   HG11  VAL  60          2HG1      VAL  60  -0.697   6.829   3.909
  445   HG12  VAL  60          1HG1      VAL  60  -0.049   8.417   3.499
  446   HG13  VAL  60          3HG1      VAL  60   0.481   7.602   4.970
  447   HG21  VAL  60          3HG2      VAL  60   0.859   4.793   3.762
  448   HG22  VAL  60          2HG2      VAL  60   1.936   5.653   4.863
  449   HG23  VAL  60          1HG2      VAL  60   2.546   5.056   3.319
  450    H    ALA  61           H        ALA  61   2.206   8.526   0.733
  451    HA   ALA  61           HA       ALA  61   0.302  10.551   0.711
  452    HB1  ALA  61           HB1      ALA  61   1.744  11.695  -0.889
  453    HB2  ALA  61           HB2      ALA  61   2.691  10.963   0.407
  454    HB3  ALA  61           HB3      ALA  61   2.625  10.195  -1.180
  455    H    VAL  62           H        VAL  62   1.215   8.279  -1.870
  456    HA   VAL  62           HA       VAL  62  -0.627   9.268  -3.784
  457    HB   VAL  62           HB       VAL  62   0.652   6.536  -3.602
  458   HG11  VAL  62          2HG1      VAL  62   0.157   6.330  -5.985
  459   HG12  VAL  62          1HG1      VAL  62  -0.689   7.878  -5.949
  460   HG13  VAL  62          3HG1      VAL  62  -1.323   6.506  -5.043
  461   HG21  VAL  62          3HG2      VAL  62   1.454   8.981  -5.174
  462   HG22  VAL  62          2HG2      VAL  62   2.255   7.411  -5.216
  463   HG23  VAL  62          1HG2      VAL  62   2.267   8.366  -3.735
  464    H    ILE  63           H        ILE  63  -0.814   6.589  -1.458
  465    HA   ILE  63           HA       ILE  63  -3.252   5.498  -2.313
  466    HB   ILE  63           HB       ILE  63  -2.082   5.537   0.472
  467   HG12  ILE  63          2HG1      ILE  63  -2.010   3.395  -1.664
  468   HG13  ILE  63          3HG1      ILE  63  -0.663   4.450  -1.246
  469   HG21  ILE  63          2HG2      ILE  63  -4.483   5.093   0.521
  470   HG22  ILE  63          1HG2      ILE  63  -3.557   3.655   0.947
  471   HG23  ILE  63          3HG2      ILE  63  -4.271   3.798  -0.658
  472   HD11  ILE  63          3HD1      ILE  63  -1.975   2.458   0.591
  473   HD12  ILE  63          2HD1      ILE  63  -0.619   3.508   1.001
  474   HD13  ILE  63          1HD1      ILE  63  -0.425   2.258  -0.228
  475    H    GLU  64           H        GLU  64  -2.603   7.937   0.193
  476    HA   GLU  64           HA       GLU  64  -5.351   8.201   0.887
  477    HB2  GLU  64           HB2      GLU  64  -3.031  10.044   1.475
  478    HB3  GLU  64           HB3      GLU  64  -4.619  10.125   2.230
  479    HG2  GLU  64           HG2      GLU  64  -4.244   7.765   3.021
  480    HG3  GLU  64           HG3      GLU  64  -2.579   7.932   2.467
  481    H    ASP  65           H        ASP  65  -3.318   9.649  -1.507
  482    HA   ASP  65           HA       ASP  65  -4.981  11.861  -2.150
  483    HB2  ASP  65           HB2      ASP  65  -2.667  11.783  -2.904
  484    HB3  ASP  65           HB3      ASP  65  -2.986  10.324  -3.834
  485    H    GLN  66           H        GLN  66  -5.213   8.485  -2.712
  486    HA   GLN  66           HA       GLN  66  -7.024   8.637  -4.940
  487    HB2  GLN  66           HB2      GLN  66  -6.330   6.370  -3.068
  488    HB3  GLN  66           HB3      GLN  66  -7.371   6.208  -4.474
  489    HG2  GLN  66           HG2      GLN  66  -4.527   7.155  -4.638
  490    HG3  GLN  66           HG3      GLN  66  -4.992   5.459  -4.756
  491   HE21  GLN  66          1HE2      GLN  66  -4.291   5.217  -6.827
  492   HE22  GLN  66          2HE2      GLN  66  -5.073   5.951  -8.186
  493    H    GLY  67           H        GLY  67  -7.282   8.882  -1.529
  494    HA2  GLY  67           HA1      GLY  67  -9.385   9.826  -0.696
  495    HA3  GLY  67           HA2      GLY  67 -10.223   8.706  -1.757
  496    H    TYR  68           H        TYR  68  -7.444   7.911   0.250
  497    HA   TYR  68           HA       TYR  68  -9.212   6.345   2.007
  498    HB2  TYR  68           HB2      TYR  68  -6.461   5.481   1.072
  499    HB3  TYR  68           HB3      TYR  68  -7.539   4.580   2.129
  500    HD1  TYR  68           HD1      TYR  68  -9.726   3.710   1.170
  501    HD2  TYR  68           HD2      TYR  68  -6.594   5.252  -1.261
  502    HE1  TYR  68           HE1      TYR  68 -10.677   2.554  -0.780
  503    HE2  TYR  68           HE2      TYR  68  -7.540   4.107  -3.217
  504    HH   TYR  68           HH       TYR  68 -10.644   2.783  -3.255
  505    H    ASP  69           H        ASP  69  -8.445   6.078   4.167
  506    HA   ASP  69           HA       ASP  69  -6.199   7.847   4.894
  507    HB2  ASP  69           HB2      ASP  69  -8.647   7.067   6.491
  508    HB3  ASP  69           HB3      ASP  69  -7.234   7.828   7.214
  509    H    VAL  70           H        VAL  70  -4.447   6.587   5.040
  510    HA   VAL  70           HA       VAL  70  -4.789   3.942   6.286
  511    HB   VAL  70           HB       VAL  70  -3.087   3.033   4.773
  512   HG11  VAL  70          2HG1      VAL  70  -5.453   2.812   4.201
  513   HG12  VAL  70          1HG1      VAL  70  -4.449   2.936   2.758
  514   HG13  VAL  70          3HG1      VAL  70  -5.381   4.331   3.306
  515   HG21  VAL  70          3HG2      VAL  70  -2.380   4.285   2.796
  516   HG22  VAL  70          2HG2      VAL  70  -1.861   5.078   4.283
  517   HG23  VAL  70          1HG2      VAL  70  -3.247   5.705   3.384
  518    H    GLN  71           H        GLN  71  -2.778   2.991   7.063
  519    HA   GLN  71           HA       GLN  71  -0.960   2.945   8.394
  520    HB2  GLN  71           HB2      GLN  71   0.068   4.154   6.411
  521    HB3  GLN  71           HB3      GLN  71  -0.190   5.649   7.300
  522    HG2  GLN  71           HG2      GLN  71   1.172   4.703   9.155
  523    HG3  GLN  71           HG3      GLN  71   1.528   3.322   8.120
  524   HE21  GLN  71          1HE2      GLN  71   3.700   3.687   8.033
  525   HE22  GLN  71          2HE2      GLN  71   4.401   5.035   7.209
  Start of MODEL   14
    1    H1   SER   1           H1       SER   1  17.821  -5.244  -5.708
    2    H2   SER   1           H2       SER   1  17.161  -3.704  -5.439
    3    H3   SER   1           H3       SER   1  16.220  -4.915  -6.160
    4    HA   SER   1           HA       SER   1  15.620  -4.581  -3.849
    5    HB2  SER   1           HB2      SER   1  17.017  -7.223  -4.354
    6    HB3  SER   1           HB3      SER   1  15.712  -6.935  -3.204
    7    HG   SER   1           HG       SER   1  14.836  -7.801  -5.074
    8    H    ASN   2           H        ASN   2  16.548  -3.378  -2.304
    9    HA   ASN   2           HA       ASN   2  19.203  -4.218  -1.323
   10    HB2  ASN   2           HB2      ASN   2  19.157  -1.929  -2.186
   11    HB3  ASN   2           HB3      ASN   2  17.832  -1.530  -1.097
   12   HD21  ASN   2          1HD2      ASN   2  18.246  -1.184   1.058
   13   HD22  ASN   2          2HD2      ASN   2  19.846  -1.008   1.697
   14    H    ALA   3           H        ALA   3  16.246  -2.637  -0.038
   15    HA   ALA   3           HA       ALA   3  16.377  -4.492   2.234
   16    HB1  ALA   3           HB1      ALA   3  16.153  -1.498   2.537
   17    HB2  ALA   3           HB2      ALA   3  16.038  -2.680   3.842
   18    HB3  ALA   3           HB3      ALA   3  17.555  -2.483   2.962
   19    H    MET   4           H        MET   4  14.517  -5.561   1.802
   20    HA   MET   4           HA       MET   4  12.164  -4.063   1.003
   21    HB2  MET   4           HB2      MET   4  12.772  -6.994   1.226
   22    HB3  MET   4           HB3      MET   4  11.131  -6.412   0.977
   23    HG2  MET   4           HG2      MET   4  11.880  -5.257  -1.061
   24    HG3  MET   4           HG3      MET   4  13.491  -5.930  -0.822
   25    HE1  MET   4           HE1      MET   4  11.849  -7.823  -3.910
   26    HE2  MET   4           HE2      MET   4  11.505  -6.167  -3.404
   27    HE3  MET   4           HE3      MET   4  13.168  -6.759  -3.411
   28    H    GLU   5           H        GLU   5  10.754  -3.306   2.345
   29    HA   GLU   5           HA       GLU   5  10.557  -4.445   5.050
   30    HB2  GLU   5           HB2      GLU   5   9.623  -1.763   4.007
   31    HB3  GLU   5           HB3      GLU   5   9.477  -2.317   5.667
   32    HG2  GLU   5           HG2      GLU   5  12.042  -1.809   4.186
   33    HG3  GLU   5           HG3      GLU   5  11.325  -0.776   5.420
   34    H    GLN   6           H        GLN   6   8.796  -5.581   5.561
   35    HA   GLN   6           HA       GLN   6   6.481  -5.465   3.755
   36    HB2  GLN   6           HB2      GLN   6   7.212  -7.471   5.893
   37    HB3  GLN   6           HB3      GLN   6   5.795  -7.567   4.858
   38    HG2  GLN   6           HG2      GLN   6   7.226  -7.762   2.899
   39    HG3  GLN   6           HG3      GLN   6   8.654  -7.648   3.927
   40   HE21  GLN   6          1HE2      GLN   6   9.209  -9.379   5.232
   41   HE22  GLN   6          2HE2      GLN   6   8.539 -10.960   5.008
   42    H    LEU   7           H        LEU   7   5.184  -3.845   4.394
   43    HA   LEU   7           HA       LEU   7   4.695  -3.530   7.283
   44    HB2  LEU   7           HB2      LEU   7   4.443  -1.485   5.081
   45    HB3  LEU   7           HB3      LEU   7   4.153  -1.196   6.786
   46    HG   LEU   7           HG       LEU   7   6.819  -1.993   5.615
   47   HD11  LEU   7          2HD1      LEU   7   7.474   0.312   6.003
   48   HD12  LEU   7          1HD1      LEU   7   5.846   0.696   6.563
   49   HD13  LEU   7          3HD1      LEU   7   6.115   0.231   4.882
   50   HD21  LEU   7          3HD2      LEU   7   6.065  -1.034   8.372
   51   HD22  LEU   7          2HD2      LEU   7   7.694  -1.401   7.808
   52   HD23  LEU   7          1HD2      LEU   7   6.495  -2.690   7.943
   53    H    THR   8           H        THR   8   2.642  -3.466   8.047
   54    HA   THR   8           HA       THR   8   0.484  -3.992   6.129
   55    HB   THR   8           HB       THR   8   0.462  -4.405   9.126
   56    HG1  THR   8           HG1      THR   8   0.508  -6.576   7.357
   57   HG21  THR   8          3HG2      THR   8  -1.417  -5.354   6.958
   58   HG22  THR   8          1HG2      THR   8  -1.760  -4.110   8.163
   59   HG23  THR   8          2HG2      THR   8  -1.520  -5.785   8.664
   60    H    LEU   9           H        LEU   9  -0.582  -2.205   5.575
   61    HA   LEU   9           HA       LEU   9  -0.786   0.002   7.498
   62    HB2  LEU   9           HB2      LEU   9  -1.221  -0.152   4.517
   63    HB3  LEU   9           HB3      LEU   9  -1.645   1.258   5.464
   64    HG   LEU   9           HG       LEU   9   0.779   1.427   6.141
   65   HD11  LEU   9          2HD1      LEU   9   1.122  -0.640   3.973
   66   HD12  LEU   9          1HD1      LEU   9   1.497  -0.840   5.686
   67   HD13  LEU   9          3HD1      LEU   9   2.423   0.299   4.709
   68   HD21  LEU   9          3HD2      LEU   9   1.474   2.394   3.993
   69   HD22  LEU   9          2HD2      LEU   9  -0.167   2.859   4.438
   70   HD23  LEU   9          1HD2      LEU   9   0.095   1.617   3.214
   71    H    GLN  10           H        GLN  10  -2.649   0.380   8.534
   72    HA   GLN  10           HA       GLN  10  -5.020  -1.095   7.779
   73    HB2  GLN  10           HB2      GLN  10  -6.069   0.112   9.737
   74    HB3  GLN  10           HB3      GLN  10  -4.729  -0.941  10.128
   75    HG2  GLN  10           HG2      GLN  10  -4.270   1.963   9.707
   76    HG3  GLN  10           HG3      GLN  10  -4.911   1.356  11.231
   77   HE21  GLN  10          1HE2      GLN  10  -3.637   0.046  12.527
   78   HE22  GLN  10          2HE2      GLN  10  -1.911  -0.019  12.345
   79    H    VAL  11           H        VAL  11  -6.606  -0.390   6.555
   80    HA   VAL  11           HA       VAL  11  -6.579   2.447   5.768
   81    HB   VAL  11           HB       VAL  11  -5.630   1.364   3.915
   82   HG11  VAL  11          2HG1      VAL  11  -6.018  -0.935   4.568
   83   HG12  VAL  11          1HG1      VAL  11  -6.553  -0.686   2.904
   84   HG13  VAL  11          3HG1      VAL  11  -7.737  -0.769   4.209
   85   HG21  VAL  11          3HG2      VAL  11  -7.500   2.838   3.304
   86   HG22  VAL  11          2HG2      VAL  11  -8.582   1.446   3.318
   87   HG23  VAL  11          1HG2      VAL  11  -7.271   1.531   2.143
   88    H    GLU  12           H        GLU  12  -8.431   3.484   5.876
   89    HA   GLU  12           HA       GLU  12 -10.926   1.916   5.876
   90    HB2  GLU  12           HB2      GLU  12 -10.378   4.543   7.283
   91    HB3  GLU  12           HB3      GLU  12 -11.926   3.711   7.246
   92    HG2  GLU  12           HG2      GLU  12 -10.891   1.797   8.405
   93    HG3  GLU  12           HG3      GLU  12  -9.383   2.702   8.501
   94    H    GLY  13           H        GLY  13 -12.669   2.764   4.658
   95    HA2  GLY  13           HA1      GLY  13 -13.502   4.723   3.381
   96    HA3  GLY  13           HA2      GLY  13 -11.861   4.906   2.782
   97    H    MET  14           H        MET  14 -11.903   1.783   2.736
   98    HA   MET  14           HA       MET  14 -13.167   1.632   0.085
   99    HB2  MET  14           HB2      MET  14 -11.658  -0.145  -0.463
  100    HB3  MET  14           HB3      MET  14 -10.715   1.184   0.192
  101    HG2  MET  14           HG2      MET  14 -10.540   0.025   2.323
  102    HG3  MET  14           HG3      MET  14 -11.520  -1.301   1.691
  103    HE1  MET  14           HE1      MET  14  -9.812  -3.234   2.099
  104    HE2  MET  14           HE2      MET  14  -8.081  -3.068   1.805
  105    HE3  MET  14           HE3      MET  14  -8.875  -2.044   3.000
  106    H    SER  15           H        SER  15 -14.626  -0.014  -0.380
  107    HA   SER  15           HA       SER  15 -15.246  -1.904   1.767
  108    HB2  SER  15           HB2      SER  15 -17.319  -0.109   0.490
  109    HB3  SER  15           HB3      SER  15 -17.624  -1.350   1.704
  110    HG   SER  15           HG       SER  15 -15.861   0.039   2.868
  111    H    CYS  16           H        CYS  16 -14.524  -1.576  -1.393
  112    HA   CYS  16           HA       CYS  16 -16.011  -3.992  -2.088
  113    HB2  CYS  16           HB2      CYS  16 -16.625  -3.063  -4.296
  114    HB3  CYS  16           HB3      CYS  16 -17.385  -2.194  -2.967
  115    HG   CYS  16           HG       CYS  16 -16.108   0.109  -3.236
  116    H    GLY  17           H        GLY  17 -15.255  -4.872  -4.250
  117    HA2  GLY  17           HA1      GLY  17 -12.458  -5.282  -4.123
  118    HA3  GLY  17           HA2      GLY  17 -13.532  -5.854  -5.395
  119    H    HIS  18           H        HIS  18 -14.446  -3.083  -5.968
  120    HA   HIS  18           HA       HIS  18 -12.650  -2.296  -7.947
  121    HB2  HIS  18           HB2      HIS  18 -14.975  -1.508  -7.873
  122    HB3  HIS  18           HB3      HIS  18 -14.629  -0.587  -6.414
  123    HD1  HIS  18           HD1      HIS  18 -14.186   1.816  -6.819
  124    HD2  HIS  18           HD2      HIS  18 -13.241  -0.524 -10.134
  125    HE1  HIS  18           HE1      HIS  18 -13.441   3.427  -8.600
  126    HE2  HIS  18           HE2      HIS  18 -12.729   1.983 -10.544
  127    H    CYS  19           H        CYS  19 -12.991  -1.187  -4.608
  128    HA   CYS  19           HA       CYS  19 -10.848   0.650  -4.656
  129    HB2  CYS  19           HB2      CYS  19 -11.971  -0.891  -2.308
  130    HB3  CYS  19           HB3      CYS  19 -10.989   0.569  -2.219
  131    HG   CYS  19           HG       CYS  19 -13.031   2.013  -3.748
  132    H    VAL  20           H        VAL  20 -11.074  -2.736  -3.598
  133    HA   VAL  20           HA       VAL  20  -8.521  -3.240  -2.749
  134    HB   VAL  20           HB       VAL  20 -10.272  -5.039  -4.436
  135   HG11  VAL  20          2HG1      VAL  20  -7.975  -5.840  -4.465
  136   HG12  VAL  20          1HG1      VAL  20  -8.990  -6.901  -3.488
  137   HG13  VAL  20          3HG1      VAL  20  -7.909  -5.748  -2.705
  138   HG21  VAL  20          3HG2      VAL  20 -11.333  -4.286  -2.380
  139   HG22  VAL  20          2HG2      VAL  20  -9.939  -4.829  -1.450
  140   HG23  VAL  20          1HG2      VAL  20 -10.945  -6.004  -2.298
  141    H    ASN  21           H        ASN  21  -9.679  -3.544  -6.103
  142    HA   ASN  21           HA       ASN  21  -7.211  -4.135  -7.284
  143    HB2  ASN  21           HB2      ASN  21  -9.292  -4.471  -8.473
  144    HB3  ASN  21           HB3      ASN  21  -9.649  -2.750  -8.417
  145   HD21  ASN  21          1HD2      ASN  21  -6.493  -4.132  -9.136
  146   HD22  ASN  21          2HD2      ASN  21  -6.436  -3.589 -10.781
  147    H    ALA  22           H        ALA  22  -8.855  -1.010  -6.898
  148    HA   ALA  22           HA       ALA  22  -7.008   0.565  -8.266
  149    HB1  ALA  22           HB1      ALA  22  -8.017   2.461  -7.133
  150    HB2  ALA  22           HB2      ALA  22  -9.252   1.316  -7.654
  151    HB3  ALA  22           HB3      ALA  22  -8.769   1.380  -5.960
  152    H    ILE  23           H        ILE  23  -7.282   0.136  -4.711
  153    HA   ILE  23           HA       ILE  23  -5.004   1.722  -4.183
  154    HB   ILE  23           HB       ILE  23  -6.724   1.324  -2.479
  155   HG12  ILE  23          2HG1      ILE  23  -4.012   0.310  -1.606
  156   HG13  ILE  23          3HG1      ILE  23  -4.410   2.006  -1.866
  157   HG21  ILE  23          2HG2      ILE  23  -5.609  -1.477  -2.325
  158   HG22  ILE  23          1HG2      ILE  23  -7.200  -1.026  -2.935
  159   HG23  ILE  23          3HG2      ILE  23  -6.807  -0.778  -1.233
  160   HD11  ILE  23          3HD1      ILE  23  -4.462   1.368   0.498
  161   HD12  ILE  23          2HD1      ILE  23  -5.739   0.207   0.144
  162   HD13  ILE  23          1HD1      ILE  23  -6.030   1.932  -0.078
  163    H    GLU  24           H        GLU  24  -5.423  -1.725  -4.727
  164    HA   GLU  24           HA       GLU  24  -2.938  -2.655  -3.899
  165    HB2  GLU  24           HB2      GLU  24  -4.806  -4.110  -4.595
  166    HB3  GLU  24           HB3      GLU  24  -4.569  -3.603  -6.260
  167    HG2  GLU  24           HG2      GLU  24  -2.327  -4.584  -6.230
  168    HG3  GLU  24           HG3      GLU  24  -2.597  -5.124  -4.573
  169    H    SER  25           H        SER  25  -3.911  -1.535  -7.165
  170    HA   SER  25           HA       SER  25  -1.236  -1.716  -8.124
  171    HB2  SER  25           HB2      SER  25  -3.559  -0.202  -9.313
  172    HB3  SER  25           HB3      SER  25  -2.018  -0.551 -10.109
  173    HG   SER  25           HG       SER  25  -3.051  -2.829  -9.131
  174    H    SER  26           H        SER  26  -3.167   0.872  -6.728
  175    HA   SER  26           HA       SER  26  -1.661   3.075  -7.471
  176    HB2  SER  26           HB2      SER  26  -3.014   2.582  -4.802
  177    HB3  SER  26           HB3      SER  26  -2.479   4.155  -5.396
  178    HG   SER  26           HG       SER  26  -4.424   2.467  -6.613
  179    H    VAL  27           H        VAL  27  -1.132   0.798  -4.821
  180    HA   VAL  27           HA       VAL  27   1.354   2.058  -4.060
  181    HB   VAL  27           HB       VAL  27   0.301  -0.654  -3.232
  182   HG11  VAL  27          2HG1      VAL  27   1.771  -0.379  -1.305
  183   HG12  VAL  27          1HG1      VAL  27   2.330   1.167  -1.942
  184   HG13  VAL  27          3HG1      VAL  27   2.686  -0.325  -2.812
  185   HG21  VAL  27          3HG2      VAL  27  -0.558   0.472  -1.233
  186   HG22  VAL  27          2HG2      VAL  27  -1.324   1.080  -2.701
  187   HG23  VAL  27          1HG2      VAL  27  -0.070   2.029  -1.905
  188    H    LYS  28           H        LYS  28   0.348  -0.771  -5.942
  189    HA   LYS  28           HA       LYS  28   2.923  -1.986  -5.971
  190    HB2  LYS  28           HB2      LYS  28   0.709  -3.167  -6.255
  191    HB3  LYS  28           HB3      LYS  28   0.676  -2.541  -7.899
  192    HG2  LYS  28           HG2      LYS  28   2.899  -3.647  -8.253
  193    HG3  LYS  28           HG3      LYS  28   2.667  -4.436  -6.694
  194    HD2  LYS  28           HD2      LYS  28   0.553  -5.396  -7.539
  195    HD3  LYS  28           HD3      LYS  28   0.886  -4.667  -9.112
  196    HE2  LYS  28           HE2      LYS  28   2.512  -6.768  -7.691
  197    HE3  LYS  28           HE3      LYS  28   1.571  -6.961  -9.169
  198    HZ1  LYS  28           HZ1      LYS  28   4.015  -5.300  -8.838
  199    HZ2  LYS  28           HZ2      LYS  28   3.076  -5.355 -10.249
  200    HZ3  LYS  28           HZ3      LYS  28   3.884  -6.748  -9.711
  201    H    GLU  29           H        GLU  29   1.266   0.201  -8.180
  202    HA   GLU  29           HA       GLU  29   2.935  -0.128 -10.432
  203    HB2  GLU  29           HB2      GLU  29   1.405   2.300  -9.484
  204    HB3  GLU  29           HB3      GLU  29   2.183   2.170 -11.053
  205    HG2  GLU  29           HG2      GLU  29   0.734   0.322 -11.644
  206    HG3  GLU  29           HG3      GLU  29  -0.025   0.392 -10.054
  207    H    LEU  30           H        LEU  30   3.235   1.619  -7.484
  208    HA   LEU  30           HA       LEU  30   5.116   3.556  -8.148
  209    HB2  LEU  30           HB2      LEU  30   4.841   2.076  -5.533
  210    HB3  LEU  30           HB3      LEU  30   5.734   3.566  -5.754
  211    HG   LEU  30           HG       LEU  30   2.758   3.160  -5.939
  212   HD11  LEU  30          2HD1      LEU  30   4.497   4.867  -4.166
  213   HD12  LEU  30          1HD1      LEU  30   3.629   3.402  -3.696
  214   HD13  LEU  30          3HD1      LEU  30   2.732   4.849  -4.162
  215   HD21  LEU  30          3HD2      LEU  30   2.633   5.578  -6.456
  216   HD22  LEU  30          2HD2      LEU  30   3.356   4.624  -7.751
  217   HD23  LEU  30          1HD2      LEU  30   4.383   5.588  -6.688
  218    H    ASN  31           H        ASN  31   7.277   3.655  -8.299
  219    HA   ASN  31           HA       ASN  31   8.660   1.235  -8.956
  220    HB2  ASN  31           HB2      ASN  31   9.067   3.368 -10.140
  221    HB3  ASN  31           HB3      ASN  31   9.727   4.051  -8.655
  222   HD21  ASN  31          1HD2      ASN  31  11.731   4.432  -9.527
  223   HD22  ASN  31          2HD2      ASN  31  12.843   3.158  -9.916
  224    H    GLY  32           H        GLY  32   9.672  -0.064  -7.591
  225    HA2  GLY  32           HA1      GLY  32  11.419  -0.293  -5.893
  226    HA3  GLY  32           HA2      GLY  32  10.688   1.077  -5.063
  227    H    VAL  33           H        VAL  33   8.197  -0.628  -6.269
  228    HA   VAL  33           HA       VAL  33   7.751  -1.955  -3.710
  229    HB   VAL  33           HB       VAL  33   5.799  -1.087  -5.847
  230   HG11  VAL  33          2HG1      VAL  33   5.038  -3.156  -4.830
  231   HG12  VAL  33          1HG1      VAL  33   4.046  -1.804  -4.284
  232   HG13  VAL  33          3HG1      VAL  33   5.281  -2.479  -3.222
  233   HG21  VAL  33          3HG2      VAL  33   4.987   0.429  -4.070
  234   HG22  VAL  33          2HG2      VAL  33   6.658   0.754  -4.539
  235   HG23  VAL  33          1HG2      VAL  33   6.317  -0.114  -3.042
  236    H    GLU  34           H        GLU  34   7.743  -4.036  -3.581
  237    HA   GLU  34           HA       GLU  34   8.260  -5.602  -5.959
  238    HB2  GLU  34           HB2      GLU  34   9.733  -6.100  -4.224
  239    HB3  GLU  34           HB3      GLU  34   8.470  -6.032  -3.009
  240    HG2  GLU  34           HG2      GLU  34   9.173  -8.302  -3.269
  241    HG3  GLU  34           HG3      GLU  34   7.546  -8.136  -3.920
  242    H    GLN  35           H        GLN  35   6.110  -6.015  -3.129
  243    HA   GLN  35           HA       GLN  35   4.082  -7.093  -4.930
  244    HB2  GLN  35           HB2      GLN  35   3.677  -8.997  -3.374
  245    HB3  GLN  35           HB3      GLN  35   5.227  -9.069  -4.203
  246    HG2  GLN  35           HG2      GLN  35   6.333  -8.220  -2.223
  247    HG3  GLN  35           HG3      GLN  35   4.789  -8.119  -1.382
  248   HE21  GLN  35          1HE2      GLN  35   7.267 -10.225  -2.580
  249   HE22  GLN  35          2HE2      GLN  35   6.730 -11.658  -1.767
  250    H    VAL  36           H        VAL  36   1.982  -6.882  -4.248
  251    HA   VAL  36           HA       VAL  36   1.523  -5.495  -1.694
  252    HB   VAL  36           HB       VAL  36   0.284  -4.676  -4.336
  253   HG11  VAL  36          2HG1      VAL  36  -0.733  -2.851  -3.032
  254   HG12  VAL  36          1HG1      VAL  36  -0.092  -3.570  -1.555
  255   HG13  VAL  36          3HG1      VAL  36  -1.290  -4.441  -2.512
  256   HG21  VAL  36          3HG2      VAL  36   1.468  -2.544  -3.972
  257   HG22  VAL  36          2HG2      VAL  36   2.568  -3.906  -4.193
  258   HG23  VAL  36          1HG2      VAL  36   2.279  -3.259  -2.577
  259    H    LYS  37           H        LYS  37   0.124  -6.657  -0.554
  260    HA   LYS  37           HA       LYS  37  -2.087  -7.929  -2.001
  261    HB2  LYS  37           HB2      LYS  37  -2.056  -9.744  -0.269
  262    HB3  LYS  37           HB3      LYS  37  -0.682  -9.738  -1.360
  263    HG2  LYS  37           HG2      LYS  37   0.592  -8.519   0.439
  264    HG3  LYS  37           HG3      LYS  37  -0.761  -8.872   1.514
  265    HD2  LYS  37           HD2      LYS  37  -0.466 -11.280   1.036
  266    HD3  LYS  37           HD3      LYS  37   0.940 -10.887   0.046
  267    HE2  LYS  37           HE2      LYS  37   1.765 -11.542   2.167
  268    HE3  LYS  37           HE3      LYS  37   1.929  -9.789   2.082
  269    HZ1  LYS  37           HZ1      LYS  37  -0.264  -9.704   3.305
  270    HZ2  LYS  37           HZ2      LYS  37   1.065 -10.260   4.195
  271    HZ3  LYS  37           HZ3      LYS  37  -0.075 -11.362   3.597
  272    H    VAL  38           H        VAL  38  -3.561  -6.413  -1.637
  273    HA   VAL  38           HA       VAL  38  -4.013  -5.335   1.006
  274    HB   VAL  38           HB       VAL  38  -4.304  -3.807  -0.826
  275   HG11  VAL  38          2HG1      VAL  38  -4.757  -5.412  -2.594
  276   HG12  VAL  38          1HG1      VAL  38  -5.980  -4.141  -2.578
  277   HG13  VAL  38          3HG1      VAL  38  -6.352  -5.731  -1.913
  278   HG21  VAL  38          3HG2      VAL  38  -6.994  -4.585   0.293
  279   HG22  VAL  38          2HG2      VAL  38  -6.614  -3.048  -0.486
  280   HG23  VAL  38          1HG2      VAL  38  -5.830  -3.485   1.033
  281    H    GLN  39           H        GLN  39  -5.681  -5.839   2.365
  282    HA   GLN  39           HA       GLN  39  -7.344  -8.114   1.543
  283    HB2  GLN  39           HB2      GLN  39  -6.375  -7.395   4.311
  284    HB3  GLN  39           HB3      GLN  39  -7.434  -8.746   3.929
  285    HG2  GLN  39           HG2      GLN  39  -5.668  -9.722   2.538
  286    HG3  GLN  39           HG3      GLN  39  -4.605  -8.383   2.969
  287   HE21  GLN  39          1HE2      GLN  39  -6.120 -11.301   4.038
  288   HE22  GLN  39          2HE2      GLN  39  -5.237 -11.469   5.512
  289    H    LEU  40           H        LEU  40  -9.367  -7.555   1.176
  290    HA   LEU  40           HA       LEU  40 -10.417  -5.028   1.969
  291    HB2  LEU  40           HB2      LEU  40 -10.916  -6.316  -0.154
  292    HB3  LEU  40           HB3      LEU  40 -11.931  -7.365   0.808
  293    HG   LEU  40           HG       LEU  40 -13.071  -5.517  -0.541
  294   HD11  LEU  40          2HD1      LEU  40 -13.615  -5.687   2.417
  295   HD12  LEU  40          1HD1      LEU  40 -14.244  -6.770   1.175
  296   HD13  LEU  40          3HD1      LEU  40 -14.731  -5.075   1.195
  297   HD21  LEU  40          3HD2      LEU  40 -11.550  -3.704  -0.003
  298   HD22  LEU  40          2HD2      LEU  40 -11.969  -3.832   1.704
  299   HD23  LEU  40          1HD2      LEU  40 -13.185  -3.320   0.534
  300    H    ALA  41           H        ALA  41 -10.727  -8.320   3.152
  301    HA   ALA  41           HA       ALA  41 -13.064  -7.946   4.698
  302    HB1  ALA  41           HB1      ALA  41 -12.494 -10.054   5.757
  303    HB2  ALA  41           HB2      ALA  41 -12.251 -10.153   4.012
  304    HB3  ALA  41           HB3      ALA  41 -10.865  -9.969   5.086
  305    H    GLU  42           H        GLU  42  -9.636  -7.568   5.440
  306    HA   GLU  42           HA       GLU  42 -10.262  -6.935   8.212
  307    HB2  GLU  42           HB2      GLU  42  -7.684  -7.359   6.722
  308    HB3  GLU  42           HB3      GLU  42  -7.714  -6.709   8.355
  309    HG2  GLU  42           HG2      GLU  42  -8.774  -8.702   9.180
  310    HG3  GLU  42           HG3      GLU  42  -8.920  -9.341   7.544
  311    H    GLY  43           H        GLY  43  -9.520  -5.324   5.243
  312    HA2  GLY  43           HA1      GLY  43  -9.450  -3.064   4.777
  313    HA3  GLY  43           HA2      GLY  43  -9.813  -2.747   6.470
  314    H    THR  44           H        THR  44  -7.160  -4.658   5.168
  315    HA   THR  44           HA       THR  44  -5.281  -2.557   5.967
  316    HB   THR  44           HB       THR  44  -3.754  -4.452   6.771
  317    HG1  THR  44           HG1      THR  44  -5.034  -6.282   7.584
  318   HG21  THR  44          3HG2      THR  44  -4.772  -2.854   8.305
  319   HG22  THR  44          1HG2      THR  44  -4.758  -4.469   9.015
  320   HG23  THR  44          2HG2      THR  44  -6.252  -3.813   8.344
  321    H    VAL  45           H        VAL  45  -3.389  -2.458   4.784
  322    HA   VAL  45           HA       VAL  45  -3.258  -4.217   2.419
  323    HB   VAL  45           HB       VAL  45  -2.236  -1.373   2.561
  324   HG11  VAL  45          2HG1      VAL  45  -1.117  -2.767   0.918
  325   HG12  VAL  45          1HG1      VAL  45  -2.143  -1.578   0.116
  326   HG13  VAL  45          3HG1      VAL  45  -2.672  -3.256   0.244
  327   HG21  VAL  45          3HG2      VAL  45  -4.181  -0.777   1.165
  328   HG22  VAL  45          2HG2      VAL  45  -4.643  -1.312   2.779
  329   HG23  VAL  45          1HG2      VAL  45  -4.827  -2.400   1.404
  330    H    GLU  46           H        GLU  46  -1.647  -5.621   2.739
  331    HA   GLU  46           HA       GLU  46   0.716  -4.719   4.217
  332    HB2  GLU  46           HB2      GLU  46  -0.531  -6.904   4.732
  333    HB3  GLU  46           HB3      GLU  46   0.201  -7.520   3.256
  334    HG2  GLU  46           HG2      GLU  46   2.389  -7.280   4.136
  335    HG3  GLU  46           HG3      GLU  46   1.796  -6.368   5.526
  336    H    VAL  47           H        VAL  47   2.376  -3.989   3.120
  337    HA   VAL  47           HA       VAL  47   2.685  -4.813   0.304
  338    HB   VAL  47           HB       VAL  47   3.343  -2.098   1.462
  339   HG11  VAL  47          2HG1      VAL  47   4.718  -2.709  -0.453
  340   HG12  VAL  47          1HG1      VAL  47   3.593  -1.417  -0.871
  341   HG13  VAL  47          3HG1      VAL  47   3.269  -3.070  -1.391
  342   HG21  VAL  47          3HG2      VAL  47   0.926  -2.470   1.454
  343   HG22  VAL  47          2HG2      VAL  47   0.994  -2.902  -0.254
  344   HG23  VAL  47          1HG2      VAL  47   1.395  -1.262   0.257
  345    H    THR  48           H        THR  48   4.710  -5.257  -0.424
  346    HA   THR  48           HA       THR  48   6.921  -5.060   1.516
  347    HB   THR  48           HB       THR  48   6.705  -6.887  -0.888
  348    HG1  THR  48           HG1      THR  48   5.557  -7.080   1.501
  349   HG21  THR  48          3HG2      THR  48   9.015  -6.398  -0.318
  350   HG22  THR  48          1HG2      THR  48   8.623  -8.051   0.159
  351   HG23  THR  48          2HG2      THR  48   8.705  -6.777   1.377
  352    H    ILE  49           H        ILE  49   8.055  -3.256   1.096
  353    HA   ILE  49           HA       ILE  49   8.494  -2.515  -1.734
  354    HB   ILE  49           HB       ILE  49   8.741  -0.197  -1.022
  355   HG12  ILE  49          2HG1      ILE  49   7.962  -1.053   1.768
  356   HG13  ILE  49          3HG1      ILE  49   9.639  -0.845   1.273
  357   HG21  ILE  49          2HG2      ILE  49   6.511  -0.930  -1.599
  358   HG22  ILE  49          1HG2      ILE  49   6.438   0.262  -0.299
  359   HG23  ILE  49          3HG2      ILE  49   6.227  -1.453   0.061
  360   HD11  ILE  49          3HD1      ILE  49   8.887   1.126   2.415
  361   HD12  ILE  49          2HD1      ILE  49   7.502   1.275   1.329
  362   HD13  ILE  49          1HD1      ILE  49   9.140   1.505   0.711
  363    H    ASP  50           H        ASP  50  10.544  -1.429  -2.188
  364    HA   ASP  50           HA       ASP  50  12.727  -2.311  -0.442
  365    HB2  ASP  50           HB2      ASP  50  12.789  -2.569  -3.007
  366    HB3  ASP  50           HB3      ASP  50  13.021  -0.825  -3.052
  367    H    SER  51           H        SER  51  13.209  -0.956   1.153
  368    HA   SER  51           HA       SER  51  12.220   1.728   1.142
  369    HB2  SER  51           HB2      SER  51  13.234   1.820   3.415
  370    HB3  SER  51           HB3      SER  51  12.161   0.445   3.182
  371    HG   SER  51           HG       SER  51  13.804  -0.899   3.314
  372    H    SER  52           H        SER  52  14.906   0.440  -0.259
  373    HA   SER  52           HA       SER  52  16.636   2.730   0.229
  374    HB2  SER  52           HB2      SER  52  17.538   0.391  -0.013
  375    HB3  SER  52           HB3      SER  52  17.046   0.439  -1.704
  376    HG   SER  52           HG       SER  52  18.467   2.160  -2.028
  377    H    VAL  53           H        VAL  53  14.063   1.946  -1.745
  378    HA   VAL  53           HA       VAL  53  14.918   3.861  -3.819
  379    HB   VAL  53           HB       VAL  53  12.974   1.566  -4.119
  380   HG11  VAL  53          2HG1      VAL  53  12.433   3.482  -5.534
  381   HG12  VAL  53          1HG1      VAL  53  13.007   2.116  -6.495
  382   HG13  VAL  53          3HG1      VAL  53  14.080   3.480  -6.172
  383   HG21  VAL  53          3HG2      VAL  53  14.674   0.498  -5.473
  384   HG22  VAL  53          2HG2      VAL  53  15.315   0.839  -3.864
  385   HG23  VAL  53          1HG2      VAL  53  15.764   1.865  -5.229
  386    H    VAL  54           H        VAL  54  11.850   2.421  -2.730
  387    HA   VAL  54           HA       VAL  54  10.656   5.096  -2.786
  388    HB   VAL  54           HB       VAL  54   9.529   3.302  -4.098
  389   HG11  VAL  54          2HG1      VAL  54   8.268   1.559  -2.905
  390   HG12  VAL  54          1HG1      VAL  54   9.039   2.058  -1.398
  391   HG13  VAL  54          3HG1      VAL  54  10.013   1.389  -2.708
  392   HG21  VAL  54          3HG2      VAL  54   7.261   3.753  -3.300
  393   HG22  VAL  54          2HG2      VAL  54   8.250   5.213  -3.295
  394   HG23  VAL  54          1HG2      VAL  54   7.916   4.368  -1.783
  395    H    THR  55           H        THR  55   9.584   5.919  -0.919
  396    HA   THR  55           HA       THR  55  10.416   4.510   1.527
  397    HB   THR  55           HB       THR  55  10.381   6.679   2.668
  398    HG1  THR  55           HG1      THR  55   9.474   7.564   0.129
  399   HG21  THR  55          3HG2      THR  55  12.461   5.887   1.657
  400   HG22  THR  55          1HG2      THR  55  12.354   7.646   1.582
  401   HG23  THR  55          2HG2      THR  55  12.035   6.680   0.141
  402    H    LEU  56           H        LEU  56   8.995   5.302   3.472
  403    HA   LEU  56           HA       LEU  56   6.472   4.081   3.037
  404    HB2  LEU  56           HB2      LEU  56   7.604   5.586   5.398
  405    HB3  LEU  56           HB3      LEU  56   6.020   4.841   5.415
  406    HG   LEU  56           HG       LEU  56   7.150   2.632   4.975
  407   HD11  LEU  56          2HD1      LEU  56   9.250   3.428   4.063
  408   HD12  LEU  56          1HD1      LEU  56   9.539   2.465   5.513
  409   HD13  LEU  56          3HD1      LEU  56   9.634   4.226   5.589
  410   HD21  LEU  56          3HD2      LEU  56   6.373   3.233   7.182
  411   HD22  LEU  56          2HD2      LEU  56   7.857   4.135   7.489
  412   HD23  LEU  56          1HD2      LEU  56   7.913   2.381   7.302
  413    H    LYS  57           H        LYS  57   7.546   7.420   3.360
  414    HA   LYS  57           HA       LYS  57   5.057   8.655   3.655
  415    HB2  LYS  57           HB2      LYS  57   7.559   9.593   3.602
  416    HB3  LYS  57           HB3      LYS  57   7.087  10.011   1.959
  417    HG2  LYS  57           HG2      LYS  57   5.588  10.808   4.443
  418    HG3  LYS  57           HG3      LYS  57   6.716  11.845   3.565
  419    HD2  LYS  57           HD2      LYS  57   5.263  11.636   1.563
  420    HD3  LYS  57           HD3      LYS  57   4.122  10.695   2.525
  421    HE2  LYS  57           HE2      LYS  57   3.343  12.957   2.425
  422    HE3  LYS  57           HE3      LYS  57   3.911  12.636   4.063
  423    HZ1  LYS  57           HZ1      LYS  57   5.543  13.987   1.985
  424    HZ2  LYS  57           HZ2      LYS  57   5.906  13.838   3.636
  425    HZ3  LYS  57           HZ3      LYS  57   4.614  14.812   3.134
  426    H    ASP  58           H        ASP  58   6.799   7.666   0.726
  427    HA   ASP  58           HA       ASP  58   5.037   8.777  -1.168
  428    HB2  ASP  58           HB2      ASP  58   6.673   6.243  -1.442
  429    HB3  ASP  58           HB3      ASP  58   6.003   7.194  -2.763
  430    H    ILE  59           H        ILE  59   5.085   5.673   0.462
  431    HA   ILE  59           HA       ILE  59   2.898   4.527  -0.919
  432    HB   ILE  59           HB       ILE  59   3.933   3.898   1.855
  433   HG12  ILE  59          2HG1      ILE  59   5.722   3.732   0.211
  434   HG13  ILE  59          3HG1      ILE  59   5.243   2.122   0.735
  435   HG21  ILE  59          2HG2      ILE  59   1.722   2.964   1.441
  436   HG22  ILE  59          1HG2      ILE  59   2.948   1.697   1.523
  437   HG23  ILE  59          3HG2      ILE  59   2.312   2.208  -0.040
  438   HD11  ILE  59          3HD1      ILE  59   3.921   1.876  -1.326
  439   HD12  ILE  59          2HD1      ILE  59   5.635   2.146  -1.642
  440   HD13  ILE  59          1HD1      ILE  59   4.483   3.463  -1.851
  441    H    VAL  60           H        VAL  60   3.141   6.202   2.220
  442    HA   VAL  60           HA       VAL  60   0.416   6.036   2.902
  443    HB   VAL  60           HB       VAL  60   2.469   8.117   3.687
  444   HG11  VAL  60          2HG1      VAL  60   0.209   8.986   3.991
  445   HG12  VAL  60          1HG1      VAL  60   0.977   8.660   5.543
  446   HG13  VAL  60          3HG1      VAL  60  -0.230   7.545   4.906
  447   HG21  VAL  60          3HG2      VAL  60   1.466   5.655   5.116
  448   HG22  VAL  60          2HG2      VAL  60   2.615   6.828   5.764
  449   HG23  VAL  60          1HG2      VAL  60   3.049   5.849   4.363
  450    H    ALA  61           H        ALA  61   2.242   8.568   1.213
  451    HA   ALA  61           HA       ALA  61   0.149  10.415   0.969
  452    HB1  ALA  61           HB1      ALA  61   2.522  10.963   0.622
  453    HB2  ALA  61           HB2      ALA  61   2.499  10.048  -0.884
  454    HB3  ALA  61           HB3      ALA  61   1.509  11.499  -0.718
  455    H    VAL  62           H        VAL  62   1.238   7.859  -1.260
  456    HA   VAL  62           HA       VAL  62  -0.549   8.565  -3.326
  457    HB   VAL  62           HB       VAL  62   1.442   7.185  -3.729
  458   HG11  VAL  62          2HG1      VAL  62   1.360   4.769  -3.268
  459   HG12  VAL  62          1HG1      VAL  62  -0.076   5.050  -2.282
  460   HG13  VAL  62          3HG1      VAL  62   1.467   5.779  -1.825
  461   HG21  VAL  62          3HG2      VAL  62  -1.143   5.874  -4.555
  462   HG22  VAL  62          2HG2      VAL  62   0.425   5.625  -5.324
  463   HG23  VAL  62          1HG2      VAL  62  -0.344   7.212  -5.381
  464    H    ILE  63           H        ILE  63  -0.809   6.227  -0.682
  465    HA   ILE  63           HA       ILE  63  -3.239   5.070  -1.491
  466    HB   ILE  63           HB       ILE  63  -2.035   5.351   1.260
  467   HG12  ILE  63          2HG1      ILE  63  -2.230   3.045  -0.688
  468   HG13  ILE  63          3HG1      ILE  63  -0.774   3.955  -0.298
  469   HG21  ILE  63          2HG2      ILE  63  -4.441   3.740   0.430
  470   HG22  ILE  63          1HG2      ILE  63  -4.442   5.145   1.497
  471   HG23  ILE  63          3HG2      ILE  63  -3.641   3.656   1.999
  472   HD11  ILE  63          3HD1      ILE  63  -0.891   3.126   2.003
  473   HD12  ILE  63          2HD1      ILE  63  -0.783   1.815   0.827
  474   HD13  ILE  63          1HD1      ILE  63  -2.329   2.195   1.585
  475    H    GLU  64           H        GLU  64  -2.641   7.774   0.762
  476    HA   GLU  64           HA       GLU  64  -5.433   8.145   1.239
  477    HB2  GLU  64           HB2      GLU  64  -3.156  10.043   1.826
  478    HB3  GLU  64           HB3      GLU  64  -4.799  10.171   2.447
  479    HG2  GLU  64           HG2      GLU  64  -4.376   7.803   3.394
  480    HG3  GLU  64           HG3      GLU  64  -2.674   8.185   3.132
  481    H    ASP  65           H        ASP  65  -3.166   9.369  -1.091
  482    HA   ASP  65           HA       ASP  65  -4.677  11.553  -2.046
  483    HB2  ASP  65           HB2      ASP  65  -2.374  11.294  -2.749
  484    HB3  ASP  65           HB3      ASP  65  -2.735   9.739  -3.494
  485    H    GLN  66           H        GLN  66  -4.853   8.112  -2.611
  486    HA   GLN  66           HA       GLN  66  -6.693   8.226  -4.778
  487    HB2  GLN  66           HB2      GLN  66  -6.196   5.982  -2.809
  488    HB3  GLN  66           HB3      GLN  66  -7.051   5.839  -4.339
  489    HG2  GLN  66           HG2      GLN  66  -4.155   6.597  -4.025
  490    HG3  GLN  66           HG3      GLN  66  -4.756   4.997  -4.458
  491   HE21  GLN  66          1HE2      GLN  66  -6.887   6.035  -6.146
  492   HE22  GLN  66          2HE2      GLN  66  -6.119   6.605  -7.591
  493    H    GLY  67           H        GLY  67  -7.010   8.871  -1.483
  494    HA2  GLY  67           HA1      GLY  67  -9.073   9.975  -0.837
  495    HA3  GLY  67           HA2      GLY  67  -9.942   8.770  -1.773
  496    H    TYR  68           H        TYR  68  -7.382   7.390  -0.040
  497    HA   TYR  68           HA       TYR  68  -9.325   6.231   1.811
  498    HB2  TYR  68           HB2      TYR  68  -6.483   5.356   1.265
  499    HB3  TYR  68           HB3      TYR  68  -7.690   4.487   2.206
  500    HD1  TYR  68           HD2      TYR  68  -9.904   3.877   0.937
  501    HD2  TYR  68           HD1      TYR  68  -6.227   4.815  -0.984
  502    HE1  TYR  68           HE2      TYR  68 -10.673   2.715  -1.087
  503    HE2  TYR  68           HE1      TYR  68  -6.987   3.660  -3.015
  504    HH   TYR  68           HH       TYR  68 -10.192   2.766  -3.536
  505    H    ASP  69           H        ASP  69  -8.850   5.956   4.038
  506    HA   ASP  69           HA       ASP  69  -6.965   7.958   5.087
  507    HB2  ASP  69           HB2      ASP  69  -9.491   6.816   6.285
  508    HB3  ASP  69           HB3      ASP  69  -8.325   7.746   7.221
  509    H    VAL  70           H        VAL  70  -5.120   7.091   5.707
  510    HA   VAL  70           HA       VAL  70  -5.192   4.480   7.061
  511    HB   VAL  70           HB       VAL  70  -2.894   4.046   6.102
  512   HG11  VAL  70          2HG1      VAL  70  -5.177   4.268   4.147
  513   HG12  VAL  70          1HG1      VAL  70  -4.892   2.924   5.258
  514   HG13  VAL  70          3HG1      VAL  70  -3.747   3.251   3.955
  515   HG21  VAL  70          3HG2      VAL  70  -3.671   6.167   4.110
  516   HG22  VAL  70          2HG2      VAL  70  -2.172   5.235   4.161
  517   HG23  VAL  70          1HG2      VAL  70  -2.510   6.428   5.417
  518    H    GLN  71           H        GLN  71  -3.199   4.102   8.401
  519    HA   GLN  71           HA       GLN  71  -2.443   6.625   9.726
  520    HB2  GLN  71           HB2      GLN  71  -2.981   3.911  10.936
  521    HB3  GLN  71           HB3      GLN  71  -2.270   5.255  11.821
  522    HG2  GLN  71           HG2      GLN  71  -4.997   5.222  10.547
  523    HG3  GLN  71           HG3      GLN  71  -4.648   5.053  12.267
  524   HE21  GLN  71          1HE2      GLN  71  -6.247   7.054  10.870
  525   HE22  GLN  71          2HE2      GLN  71  -5.557   8.587  11.290
  Start of MODEL   15
    1    H1   SER   1           H1       SER   1  16.494  -7.511  -2.278
    2    H2   SER   1           H2       SER   1  17.198  -6.614  -3.535
    3    H3   SER   1           H3       SER   1  15.783  -7.500  -3.819
    4    HA   SER   1           HA       SER   1  15.317  -5.144  -3.614
    5    HB2  SER   1           HB2      SER   1  14.282  -6.789  -1.291
    6    HB3  SER   1           HB3      SER   1  13.512  -5.358  -1.974
    7    HG   SER   1           HG       SER   1  13.426  -6.577  -3.999
    8    H    ASN   2           H        ASN   2  17.979  -5.529  -2.339
    9    HA   ASN   2           HA       ASN   2  19.379  -4.510  -0.881
   10    HB2  ASN   2           HB2      ASN   2  17.282  -2.346  -1.127
   11    HB3  ASN   2           HB3      ASN   2  18.847  -2.117  -0.354
   12   HD21  ASN   2          1HD2      ASN   2  17.127  -2.385  -3.327
   13   HD22  ASN   2          2HD2      ASN   2  18.477  -2.061  -4.369
   14    H    ALA   3           H        ALA   3  16.762  -2.787   0.600
   15    HA   ALA   3           HA       ALA   3  16.766  -4.591   2.907
   16    HB1  ALA   3           HB1      ALA   3  18.265  -2.741   3.464
   17    HB2  ALA   3           HB2      ALA   3  16.999  -1.582   3.055
   18    HB3  ALA   3           HB3      ALA   3  16.792  -2.666   4.432
   19    H    MET   4           H        MET   4  14.747  -5.333   2.923
   20    HA   MET   4           HA       MET   4  12.637  -3.594   1.873
   21    HB2  MET   4           HB2      MET   4  11.284  -5.629   1.670
   22    HB3  MET   4           HB3      MET   4  12.803  -5.762   0.799
   23    HG2  MET   4           HG2      MET   4  13.712  -7.223   2.418
   24    HG3  MET   4           HG3      MET   4  12.404  -6.893   3.553
   25    HE1  MET   4           HE1      MET   4  11.539  -8.987  -0.461
   26    HE2  MET   4           HE2      MET   4  11.653  -7.241  -0.236
   27    HE3  MET   4           HE3      MET   4  13.097  -8.246  -0.101
   28    H    GLU   5           H        GLU   5  10.847  -3.053   2.971
   29    HA   GLU   5           HA       GLU   5  10.601  -4.027   5.736
   30    HB2  GLU   5           HB2      GLU   5   9.781  -1.375   4.543
   31    HB3  GLU   5           HB3      GLU   5   9.292  -1.913   6.143
   32    HG2  GLU   5           HG2      GLU   5  11.652  -2.042   6.801
   33    HG3  GLU   5           HG3      GLU   5  12.113  -1.451   5.205
   34    H    GLN   6           H        GLN   6   8.877  -5.232   6.145
   35    HA   GLN   6           HA       GLN   6   6.733  -5.288   4.131
   36    HB2  GLN   6           HB2      GLN   6   7.486  -7.351   6.210
   37    HB3  GLN   6           HB3      GLN   6   6.207  -7.520   5.015
   38    HG2  GLN   6           HG2      GLN   6   7.849  -7.439   3.224
   39    HG3  GLN   6           HG3      GLN   6   9.137  -7.221   4.407
   40   HE21  GLN   6          1HE2      GLN   6  10.200  -9.074   3.774
   41   HE22  GLN   6          2HE2      GLN   6   9.612 -10.658   4.154
   42    H    LEU   7           H        LEU   7   5.253  -3.837   4.765
   43    HA   LEU   7           HA       LEU   7   4.386  -3.917   7.580
   44    HB2  LEU   7           HB2      LEU   7   4.543  -1.530   5.739
   45    HB3  LEU   7           HB3      LEU   7   3.856  -1.510   7.352
   46    HG   LEU   7           HG       LEU   7   6.743  -2.139   6.726
   47   HD11  LEU   7          2HD1      LEU   7   5.488   0.379   7.810
   48   HD12  LEU   7          1HD1      LEU   7   6.208   0.181   6.214
   49   HD13  LEU   7          3HD1      LEU   7   7.217   0.069   7.656
   50   HD21  LEU   7          3HD2      LEU   7   5.917  -3.206   8.766
   51   HD22  LEU   7          2HD2      LEU   7   5.330  -1.649   9.347
   52   HD23  LEU   7          1HD2      LEU   7   7.060  -1.916   9.138
   53    H    THR   8           H        THR   8   2.229  -3.914   7.991
   54    HA   THR   8           HA       THR   8   0.455  -4.053   5.655
   55    HB   THR   8           HB       THR   8  -0.098  -5.005   8.477
   56    HG1  THR   8           HG1      THR   8   1.575  -6.085   6.919
   57   HG21  THR   8          3HG2      THR   8  -1.948  -6.239   7.401
   58   HG22  THR   8          1HG2      THR   8  -1.552  -5.464   5.867
   59   HG23  THR   8          2HG2      THR   8  -2.122  -4.494   7.225
   60    H    LEU   9           H        LEU   9  -0.329  -2.103   5.234
   61    HA   LEU   9           HA       LEU   9  -0.599  -0.079   7.266
   62    HB2  LEU   9           HB2      LEU   9  -1.251  -0.153   4.324
   63    HB3  LEU   9           HB3      LEU   9  -1.603   1.237   5.328
   64    HG   LEU   9           HG       LEU   9   0.839   1.426   5.824
   65   HD11  LEU   9          2HD1      LEU   9   1.477  -0.900   5.358
   66   HD12  LEU   9          1HD1      LEU   9   2.432   0.252   4.424
   67   HD13  LEU   9          3HD1      LEU   9   1.123  -0.641   3.649
   68   HD21  LEU   9          3HD2      LEU   9   1.417   2.333   3.612
   69   HD22  LEU   9          2HD2      LEU   9  -0.201   2.807   4.132
   70   HD23  LEU   9          1HD2      LEU   9   0.002   1.527   2.933
   71    H    GLN  10           H        GLN  10  -2.457   0.683   8.205
   72    HA   GLN  10           HA       GLN  10  -4.873  -0.893   7.875
   73    HB2  GLN  10           HB2      GLN  10  -4.410   1.576   9.556
   74    HB3  GLN  10           HB3      GLN  10  -5.785   0.485   9.669
   75    HG2  GLN  10           HG2      GLN  10  -4.313  -1.292  10.421
   76    HG3  GLN  10           HG3      GLN  10  -2.925  -0.219  10.254
   77   HE21  GLN  10          1HE2      GLN  10  -2.634   1.455  11.726
   78   HE22  GLN  10          2HE2      GLN  10  -3.466   1.496  13.243
   79    H    VAL  11           H        VAL  11  -6.573  -0.336   6.616
   80    HA   VAL  11           HA       VAL  11  -6.409   2.283   5.269
   81    HB   VAL  11           HB       VAL  11  -7.443  -0.293   4.082
   82   HG11  VAL  11          2HG1      VAL  11  -6.891   2.400   2.848
   83   HG12  VAL  11          1HG1      VAL  11  -8.476   1.679   3.125
   84   HG13  VAL  11          3HG1      VAL  11  -7.365   0.949   1.965
   85   HG21  VAL  11          3HG2      VAL  11  -5.387  -0.272   2.725
   86   HG22  VAL  11          2HG2      VAL  11  -5.058  -0.473   4.446
   87   HG23  VAL  11          1HG2      VAL  11  -4.796   1.093   3.675
   88    H    GLU  12           H        GLU  12  -8.012   3.541   5.955
   89    HA   GLU  12           HA       GLU  12 -10.692   2.347   6.219
   90    HB2  GLU  12           HB2      GLU  12  -9.505   4.842   7.431
   91    HB3  GLU  12           HB3      GLU  12 -11.227   4.486   7.467
   92    HG2  GLU  12           HG2      GLU  12 -10.748   2.403   8.681
   93    HG3  GLU  12           HG3      GLU  12  -9.035   2.827   8.692
   94    H    GLY  13           H        GLY  13 -12.298   3.014   4.900
   95    HA2  GLY  13           HA1      GLY  13 -13.297   4.946   3.703
   96    HA3  GLY  13           HA2      GLY  13 -11.685   5.262   3.078
   97    H    MET  14           H        MET  14 -12.656   1.973   3.368
   98    HA   MET  14           HA       MET  14 -12.452   1.608   0.518
   99    HB2  MET  14           HB2      MET  14 -13.102  -0.301   2.770
  100    HB3  MET  14           HB3      MET  14 -13.003  -0.790   1.085
  101    HG2  MET  14           HG2      MET  14 -10.673  -0.106   1.008
  102    HG3  MET  14           HG3      MET  14 -10.766   0.424   2.687
  103    HE1  MET  14           HE1      MET  14  -8.565  -1.107   3.076
  104    HE2  MET  14           HE2      MET  14  -8.525  -2.841   2.756
  105    HE3  MET  14           HE3      MET  14  -8.622  -1.700   1.416
  106    H    SER  15           H        SER  15 -14.120   0.557  -0.776
  107    HA   SER  15           HA       SER  15 -16.830   1.184   0.182
  108    HB2  SER  15           HB2      SER  15 -16.048   2.858  -1.482
  109    HB3  SER  15           HB3      SER  15 -15.818   1.558  -2.650
  110    HG   SER  15           HG       SER  15 -18.303   2.070  -1.377
  111    H    CYS  16           H        CYS  16 -15.522  -0.380  -2.753
  112    HA   CYS  16           HA       CYS  16 -16.706  -2.908  -1.875
  113    HB2  CYS  16           HB2      CYS  16 -17.712  -3.249  -4.120
  114    HB3  CYS  16           HB3      CYS  16 -18.432  -1.899  -3.252
  115    HG   CYS  16           HG       CYS  16 -17.753   0.009  -4.900
  116    H    GLY  17           H        GLY  17 -16.222  -4.296  -4.310
  117    HA2  GLY  17           HA1      GLY  17 -13.560  -5.063  -3.885
  118    HA3  GLY  17           HA2      GLY  17 -14.535  -5.507  -5.276
  119    H    HIS  18           H        HIS  18 -14.868  -2.667  -6.081
  120    HA   HIS  18           HA       HIS  18 -12.698  -2.550  -7.864
  121    HB2  HIS  18           HB2      HIS  18 -14.838  -0.576  -7.133
  122    HB3  HIS  18           HB3      HIS  18 -13.562  -0.153  -8.271
  123    HD1  HIS  18           HD1      HIS  18 -16.755  -0.627  -8.787
  124    HD2  HIS  18           HD2      HIS  18 -13.570  -3.068  -9.891
  125    HE1  HIS  18           HE1      HIS  18 -17.589  -2.009 -10.720
  126    HE2  HIS  18           HE2      HIS  18 -15.675  -3.539 -11.320
  127    H    CYS  19           H        CYS  19 -13.263  -0.818  -4.811
  128    HA   CYS  19           HA       CYS  19 -11.031   0.899  -5.110
  129    HB2  CYS  19           HB2      CYS  19 -11.312   1.464  -2.788
  130    HB3  CYS  19           HB3      CYS  19 -12.902   1.320  -3.519
  131    HG   CYS  19           HG       CYS  19 -12.964  -1.480  -2.484
  132    H    VAL  20           H        VAL  20 -11.344  -2.394  -4.209
  133    HA   VAL  20           HA       VAL  20  -8.968  -2.726  -2.710
  134    HB   VAL  20           HB       VAL  20 -10.415  -4.760  -4.418
  135   HG11  VAL  20          2HG1      VAL  20  -8.152  -5.466  -3.840
  136   HG12  VAL  20          1HG1      VAL  20  -9.357  -6.430  -2.988
  137   HG13  VAL  20          3HG1      VAL  20  -8.483  -5.157  -2.137
  138   HG21  VAL  20          3HG2      VAL  20 -11.893  -3.761  -2.764
  139   HG22  VAL  20          2HG2      VAL  20 -10.721  -4.106  -1.491
  140   HG23  VAL  20          1HG2      VAL  20 -11.519  -5.432  -2.338
  141    H    ASN  21           H        ASN  21  -9.669  -3.449  -6.145
  142    HA   ASN  21           HA       ASN  21  -6.934  -4.015  -6.724
  143    HB2  ASN  21           HB2      ASN  21  -7.619  -4.083  -9.083
  144    HB3  ASN  21           HB3      ASN  21  -8.718  -5.014  -8.074
  145   HD21  ASN  21          1HD2      ASN  21  -8.313  -2.137  -9.992
  146   HD22  ASN  21          2HD2      ASN  21  -9.998  -1.727 -10.092
  147    H    ALA  22           H        ALA  22  -8.903  -1.153  -6.778
  148    HA   ALA  22           HA       ALA  22  -7.301   0.505  -8.374
  149    HB1  ALA  22           HB1      ALA  22  -8.992   1.289  -6.005
  150    HB2  ALA  22           HB2      ALA  22  -8.420   2.361  -7.284
  151    HB3  ALA  22           HB3      ALA  22  -9.578   1.083  -7.655
  152    H    ILE  23           H        ILE  23  -7.341   0.124  -4.821
  153    HA   ILE  23           HA       ILE  23  -5.071   1.795  -4.445
  154    HB   ILE  23           HB       ILE  23  -6.675   1.463  -2.635
  155   HG12  ILE  23          2HG1      ILE  23  -3.924   0.406  -1.951
  156   HG13  ILE  23          3HG1      ILE  23  -4.370   2.105  -2.082
  157   HG21  ILE  23          2HG2      ILE  23  -6.751  -0.628  -1.365
  158   HG22  ILE  23          1HG2      ILE  23  -5.664  -1.374  -2.538
  159   HG23  ILE  23          3HG2      ILE  23  -7.274  -0.854  -3.035
  160   HD11  ILE  23          3HD1      ILE  23  -4.246   1.349   0.239
  161   HD12  ILE  23          2HD1      ILE  23  -5.507   0.160  -0.088
  162   HD13  ILE  23          1HD1      ILE  23  -5.870   1.882  -0.197
  163    H    GLU  24           H        GLU  24  -5.533  -1.647  -4.922
  164    HA   GLU  24           HA       GLU  24  -3.050  -2.643  -4.223
  165    HB2  GLU  24           HB2      GLU  24  -4.893  -4.086  -4.860
  166    HB3  GLU  24           HB3      GLU  24  -4.859  -3.461  -6.505
  167    HG2  GLU  24           HG2      GLU  24  -2.612  -4.418  -6.792
  168    HG3  GLU  24           HG3      GLU  24  -2.710  -5.085  -5.163
  169    H    SER  25           H        SER  25  -4.054  -1.409  -7.436
  170    HA   SER  25           HA       SER  25  -1.404  -1.583  -8.453
  171    HB2  SER  25           HB2      SER  25  -2.338  -0.058 -10.276
  172    HB3  SER  25           HB3      SER  25  -3.045  -1.674 -10.120
  173    HG   SER  25           HG       SER  25  -4.148   0.833  -9.553
  174    H    SER  26           H        SER  26  -3.251   0.954  -6.877
  175    HA   SER  26           HA       SER  26  -1.663   3.144  -7.523
  176    HB2  SER  26           HB2      SER  26  -3.109   2.548  -4.928
  177    HB3  SER  26           HB3      SER  26  -2.442   4.123  -5.363
  178    HG   SER  26           HG       SER  26  -4.448   2.687  -6.793
  179    H    VAL  27           H        VAL  27  -1.174   0.620  -5.119
  180    HA   VAL  27           HA       VAL  27   1.331   1.765  -4.225
  181    HB   VAL  27           HB       VAL  27   0.265  -1.018  -3.708
  182   HG11  VAL  27          2HG1      VAL  27   2.638  -0.776  -3.254
  183   HG12  VAL  27          1HG1      VAL  27   1.734  -0.937  -1.747
  184   HG13  VAL  27          3HG1      VAL  27   2.319   0.647  -2.261
  185   HG21  VAL  27          3HG2      VAL  27  -0.582  -0.137  -1.584
  186   HG22  VAL  27          2HG2      VAL  27  -1.359   0.635  -2.968
  187   HG23  VAL  27          1HG2      VAL  27  -0.101   1.490  -2.071
  188    H    LYS  28           H        LYS  28   0.281  -0.897  -6.325
  189    HA   LYS  28           HA       LYS  28   2.840  -2.037  -6.678
  190    HB2  LYS  28           HB2      LYS  28   0.885  -3.347  -7.133
  191    HB3  LYS  28           HB3      LYS  28   0.326  -2.203  -8.342
  192    HG2  LYS  28           HG2      LYS  28   1.146  -3.983  -9.581
  193    HG3  LYS  28           HG3      LYS  28   2.447  -2.800  -9.632
  194    HD2  LYS  28           HD2      LYS  28   2.363  -5.103  -7.683
  195    HD3  LYS  28           HD3      LYS  28   3.155  -5.187  -9.253
  196    HE2  LYS  28           HE2      LYS  28   4.525  -3.199  -8.539
  197    HE3  LYS  28           HE3      LYS  28   3.855  -3.418  -6.924
  198    HZ1  LYS  28           HZ1      LYS  28   4.763  -5.700  -6.955
  199    HZ2  LYS  28           HZ2      LYS  28   5.961  -4.506  -7.053
  200    HZ3  LYS  28           HZ3      LYS  28   5.508  -5.364  -8.441
  201    H    GLU  29           H        GLU  29   1.093   0.406  -8.565
  202    HA   GLU  29           HA       GLU  29   2.874   0.510 -10.749
  203    HB2  GLU  29           HB2      GLU  29   1.019   2.583  -9.581
  204    HB3  GLU  29           HB3      GLU  29   1.926   2.833 -11.068
  205    HG2  GLU  29           HG2      GLU  29   0.803   0.842 -12.024
  206    HG3  GLU  29           HG3      GLU  29  -0.161   0.724 -10.554
  207    H    LEU  30           H        LEU  30   3.013   1.755  -7.566
  208    HA   LEU  30           HA       LEU  30   4.975   3.761  -7.911
  209    HB2  LEU  30           HB2      LEU  30   3.789   2.285  -5.664
  210    HB3  LEU  30           HB3      LEU  30   5.432   2.820  -5.373
  211    HG   LEU  30           HG       LEU  30   3.608   4.371  -4.573
  212   HD11  LEU  30          2HD1      LEU  30   5.898   5.120  -4.873
  213   HD12  LEU  30          1HD1      LEU  30   4.756   6.387  -5.318
  214   HD13  LEU  30          3HD1      LEU  30   5.575   5.459  -6.574
  215   HD21  LEU  30          3HD2      LEU  30   2.583   5.840  -6.255
  216   HD22  LEU  30          2HD2      LEU  30   2.073   4.160  -6.440
  217   HD23  LEU  30          1HD2      LEU  30   3.279   4.843  -7.531
  218    H    ASN  31           H        ASN  31   7.115   3.679  -8.197
  219    HA   ASN  31           HA       ASN  31   8.391   1.184  -8.752
  220    HB2  ASN  31           HB2      ASN  31   9.017   3.216  -9.968
  221    HB3  ASN  31           HB3      ASN  31   9.561   3.963  -8.469
  222   HD21  ASN  31          1HD2      ASN  31  11.646   4.256  -9.208
  223   HD22  ASN  31          2HD2      ASN  31  12.758   2.945  -9.414
  224    H    GLY  32           H        GLY  32   9.633  -0.065  -7.485
  225    HA2  GLY  32           HA1      GLY  32  11.200  -0.389  -5.708
  226    HA3  GLY  32           HA2      GLY  32  10.499   0.999  -4.886
  227    H    VAL  33           H        VAL  33   7.945  -0.642  -6.087
  228    HA   VAL  33           HA       VAL  33   7.454  -1.880  -3.498
  229    HB   VAL  33           HB       VAL  33   5.577  -1.234  -5.777
  230   HG11  VAL  33          2HG1      VAL  33   4.997  -2.455  -3.081
  231   HG12  VAL  33          1HG1      VAL  33   4.832  -3.247  -4.649
  232   HG13  VAL  33          3HG1      VAL  33   3.783  -1.892  -4.232
  233   HG21  VAL  33          3HG2      VAL  33   4.652   0.387  -4.203
  234   HG22  VAL  33          2HG2      VAL  33   6.355   0.707  -4.535
  235   HG23  VAL  33          1HG2      VAL  33   5.882  -0.062  -3.019
  236    H    GLU  34           H        GLU  34   7.545  -3.960  -3.220
  237    HA   GLU  34           HA       GLU  34   7.988  -5.680  -5.527
  238    HB2  GLU  34           HB2      GLU  34   9.557  -5.859  -3.686
  239    HB3  GLU  34           HB3      GLU  34   8.246  -6.167  -2.559
  240    HG2  GLU  34           HG2      GLU  34   9.357  -8.226  -3.042
  241    HG3  GLU  34           HG3      GLU  34   7.751  -8.263  -3.765
  242    H    GLN  35           H        GLN  35   6.049  -5.913  -2.519
  243    HA   GLN  35           HA       GLN  35   4.038  -7.386  -4.096
  244    HB2  GLN  35           HB2      GLN  35   4.807  -7.870  -1.216
  245    HB3  GLN  35           HB3      GLN  35   3.531  -8.708  -2.088
  246    HG2  GLN  35           HG2      GLN  35   5.248  -9.563  -3.661
  247    HG3  GLN  35           HG3      GLN  35   6.485  -8.830  -2.638
  248   HE21  GLN  35          1HE2      GLN  35   6.066 -11.624  -3.297
  249   HE22  GLN  35          2HE2      GLN  35   5.825 -12.453  -1.792
  250    H    VAL  36           H        VAL  36   1.932  -6.907  -3.795
  251    HA   VAL  36           HA       VAL  36   1.197  -5.026  -1.644
  252    HB   VAL  36           HB       VAL  36   0.041  -4.906  -4.437
  253   HG11  VAL  36          2HG1      VAL  36  -1.449  -4.136  -2.677
  254   HG12  VAL  36          1HG1      VAL  36  -0.914  -2.788  -3.681
  255   HG13  VAL  36          3HG1      VAL  36  -0.202  -3.037  -2.086
  256   HG21  VAL  36          3HG2      VAL  36   2.104  -3.087  -3.207
  257   HG22  VAL  36          2HG2      VAL  36   1.298  -2.835  -4.755
  258   HG23  VAL  36          1HG2      VAL  36   2.370  -4.217  -4.534
  259    H    LYS  37           H        LYS  37   0.056  -6.448  -0.377
  260    HA   LYS  37           HA       LYS  37  -2.067  -7.992  -1.719
  261    HB2  LYS  37           HB2      LYS  37  -0.389  -9.304  -0.382
  262    HB3  LYS  37           HB3      LYS  37  -0.953  -8.457   1.053
  263    HG2  LYS  37           HG2      LYS  37  -3.195  -9.377   0.715
  264    HG3  LYS  37           HG3      LYS  37  -2.615 -10.251  -0.703
  265    HD2  LYS  37           HD2      LYS  37  -2.710 -11.706   1.261
  266    HD3  LYS  37           HD3      LYS  37  -1.049 -11.497   0.700
  267    HE2  LYS  37           HE2      LYS  37  -0.615  -9.891   2.442
  268    HE3  LYS  37           HE3      LYS  37  -2.304  -9.925   2.943
  269    HZ1  LYS  37           HZ1      LYS  37  -0.465 -12.254   3.068
  270    HZ2  LYS  37           HZ2      LYS  37  -2.054 -12.187   3.653
  271    HZ3  LYS  37           HZ3      LYS  37  -0.842 -11.255   4.379
  272    H    VAL  38           H        VAL  38  -3.694  -6.505  -1.800
  273    HA   VAL  38           HA       VAL  38  -4.405  -4.917   0.494
  274    HB   VAL  38           HB       VAL  38  -5.988  -5.421  -2.031
  275   HG11  VAL  38          2HG1      VAL  38  -7.177  -3.362  -1.426
  276   HG12  VAL  38          1HG1      VAL  38  -6.260  -3.277   0.077
  277   HG13  VAL  38          3HG1      VAL  38  -7.379  -4.614  -0.198
  278   HG21  VAL  38          3HG2      VAL  38  -5.111  -3.244  -2.753
  279   HG22  VAL  38          2HG2      VAL  38  -3.830  -4.437  -2.528
  280   HG23  VAL  38          1HG2      VAL  38  -4.097  -3.189  -1.310
  281    H    GLN  39           H        GLN  39  -5.482  -5.634   2.172
  282    HA   GLN  39           HA       GLN  39  -6.928  -8.161   1.909
  283    HB2  GLN  39           HB2      GLN  39  -5.990  -6.761   4.419
  284    HB3  GLN  39           HB3      GLN  39  -6.666  -8.380   4.322
  285    HG2  GLN  39           HG2      GLN  39  -4.773  -9.151   3.092
  286    HG3  GLN  39           HG3      GLN  39  -4.126  -7.521   2.969
  287   HE21  GLN  39          1HE2      GLN  39  -2.219  -8.021   3.938
  288   HE22  GLN  39          2HE2      GLN  39  -2.063  -8.412   5.616
  289    H    LEU  40           H        LEU  40  -8.899  -7.579   1.202
  290    HA   LEU  40           HA       LEU  40 -10.337  -5.303   2.118
  291    HB2  LEU  40           HB2      LEU  40 -10.603  -6.492  -0.100
  292    HB3  LEU  40           HB3      LEU  40 -11.436  -7.768   0.758
  293    HG   LEU  40           HG       LEU  40 -12.855  -6.026  -0.476
  294   HD11  LEU  40          2HD1      LEU  40 -13.808  -7.621   1.099
  295   HD12  LEU  40          1HD1      LEU  40 -14.595  -6.048   1.231
  296   HD13  LEU  40          3HD1      LEU  40 -13.408  -6.545   2.440
  297   HD21  LEU  40          3HD2      LEU  40 -11.652  -4.055   0.281
  298   HD22  LEU  40          2HD2      LEU  40 -12.096  -4.409   1.950
  299   HD23  LEU  40          1HD2      LEU  40 -13.343  -3.986   0.775
  300    H    ALA  41           H        ALA  41 -10.140  -8.654   3.066
  301    HA   ALA  41           HA       ALA  41 -12.471  -8.733   4.681
  302    HB1  ALA  41           HB1      ALA  41 -11.364 -10.747   3.829
  303    HB2  ALA  41           HB2      ALA  41  -9.981 -10.425   4.876
  304    HB3  ALA  41           HB3      ALA  41 -11.555 -10.797   5.582
  305    H    GLU  42           H        GLU  42  -9.471  -7.203   5.172
  306    HA   GLU  42           HA       GLU  42  -9.985  -7.072   8.072
  307    HB2  GLU  42           HB2      GLU  42  -7.835  -8.215   7.287
  308    HB3  GLU  42           HB3      GLU  42  -7.296  -6.621   6.790
  309    HG2  GLU  42           HG2      GLU  42  -6.399  -7.156   8.955
  310    HG3  GLU  42           HG3      GLU  42  -7.554  -5.831   9.094
  311    H    GLY  43           H        GLY  43  -9.358  -5.287   5.148
  312    HA2  GLY  43           HA1      GLY  43  -9.606  -2.995   4.782
  313    HA3  GLY  43           HA2      GLY  43  -9.830  -2.766   6.516
  314    H    THR  44           H        THR  44  -7.208  -4.431   4.863
  315    HA   THR  44           HA       THR  44  -5.337  -2.337   5.705
  316    HB   THR  44           HB       THR  44  -3.766  -4.071   6.544
  317    HG1  THR  44           HG1      THR  44  -5.035  -6.139   7.085
  318   HG21  THR  44          3HG2      THR  44  -4.815  -4.454   8.671
  319   HG22  THR  44          1HG2      THR  44  -6.419  -4.230   7.973
  320   HG23  THR  44          2HG2      THR  44  -5.311  -2.862   8.097
  321    H    VAL  45           H        VAL  45  -3.165  -2.657   4.668
  322    HA   VAL  45           HA       VAL  45  -3.265  -4.360   2.275
  323    HB   VAL  45           HB       VAL  45  -2.228  -1.511   2.280
  324   HG11  VAL  45          2HG1      VAL  45  -1.810  -1.873  -0.101
  325   HG12  VAL  45          1HG1      VAL  45  -2.323  -3.553   0.058
  326   HG13  VAL  45          3HG1      VAL  45  -0.872  -2.991   0.888
  327   HG21  VAL  45          3HG2      VAL  45  -4.011  -1.147   0.594
  328   HG22  VAL  45          2HG2      VAL  45  -4.640  -1.540   2.193
  329   HG23  VAL  45          1HG2      VAL  45  -4.615  -2.768   0.929
  330    H    GLU  46           H        GLU  46  -1.688  -5.767   2.408
  331    HA   GLU  46           HA       GLU  46   0.656  -5.258   4.050
  332    HB2  GLU  46           HB2      GLU  46  -0.455  -7.452   4.137
  333    HB3  GLU  46           HB3      GLU  46  -0.154  -7.677   2.420
  334    HG2  GLU  46           HG2      GLU  46   2.277  -7.597   2.887
  335    HG3  GLU  46           HG3      GLU  46   1.902  -7.525   4.610
  336    H    VAL  47           H        VAL  47   2.320  -4.188   3.181
  337    HA   VAL  47           HA       VAL  47   2.851  -4.585   0.307
  338    HB   VAL  47           HB       VAL  47   3.357  -2.056   1.876
  339   HG11  VAL  47          2HG1      VAL  47   3.800  -1.059  -0.317
  340   HG12  VAL  47          1HG1      VAL  47   3.586  -2.641  -1.067
  341   HG13  VAL  47          3HG1      VAL  47   4.923  -2.368   0.050
  342   HG21  VAL  47          3HG2      VAL  47   1.519  -1.077   0.602
  343   HG22  VAL  47          2HG2      VAL  47   0.965  -2.425   1.596
  344   HG23  VAL  47          1HG2      VAL  47   1.197  -2.645  -0.140
  345    H    THR  48           H        THR  48   4.774  -5.304  -0.208
  346    HA   THR  48           HA       THR  48   6.981  -5.091   1.736
  347    HB   THR  48           HB       THR  48   6.763  -6.961  -0.641
  348    HG1  THR  48           HG1      THR  48   5.504  -7.104   1.659
  349   HG21  THR  48          3HG2      THR  48   8.647  -8.127   0.425
  350   HG22  THR  48          1HG2      THR  48   8.701  -6.887   1.678
  351   HG23  THR  48          2HG2      THR  48   9.068  -6.466   0.005
  352    H    ILE  49           H        ILE  49   8.525  -3.629   1.233
  353    HA   ILE  49           HA       ILE  49   8.677  -2.726  -1.573
  354    HB   ILE  49           HB       ILE  49   9.186  -0.460  -0.743
  355   HG12  ILE  49          2HG1      ILE  49   8.301  -1.495   1.956
  356   HG13  ILE  49          3HG1      ILE  49   9.986  -1.251   1.508
  357   HG21  ILE  49          2HG2      ILE  49   6.897   0.119  -0.107
  358   HG22  ILE  49          1HG2      ILE  49   6.554  -1.584   0.204
  359   HG23  ILE  49          3HG2      ILE  49   6.928  -1.043  -1.431
  360   HD11  ILE  49          3HD1      ILE  49   7.865   0.879   1.652
  361   HD12  ILE  49          2HD1      ILE  49   9.543   1.126   1.172
  362   HD13  ILE  49          1HD1      ILE  49   9.167   0.607   2.814
  363    H    ASP  50           H        ASP  50  10.656  -1.761  -2.236
  364    HA   ASP  50           HA       ASP  50  13.033  -2.582  -0.747
  365    HB2  ASP  50           HB2      ASP  50  12.927  -2.805  -3.254
  366    HB3  ASP  50           HB3      ASP  50  12.831  -1.051  -3.362
  367    H    SER  51           H        SER  51  13.284  -1.287   0.993
  368    HA   SER  51           HA       SER  51  12.416   1.445   0.957
  369    HB2  SER  51           HB2      SER  51  13.671  -0.322   3.026
  370    HB3  SER  51           HB3      SER  51  13.449   1.402   3.320
  371    HG   SER  51           HG       SER  51  11.639   0.405   4.082
  372    H    SER  52           H        SER  52  15.006   0.209  -0.464
  373    HA   SER  52           HA       SER  52  16.782   2.413   0.282
  374    HB2  SER  52           HB2      SER  52  17.647   0.033  -0.007
  375    HB3  SER  52           HB3      SER  52  17.336   0.227  -1.732
  376    HG   SER  52           HG       SER  52  19.086   1.387  -1.894
  377    H    VAL  53           H        VAL  53  14.238   1.843  -1.696
  378    HA   VAL  53           HA       VAL  53  15.184   3.788  -3.698
  379    HB   VAL  53           HB       VAL  53  13.193   1.554  -4.129
  380   HG11  VAL  53          2HG1      VAL  53  14.334   3.569  -6.059
  381   HG12  VAL  53          1HG1      VAL  53  12.677   3.527  -5.457
  382   HG13  VAL  53          3HG1      VAL  53  13.277   2.223  -6.482
  383   HG21  VAL  53          3HG2      VAL  53  14.901   0.572  -5.575
  384   HG22  VAL  53          2HG2      VAL  53  15.487   0.738  -3.919
  385   HG23  VAL  53          1HG2      VAL  53  16.011   1.877  -5.157
  386    H    VAL  54           H        VAL  54  12.095   2.405  -2.556
  387    HA   VAL  54           HA       VAL  54  10.931   5.096  -2.727
  388    HB   VAL  54           HB       VAL  54   9.813   3.246  -3.970
  389   HG11  VAL  54          2HG1      VAL  54  10.269   1.423  -2.434
  390   HG12  VAL  54          1HG1      VAL  54   8.539   1.562  -2.742
  391   HG13  VAL  54          3HG1      VAL  54   9.215   2.156  -1.226
  392   HG21  VAL  54          3HG2      VAL  54   7.527   3.746  -3.223
  393   HG22  VAL  54          2HG2      VAL  54   8.527   5.196  -3.325
  394   HG23  VAL  54          1HG2      VAL  54   8.178   4.476  -1.755
  395    H    THR  55           H        THR  55   9.779   5.987  -0.934
  396    HA   THR  55           HA       THR  55  10.477   4.735   1.627
  397    HB   THR  55           HB       THR  55   9.942   6.852   2.700
  398    HG1  THR  55           HG1      THR  55   9.246   7.735   0.066
  399   HG21  THR  55          3HG2      THR  55  11.689   7.264   0.271
  400   HG22  THR  55          1HG2      THR  55  12.203   6.585   1.814
  401   HG23  THR  55          2HG2      THR  55  11.684   8.269   1.720
  402    H    LEU  56           H        LEU  56   8.810   4.736   3.324
  403    HA   LEU  56           HA       LEU  56   6.429   3.512   2.409
  404    HB2  LEU  56           HB2      LEU  56   7.772   3.435   4.714
  405    HB3  LEU  56           HB3      LEU  56   6.617   4.674   5.155
  406    HG   LEU  56           HG       LEU  56   6.000   2.356   5.866
  407   HD11  LEU  56          2HD1      LEU  56   3.661   2.506   5.186
  408   HD12  LEU  56          1HD1      LEU  56   4.095   3.704   3.967
  409   HD13  LEU  56          3HD1      LEU  56   4.299   4.074   5.679
  410   HD21  LEU  56          3HD2      LEU  56   6.838   1.158   3.918
  411   HD22  LEU  56          2HD2      LEU  56   5.613   1.927   2.907
  412   HD23  LEU  56          1HD2      LEU  56   5.127   0.814   4.187
  413    H    LYS  57           H        LYS  57   7.295   6.748   3.419
  414    HA   LYS  57           HA       LYS  57   4.736   7.861   3.698
  415    HB2  LYS  57           HB2      LYS  57   7.188   8.782   4.168
  416    HB3  LYS  57           HB3      LYS  57   6.941   9.530   2.597
  417    HG2  LYS  57           HG2      LYS  57   5.022   9.820   4.890
  418    HG3  LYS  57           HG3      LYS  57   6.342  10.947   4.576
  419    HD2  LYS  57           HD2      LYS  57   5.392  11.433   2.370
  420    HD3  LYS  57           HD3      LYS  57   4.079  10.294   2.683
  421    HE2  LYS  57           HE2      LYS  57   3.253  12.486   3.113
  422    HE3  LYS  57           HE3      LYS  57   3.454  11.674   4.662
  423    HZ1  LYS  57           HZ1      LYS  57   5.273  13.697   3.468
  424    HZ2  LYS  57           HZ2      LYS  57   5.600  12.845   4.898
  425    HZ3  LYS  57           HZ3      LYS  57   4.272  13.900   4.823
  426    H    ASP  58           H        ASP  58   6.814   7.482   0.837
  427    HA   ASP  58           HA       ASP  58   5.412   9.022  -1.006
  428    HB2  ASP  58           HB2      ASP  58   6.892   6.415  -1.401
  429    HB3  ASP  58           HB3      ASP  58   6.229   7.348  -2.734
  430    H    ILE  59           H        ILE  59   4.999   5.610  -0.213
  431    HA   ILE  59           HA       ILE  59   2.834   5.161  -1.963
  432    HB   ILE  59           HB       ILE  59   3.656   3.632   0.508
  433   HG12  ILE  59          2HG1      ILE  59   4.306   3.212  -2.418
  434   HG13  ILE  59          3HG1      ILE  59   5.415   3.839  -1.204
  435   HG21  ILE  59          2HG2      ILE  59   1.880   2.806  -1.787
  436   HG22  ILE  59          1HG2      ILE  59   1.358   3.126  -0.134
  437   HG23  ILE  59          3HG2      ILE  59   2.420   1.760  -0.473
  438   HD11  ILE  59          3HD1      ILE  59   5.358   1.732  -0.029
  439   HD12  ILE  59          2HD1      ILE  59   5.817   1.493  -1.715
  440   HD13  ILE  59          1HD1      ILE  59   4.181   1.101  -1.183
  441    H    VAL  60           H        VAL  60   2.979   5.882   1.522
  442    HA   VAL  60           HA       VAL  60   0.255   5.770   2.091
  443    HB   VAL  60           HB       VAL  60   2.374   7.592   3.249
  444   HG11  VAL  60          2HG1      VAL  60  -0.395   7.020   4.298
  445   HG12  VAL  60          1HG1      VAL  60   0.157   8.550   3.617
  446   HG13  VAL  60          3HG1      VAL  60   0.853   7.953   5.121
  447   HG21  VAL  60          3HG2      VAL  60   2.350   6.001   5.111
  448   HG22  VAL  60          2HG2      VAL  60   2.779   5.216   3.591
  449   HG23  VAL  60          1HG2      VAL  60   1.158   5.023   4.254
  450    H    ALA  61           H        ALA  61   2.198   8.499   0.915
  451    HA   ALA  61           HA       ALA  61   0.224  10.459   0.862
  452    HB1  ALA  61           HB1      ALA  61   2.568  10.110  -1.006
  453    HB2  ALA  61           HB2      ALA  61   1.623  11.587  -0.813
  454    HB3  ALA  61           HB3      ALA  61   2.575  10.968   0.536
  455    H    VAL  62           H        VAL  62   1.170   8.169  -1.688
  456    HA   VAL  62           HA       VAL  62  -0.704   9.058  -3.600
  457    HB   VAL  62           HB       VAL  62   0.567   6.327  -3.331
  458   HG11  VAL  62          2HG1      VAL  62  -1.399   6.235  -4.757
  459   HG12  VAL  62          1HG1      VAL  62   0.067   6.088  -5.728
  460   HG13  VAL  62          3HG1      VAL  62  -0.813   7.617  -5.683
  461   HG21  VAL  62          3HG2      VAL  62   2.148   7.155  -5.016
  462   HG22  VAL  62          2HG2      VAL  62   2.213   8.105  -3.533
  463   HG23  VAL  62          1HG2      VAL  62   1.376   8.739  -4.949
  464    H    ILE  63           H        ILE  63  -0.872   6.479  -1.163
  465    HA   ILE  63           HA       ILE  63  -3.327   5.393  -2.001
  466    HB   ILE  63           HB       ILE  63  -2.049   5.373   0.732
  467   HG12  ILE  63          2HG1      ILE  63  -2.183   3.276  -1.447
  468   HG13  ILE  63          3HG1      ILE  63  -0.764   4.236  -1.036
  469   HG21  ILE  63          2HG2      ILE  63  -4.458   5.035   0.922
  470   HG22  ILE  63          1HG2      ILE  63  -3.581   3.545   1.271
  471   HG23  ILE  63          3HG2      ILE  63  -4.381   3.755  -0.288
  472   HD11  ILE  63          3HD1      ILE  63  -2.136   2.263   0.778
  473   HD12  ILE  63          2HD1      ILE  63  -0.703   3.208   1.173
  474   HD13  ILE  63          1HD1      ILE  63  -0.633   1.991  -0.100
  475    H    GLU  64           H        GLU  64  -2.616   7.858   0.473
  476    HA   GLU  64           HA       GLU  64  -5.289   8.089   1.362
  477    HB2  GLU  64           HB2      GLU  64  -3.081  10.151   1.519
  478    HB3  GLU  64           HB3      GLU  64  -4.587  10.184   2.428
  479    HG2  GLU  64           HG2      GLU  64  -3.924   8.003   3.447
  480    HG3  GLU  64           HG3      GLU  64  -2.354   8.192   2.668
  481    H    ASP  65           H        ASP  65  -3.529   9.550  -1.270
  482    HA   ASP  65           HA       ASP  65  -5.388  11.619  -1.832
  483    HB2  ASP  65           HB2      ASP  65  -3.045  11.580  -2.673
  484    HB3  ASP  65           HB3      ASP  65  -3.484  10.254  -3.747
  485    H    GLN  66           H        GLN  66  -5.419   8.244  -2.338
  486    HA   GLN  66           HA       GLN  66  -7.408   8.275  -4.435
  487    HB2  GLN  66           HB2      GLN  66  -6.347   6.045  -2.692
  488    HB3  GLN  66           HB3      GLN  66  -7.492   5.816  -4.006
  489    HG2  GLN  66           HG2      GLN  66  -4.721   6.947  -4.321
  490    HG3  GLN  66           HG3      GLN  66  -5.162   5.263  -4.605
  491   HE21  GLN  66          1HE2      GLN  66  -5.405   8.525  -5.766
  492   HE22  GLN  66          2HE2      GLN  66  -6.023   8.139  -7.335
  493    H    GLY  67           H        GLY  67  -7.466   8.989  -1.228
  494    HA2  GLY  67           HA1      GLY  67  -9.443   9.697  -0.151
  495    HA3  GLY  67           HA2      GLY  67 -10.361   8.585  -1.152
  496    H    TYR  68           H        TYR  68  -7.507   8.008   0.890
  497    HA   TYR  68           HA       TYR  68  -9.168   6.255   2.563
  498    HB2  TYR  68           HB2      TYR  68  -6.409   5.538   1.557
  499    HB3  TYR  68           HB3      TYR  68  -7.399   4.572   2.638
  500    HD1  TYR  68           HD1      TYR  68  -9.767   3.904   1.672
  501    HD2  TYR  68           HD2      TYR  68  -6.417   5.036  -0.692
  502    HE1  TYR  68           HE1      TYR  68 -10.730   2.718  -0.254
  503    HE2  TYR  68           HE2      TYR  68  -7.374   3.859  -2.624
  504    HH   TYR  68           HH       TYR  68  -8.985   1.977  -3.018
  505    H    ASP  69           H        ASP  69  -8.580   6.076   4.686
  506    HA   ASP  69           HA       ASP  69  -6.443   7.854   5.643
  507    HB2  ASP  69           HB2      ASP  69  -8.437   6.299   7.312
  508    HB3  ASP  69           HB3      ASP  69  -7.379   7.592   7.856
  509    H    VAL  70           H        VAL  70  -4.536   6.756   5.463
  510    HA   VAL  70           HA       VAL  70  -4.550   3.978   6.424
  511    HB   VAL  70           HB       VAL  70  -2.602   3.547   4.958
  512   HG11  VAL  70          2HG1      VAL  70  -3.891   3.441   2.873
  513   HG12  VAL  70          1HG1      VAL  70  -5.099   4.515   3.577
  514   HG13  VAL  70          3HG1      VAL  70  -4.836   2.910   4.265
  515   HG21  VAL  70          3HG2      VAL  70  -2.037   5.083   3.177
  516   HG22  VAL  70          2HG2      VAL  70  -1.842   5.889   4.732
  517   HG23  VAL  70          1HG2      VAL  70  -3.258   6.227   3.733
  518    H    GLN  71           H        GLN  71  -2.950   3.251   7.728
  519    HA   GLN  71           HA       GLN  71  -0.795   5.024   8.515
  520    HB2  GLN  71           HB2      GLN  71  -2.709   5.623   9.994
  521    HB3  GLN  71           HB3      GLN  71  -2.759   3.956  10.552
  522    HG2  GLN  71           HG2      GLN  71  -0.101   4.971  10.823
  523    HG3  GLN  71           HG3      GLN  71  -1.241   6.081  11.581
  524   HE21  GLN  71          1HE2      GLN  71   0.101   2.872  11.624
  525   HE22  GLN  71          2HE2      GLN  71  -0.496   2.431  13.190
  Start of MODEL   16
    1    H1   SER   1           H1       SER   1  21.890  -0.781  -1.242
    2    H2   SER   1           H2       SER   1  23.233  -1.343  -2.115
    3    H3   SER   1           H3       SER   1  22.035  -2.427  -1.612
    4    HA   SER   1           HA       SER   1  21.666  -0.232  -3.562
    5    HB2  SER   1           HB2      SER   1  21.776  -3.234  -3.966
    6    HB3  SER   1           HB3      SER   1  21.444  -2.038  -5.221
    7    HG   SER   1           HG       SER   1  23.500  -1.500  -5.290
    8    H    ASN   2           H        ASN   2  20.276  -3.139  -2.055
    9    HA   ASN   2           HA       ASN   2  17.645  -1.856  -2.246
   10    HB2  ASN   2           HB2      ASN   2  16.597  -4.017  -2.774
   11    HB3  ASN   2           HB3      ASN   2  17.734  -3.538  -4.026
   12   HD21  ASN   2          1HD2      ASN   2  19.588  -4.722  -4.334
   13   HD22  ASN   2          2HD2      ASN   2  19.846  -6.275  -3.614
   14    H    ALA   3           H        ALA   3  16.261  -2.244  -0.547
   15    HA   ALA   3           HA       ALA   3  16.994  -4.106   1.563
   16    HB1  ALA   3           HB1      ALA   3  17.034  -2.399   3.323
   17    HB2  ALA   3           HB2      ALA   3  18.325  -2.137   2.150
   18    HB3  ALA   3           HB3      ALA   3  16.872  -1.135   2.104
   19    H    MET   4           H        MET   4  15.058  -5.127   1.692
   20    HA   MET   4           HA       MET   4  12.667  -3.565   1.144
   21    HB2  MET   4           HB2      MET   4  11.498  -5.746   1.030
   22    HB3  MET   4           HB3      MET   4  12.817  -5.587  -0.117
   23    HG2  MET   4           HG2      MET   4  14.219  -6.999   1.201
   24    HG3  MET   4           HG3      MET   4  13.037  -7.027   2.510
   25    HE1  MET   4           HE1      MET   4  11.965  -8.764  -1.621
   26    HE2  MET   4           HE2      MET   4  11.807  -7.065  -1.171
   27    HE3  MET   4           HE3      MET   4  13.409  -7.786  -1.352
   28    H    GLU   5           H        GLU   5  10.969  -3.316   2.433
   29    HA   GLU   5           HA       GLU   5  11.121  -4.367   5.182
   30    HB2  GLU   5           HB2      GLU   5  10.054  -1.688   4.258
   31    HB3  GLU   5           HB3      GLU   5   9.922  -2.304   5.898
   32    HG2  GLU   5           HG2      GLU   5  12.451  -2.427   5.909
   33    HG3  GLU   5           HG3      GLU   5  12.404  -1.501   4.409
   34    H    GLN   6           H        GLN   6   9.294  -5.347   5.942
   35    HA   GLN   6           HA       GLN   6   7.008  -5.462   4.086
   36    HB2  GLN   6           HB2      GLN   6   7.692  -7.422   6.282
   37    HB3  GLN   6           HB3      GLN   6   6.459  -7.608   5.042
   38    HG2  GLN   6           HG2      GLN   6   8.324  -7.514   3.353
   39    HG3  GLN   6           HG3      GLN   6   9.440  -7.661   4.706
   40   HE21  GLN   6          1HE2      GLN   6   7.093  -9.238   2.737
   41   HE22  GLN   6          2HE2      GLN   6   7.388 -10.852   3.301
   42    H    LEU   7           H        LEU   7   5.272  -4.380   4.667
   43    HA   LEU   7           HA       LEU   7   4.749  -3.952   7.527
   44    HB2  LEU   7           HB2      LEU   7   5.921  -1.990   6.521
   45    HB3  LEU   7           HB3      LEU   7   4.585  -1.816   5.401
   46    HG   LEU   7           HG       LEU   7   3.072  -1.462   7.360
   47   HD11  LEU   7          2HD1      LEU   7   4.112  -0.866   9.504
   48   HD12  LEU   7          1HD1      LEU   7   5.683  -1.352   8.865
   49   HD13  LEU   7          3HD1      LEU   7   4.404  -2.550   9.069
   50   HD21  LEU   7          3HD2      LEU   7   5.375   0.464   7.093
   51   HD22  LEU   7          2HD2      LEU   7   3.774   0.837   7.732
   52   HD23  LEU   7          1HD2      LEU   7   3.965   0.392   6.035
   53    H    THR   8           H        THR   8   2.622  -3.944   8.098
   54    HA   THR   8           HA       THR   8   0.663  -4.503   5.998
   55    HB   THR   8           HB       THR   8   0.279  -4.706   8.992
   56    HG1  THR   8           HG1      THR   8   0.534  -7.047   7.538
   57   HG21  THR   8          3HG2      THR   8  -1.580  -6.198   8.366
   58   HG22  THR   8          1HG2      THR   8  -1.251  -5.877   6.663
   59   HG23  THR   8          2HG2      THR   8  -1.793  -4.572   7.720
   60    H    LEU   9           H        LEU   9  -0.218  -2.686   5.208
   61    HA   LEU   9           HA       LEU   9  -0.511  -0.322   6.881
   62    HB2  LEU   9           HB2      LEU   9  -1.068  -0.852   3.963
   63    HB3  LEU   9           HB3      LEU   9  -1.459   0.666   4.742
   64    HG   LEU   9           HG       LEU   9   0.988   0.915   5.290
   65   HD11  LEU   9          2HD1      LEU   9   1.263  -1.386   3.361
   66   HD12  LEU   9          1HD1      LEU   9   1.663  -1.418   5.079
   67   HD13  LEU   9          3HD1      LEU   9   2.583  -0.392   3.978
   68   HD21  LEU   9          3HD2      LEU   9  -0.018   2.133   3.469
   69   HD22  LEU   9          2HD2      LEU   9   0.159   0.741   2.401
   70   HD23  LEU   9          1HD2      LEU   9   1.590   1.584   2.995
   71    H    GLN  10           H        GLN  10  -2.457   0.545   7.564
   72    HA   GLN  10           HA       GLN  10  -4.793  -1.171   7.212
   73    HB2  GLN  10           HB2      GLN  10  -5.800   0.090   9.058
   74    HB3  GLN  10           HB3      GLN  10  -4.245  -0.578   9.517
   75    HG2  GLN  10           HG2      GLN  10  -4.095   1.509  10.415
   76    HG3  GLN  10           HG3      GLN  10  -3.359   1.782   8.837
   77   HE21  GLN  10          1HE2      GLN  10  -6.796   1.334   9.269
   78   HE22  GLN  10          2HE2      GLN  10  -7.244   2.968   8.907
   79    H    VAL  11           H        VAL  11  -6.776  -0.384   6.442
   80    HA   VAL  11           HA       VAL  11  -6.473   2.022   4.756
   81    HB   VAL  11           HB       VAL  11  -8.020  -0.457   4.004
   82   HG11  VAL  11          2HG1      VAL  11  -7.983   0.502   1.762
   83   HG12  VAL  11          1HG1      VAL  11  -7.118   1.911   2.374
   84   HG13  VAL  11          3HG1      VAL  11  -8.765   1.583   2.914
   85   HG21  VAL  11          3HG2      VAL  11  -6.155  -0.962   2.460
   86   HG22  VAL  11          2HG2      VAL  11  -5.697  -1.088   4.162
   87   HG23  VAL  11          1HG2      VAL  11  -5.216   0.325   3.217
   88    H    GLU  12           H        GLU  12  -7.777   3.523   5.649
   89    HA   GLU  12           HA       GLU  12 -10.416   2.712   6.598
   90    HB2  GLU  12           HB2      GLU  12  -8.759   5.182   6.950
   91    HB3  GLU  12           HB3      GLU  12 -10.492   5.223   7.250
   92    HG2  GLU  12           HG2      GLU  12  -8.565   3.338   8.588
   93    HG3  GLU  12           HG3      GLU  12  -9.147   4.852   9.281
   94    H    GLY  13           H        GLY  13 -11.997   2.677   5.194
   95    HA2  GLY  13           HA1      GLY  13 -13.568   4.140   4.022
   96    HA3  GLY  13           HA2      GLY  13 -12.179   4.898   3.260
   97    H    MET  14           H        MET  14 -12.743   1.427   3.705
   98    HA   MET  14           HA       MET  14 -12.034   0.724   1.102
   99    HB2  MET  14           HB2      MET  14 -13.648  -0.675   3.214
  100    HB3  MET  14           HB3      MET  14 -13.444  -1.396   1.624
  101    HG2  MET  14           HG2      MET  14 -11.224  -0.639   3.516
  102    HG3  MET  14           HG3      MET  14 -11.828  -2.270   3.223
  103    HE1  MET  14           HE1      MET  14  -8.417  -2.603   1.433
  104    HE2  MET  14           HE2      MET  14  -8.797  -1.892   3.003
  105    HE3  MET  14           HE3      MET  14  -9.593  -3.381   2.491
  106    H    SER  15           H        SER  15 -12.956   1.189  -0.736
  107    HA   SER  15           HA       SER  15 -15.761   1.928  -0.873
  108    HB2  SER  15           HB2      SER  15 -13.753   1.900  -3.130
  109    HB3  SER  15           HB3      SER  15 -15.240   2.841  -3.012
  110    HG   SER  15           HG       SER  15 -14.295   4.044  -1.346
  111    H    CYS  16           H        CYS  16 -16.168  -0.455  -0.328
  112    HA   CYS  16           HA       CYS  16 -16.986  -2.488  -0.906
  113    HB2  CYS  16           HB2      CYS  16 -17.408  -1.199  -3.612
  114    HB3  CYS  16           HB3      CYS  16 -18.236  -2.625  -2.994
  115    HG   CYS  16           HG       CYS  16 -19.307  -1.018  -0.784
  116    H    GLY  17           H        GLY  17 -16.506  -2.751  -4.199
  117    HA2  GLY  17           HA1      GLY  17 -14.091  -4.372  -3.748
  118    HA3  GLY  17           HA2      GLY  17 -15.199  -4.531  -5.106
  119    H    HIS  18           H        HIS  18 -14.808  -1.323  -4.726
  120    HA   HIS  18           HA       HIS  18 -13.167  -1.091  -7.065
  121    HB2  HIS  18           HB2      HIS  18 -14.263   0.995  -5.165
  122    HB3  HIS  18           HB3      HIS  18 -13.370   1.379  -6.630
  123    HD1  HIS  18           HD1      HIS  18 -14.804   1.874  -8.570
  124    HD2  HIS  18           HD2      HIS  18 -16.707  -0.622  -5.845
  125    HE1  HIS  18           HE1      HIS  18 -17.117   1.501  -9.492
  126    HE2  HIS  18           HE2      HIS  18 -18.214  -0.101  -7.879
  127    H    CYS  19           H        CYS  19 -12.797  -0.321  -3.652
  128    HA   CYS  19           HA       CYS  19 -10.321   0.947  -3.747
  129    HB2  CYS  19           HB2      CYS  19 -10.184   0.222  -1.320
  130    HB3  CYS  19           HB3      CYS  19 -11.629   1.119  -1.777
  131    HG   CYS  19           HG       CYS  19 -11.510  -1.663  -0.209
  132    H    VAL  20           H        VAL  20 -11.135  -2.448  -3.702
  133    HA   VAL  20           HA       VAL  20  -8.814  -3.603  -2.771
  134    HB   VAL  20           HB       VAL  20 -10.507  -4.675  -5.035
  135   HG11  VAL  20          2HG1      VAL  20  -8.409  -5.872  -4.738
  136   HG12  VAL  20          1HG1      VAL  20  -9.779  -6.868  -4.246
  137   HG13  VAL  20          3HG1      VAL  20  -8.766  -6.094  -3.025
  138   HG21  VAL  20          3HG2      VAL  20 -10.865  -4.984  -2.057
  139   HG22  VAL  20          2HG2      VAL  20 -11.799  -5.821  -3.296
  140   HG23  VAL  20          1HG2      VAL  20 -11.907  -4.067  -3.144
  141    H    ASN  21           H        ASN  21  -9.601  -3.208  -6.232
  142    HA   ASN  21           HA       ASN  21  -6.915  -3.743  -7.021
  143    HB2  ASN  21           HB2      ASN  21  -8.830  -4.271  -8.480
  144    HB3  ASN  21           HB3      ASN  21  -9.184  -2.552  -8.637
  145   HD21  ASN  21          1HD2      ASN  21  -8.017  -1.325 -10.054
  146   HD22  ASN  21          2HD2      ASN  21  -6.797  -1.970 -11.103
  147    H    ALA  22           H        ALA  22  -8.783  -0.839  -6.415
  148    HA   ALA  22           HA       ALA  22  -7.149   1.044  -7.668
  149    HB1  ALA  22           HB1      ALA  22  -8.146   2.687  -6.186
  150    HB2  ALA  22           HB2      ALA  22  -9.368   1.557  -6.772
  151    HB3  ALA  22           HB3      ALA  22  -8.736   1.403  -5.133
  152    H    ILE  23           H        ILE  23  -7.030  -0.071  -4.263
  153    HA   ILE  23           HA       ILE  23  -4.676   1.503  -3.776
  154    HB   ILE  23           HB       ILE  23  -6.315   1.051  -1.974
  155   HG12  ILE  23          2HG1      ILE  23  -3.543  -0.002  -1.383
  156   HG13  ILE  23          3HG1      ILE  23  -3.953   1.703  -1.526
  157   HG21  ILE  23          2HG2      ILE  23  -6.841  -1.273  -2.491
  158   HG22  ILE  23          1HG2      ILE  23  -6.299  -1.101  -0.821
  159   HG23  ILE  23          3HG2      ILE  23  -5.204  -1.751  -2.040
  160   HD11  ILE  23          3HD1      ILE  23  -5.052  -0.202   0.526
  161   HD12  ILE  23          2HD1      ILE  23  -5.443   1.512   0.389
  162   HD13  ILE  23          1HD1      ILE  23  -3.801   1.012   0.798
  163    H    GLU  24           H        GLU  24  -5.358  -1.872  -4.522
  164    HA   GLU  24           HA       GLU  24  -2.836  -2.950  -4.032
  165    HB2  GLU  24           HB2      GLU  24  -4.783  -4.312  -4.624
  166    HB3  GLU  24           HB3      GLU  24  -4.778  -3.637  -6.247
  167    HG2  GLU  24           HG2      GLU  24  -2.617  -4.672  -6.679
  168    HG3  GLU  24           HG3      GLU  24  -2.594  -5.321  -5.039
  169    H    SER  25           H        SER  25  -4.080  -1.311  -6.928
  170    HA   SER  25           HA       SER  25  -1.597  -1.497  -8.313
  171    HB2  SER  25           HB2      SER  25  -3.960   0.306  -8.825
  172    HB3  SER  25           HB3      SER  25  -2.551   0.144  -9.882
  173    HG   SER  25           HG       SER  25  -3.822  -2.222  -9.150
  174    H    SER  26           H        SER  26  -3.094   1.092  -6.354
  175    HA   SER  26           HA       SER  26  -1.274   3.090  -7.104
  176    HB2  SER  26           HB2      SER  26  -1.915   4.193  -4.937
  177    HB3  SER  26           HB3      SER  26  -3.274   3.741  -5.963
  178    HG   SER  26           HG       SER  26  -3.723   3.109  -3.874
  179    H    VAL  27           H        VAL  27  -1.047   0.515  -4.756
  180    HA   VAL  27           HA       VAL  27   1.532   1.395  -3.812
  181    HB   VAL  27           HB       VAL  27   0.191  -1.301  -3.495
  182   HG11  VAL  27          2HG1      VAL  27   2.582  -1.445  -3.160
  183   HG12  VAL  27          1HG1      VAL  27   1.744  -1.594  -1.616
  184   HG13  VAL  27          3HG1      VAL  27   2.534  -0.077  -2.049
  185   HG21  VAL  27          3HG2      VAL  27   0.263   1.068  -1.630
  186   HG22  VAL  27          2HG2      VAL  27  -0.413  -0.518  -1.255
  187   HG23  VAL  27          1HG2      VAL  27  -1.145   0.479  -2.513
  188    H    LYS  28           H        LYS  28   0.346  -1.192  -5.971
  189    HA   LYS  28           HA       LYS  28   2.876  -2.337  -6.439
  190    HB2  LYS  28           HB2      LYS  28   0.737  -3.498  -6.840
  191    HB3  LYS  28           HB3      LYS  28   0.419  -2.429  -8.195
  192    HG2  LYS  28           HG2      LYS  28   1.186  -4.500  -9.066
  193    HG3  LYS  28           HG3      LYS  28   2.474  -3.320  -9.293
  194    HD2  LYS  28           HD2      LYS  28   2.440  -5.104  -6.884
  195    HD3  LYS  28           HD3      LYS  28   3.066  -5.688  -8.425
  196    HE2  LYS  28           HE2      LYS  28   4.030  -3.222  -6.983
  197    HE3  LYS  28           HE3      LYS  28   4.817  -4.800  -6.921
  198    HZ1  LYS  28           HZ1      LYS  28   4.365  -3.262  -9.426
  199    HZ2  LYS  28           HZ2      LYS  28   5.274  -4.686  -9.249
  200    HZ3  LYS  28           HZ3      LYS  28   5.811  -3.243  -8.541
  201    H    GLU  29           H        GLU  29   1.103   0.166  -8.216
  202    HA   GLU  29           HA       GLU  29   2.856   0.250 -10.434
  203    HB2  GLU  29           HB2      GLU  29   0.916   2.251  -9.304
  204    HB3  GLU  29           HB3      GLU  29   1.866   2.564 -10.758
  205    HG2  GLU  29           HG2      GLU  29   0.157   0.131 -10.462
  206    HG3  GLU  29           HG3      GLU  29  -0.478   1.654 -11.094
  207    H    LEU  30           H        LEU  30   2.933   1.596  -7.281
  208    HA   LEU  30           HA       LEU  30   4.816   3.654  -7.644
  209    HB2  LEU  30           HB2      LEU  30   3.632   2.210  -5.410
  210    HB3  LEU  30           HB3      LEU  30   5.293   2.678  -5.099
  211    HG   LEU  30           HG       LEU  30   3.457   4.289  -4.355
  212   HD11  LEU  30          2HD1      LEU  30   5.651   5.299  -6.160
  213   HD12  LEU  30          1HD1      LEU  30   5.820   4.883  -4.454
  214   HD13  LEU  30          3HD1      LEU  30   4.801   6.239  -4.933
  215   HD21  LEU  30          3HD2      LEU  30   2.587   5.807  -6.023
  216   HD22  LEU  30          2HD2      LEU  30   2.134   4.153  -6.440
  217   HD23  LEU  30          1HD2      LEU  30   3.454   4.950  -7.298
  218    H    ASN  31           H        ASN  31   6.916   3.690  -7.941
  219    HA   ASN  31           HA       ASN  31   8.381   1.359  -8.579
  220    HB2  ASN  31           HB2      ASN  31   8.894   3.545  -9.564
  221    HB3  ASN  31           HB3      ASN  31   9.365   4.160  -7.983
  222   HD21  ASN  31          1HD2      ASN  31  11.452   4.625  -8.488
  223   HD22  ASN  31          2HD2      ASN  31  12.637   3.419  -8.878
  224    H    GLY  32           H        GLY  32   9.558   0.020  -7.355
  225    HA2  GLY  32           HA1      GLY  32  11.200  -0.317  -5.626
  226    HA3  GLY  32           HA2      GLY  32  10.425   0.960  -4.701
  227    H    VAL  33           H        VAL  33   7.821  -0.477  -5.745
  228    HA   VAL  33           HA       VAL  33   7.499  -1.989  -3.322
  229    HB   VAL  33           HB       VAL  33   5.577  -1.389  -5.575
  230   HG11  VAL  33          2HG1      VAL  33   5.069  -2.796  -2.951
  231   HG12  VAL  33          1HG1      VAL  33   4.991  -3.526  -4.554
  232   HG13  VAL  33          3HG1      VAL  33   3.830  -2.280  -4.094
  233   HG21  VAL  33          3HG2      VAL  33   4.534   0.064  -3.897
  234   HG22  VAL  33          2HG2      VAL  33   6.205   0.531  -4.218
  235   HG23  VAL  33          1HG2      VAL  33   5.805  -0.364  -2.750
  236    H    GLU  34           H        GLU  34   7.919  -4.007  -3.113
  237    HA   GLU  34           HA       GLU  34   8.659  -5.619  -5.384
  238    HB2  GLU  34           HB2      GLU  34  10.016  -5.684  -3.378
  239    HB3  GLU  34           HB3      GLU  34   8.627  -6.152  -2.411
  240    HG2  GLU  34           HG2      GLU  34  10.138  -8.019  -2.852
  241    HG3  GLU  34           HG3      GLU  34   8.530  -8.291  -3.521
  242    H    GLN  35           H        GLN  35   6.239  -5.848  -2.766
  243    HA   GLN  35           HA       GLN  35   4.440  -7.184  -4.598
  244    HB2  GLN  35           HB2      GLN  35   4.050  -9.125  -3.229
  245    HB3  GLN  35           HB3      GLN  35   5.765  -9.030  -3.599
  246    HG2  GLN  35           HG2      GLN  35   6.084  -7.952  -1.378
  247    HG3  GLN  35           HG3      GLN  35   4.405  -8.331  -1.019
  248   HE21  GLN  35          1HE2      GLN  35   6.771  -9.245   0.345
  249   HE22  GLN  35          2HE2      GLN  35   6.779 -10.974   0.230
  250    H    VAL  36           H        VAL  36   2.269  -7.233  -3.878
  251    HA   VAL  36           HA       VAL  36   1.632  -5.824  -1.404
  252    HB   VAL  36           HB       VAL  36   1.768  -3.994  -2.970
  253   HG11  VAL  36          2HG1      VAL  36  -0.150  -5.529  -4.723
  254   HG12  VAL  36          1HG1      VAL  36   1.560  -5.250  -5.051
  255   HG13  VAL  36          3HG1      VAL  36   0.439  -3.891  -5.013
  256   HG21  VAL  36          3HG2      VAL  36  -1.104  -4.752  -2.455
  257   HG22  VAL  36          2HG2      VAL  36  -0.539  -3.143  -2.907
  258   HG23  VAL  36          1HG2      VAL  36  -0.039  -3.853  -1.373
  259    H    LYS  37           H        LYS  37  -0.027  -6.802  -0.416
  260    HA   LYS  37           HA       LYS  37  -2.025  -8.184  -2.084
  261    HB2  LYS  37           HB2      LYS  37  -1.043  -9.180   0.599
  262    HB3  LYS  37           HB3      LYS  37  -2.224  -9.960  -0.441
  263    HG2  LYS  37           HG2      LYS  37  -0.279  -9.986  -2.171
  264    HG3  LYS  37           HG3      LYS  37   0.736  -9.777  -0.745
  265    HD2  LYS  37           HD2      LYS  37  -1.247 -11.999  -1.218
  266    HD3  LYS  37           HD3      LYS  37   0.507 -12.135  -1.312
  267    HE2  LYS  37           HE2      LYS  37  -1.079 -11.439   1.157
  268    HE3  LYS  37           HE3      LYS  37  -0.379 -13.018   0.798
  269    HZ1  LYS  37           HZ1      LYS  37   1.020 -10.498   1.435
  270    HZ2  LYS  37           HZ2      LYS  37   1.821 -11.786   0.682
  271    HZ3  LYS  37           HZ3      LYS  37   1.134 -11.996   2.218
  272    H    VAL  38           H        VAL  38  -3.791  -6.957  -1.918
  273    HA   VAL  38           HA       VAL  38  -4.373  -5.519   0.525
  274    HB   VAL  38           HB       VAL  38  -4.800  -4.361  -1.551
  275   HG11  VAL  38          2HG1      VAL  38  -5.230  -6.176  -3.057
  276   HG12  VAL  38          1HG1      VAL  38  -6.626  -5.098  -3.066
  277   HG13  VAL  38          3HG1      VAL  38  -6.693  -6.617  -2.176
  278   HG21  VAL  38          3HG2      VAL  38  -7.380  -5.079  -0.165
  279   HG22  VAL  38          2HG2      VAL  38  -7.125  -3.670  -1.196
  280   HG23  VAL  38          1HG2      VAL  38  -6.248  -3.820   0.327
  281    H    GLN  39           H        GLN  39  -5.736  -6.083   2.069
  282    HA   GLN  39           HA       GLN  39  -7.393  -8.485   1.679
  283    HB2  GLN  39           HB2      GLN  39  -6.409  -7.236   4.256
  284    HB3  GLN  39           HB3      GLN  39  -7.327  -8.730   4.116
  285    HG2  GLN  39           HG2      GLN  39  -5.483  -9.726   2.844
  286    HG3  GLN  39           HG3      GLN  39  -4.563  -8.238   3.039
  287   HE21  GLN  39          1HE2      GLN  39  -5.483  -7.825   5.784
  288   HE22  GLN  39          2HE2      GLN  39  -4.629  -8.981   6.751
  289    H    LEU  40           H        LEU  40  -9.495  -8.132   1.460
  290    HA   LEU  40           HA       LEU  40 -10.470  -5.425   1.746
  291    HB2  LEU  40           HB2      LEU  40 -10.937  -6.945  -0.213
  292    HB3  LEU  40           HB3      LEU  40 -11.980  -7.878   0.838
  293    HG   LEU  40           HG       LEU  40 -13.038  -6.148  -0.763
  294   HD11  LEU  40          2HD1      LEU  40 -13.771  -6.157   2.159
  295   HD12  LEU  40          1HD1      LEU  40 -14.296  -7.328   0.949
  296   HD13  LEU  40          3HD1      LEU  40 -14.815  -5.646   0.833
  297   HD21  LEU  40          3HD2      LEU  40 -11.598  -4.275  -0.257
  298   HD22  LEU  40          2HD2      LEU  40 -12.078  -4.328   1.440
  299   HD23  LEU  40          1HD2      LEU  40 -13.258  -3.895   0.203
  300    H    ALA  41           H        ALA  41 -11.005  -8.547   3.297
  301    HA   ALA  41           HA       ALA  41 -13.309  -7.774   4.756
  302    HB1  ALA  41           HB1      ALA  41 -12.953  -9.808   6.051
  303    HB2  ALA  41           HB2      ALA  41 -12.760 -10.115   4.325
  304    HB3  ALA  41           HB3      ALA  41 -11.339  -9.975   5.360
  305    H    GLU  42           H        GLU  42  -9.880  -8.052   5.704
  306    HA   GLU  42           HA       GLU  42 -10.389  -6.962   8.308
  307    HB2  GLU  42           HB2      GLU  42  -7.842  -7.572   6.823
  308    HB3  GLU  42           HB3      GLU  42  -7.862  -6.886   8.440
  309    HG2  GLU  42           HG2      GLU  42  -9.231  -8.861   9.156
  310    HG3  GLU  42           HG3      GLU  42  -8.915  -9.560   7.570
  311    H    GLY  43           H        GLY  43  -9.464  -5.633   5.223
  312    HA2  GLY  43           HA1      GLY  43  -9.517  -3.395   4.611
  313    HA3  GLY  43           HA2      GLY  43  -9.779  -2.969   6.296
  314    H    THR  44           H        THR  44  -7.173  -5.010   5.148
  315    HA   THR  44           HA       THR  44  -5.270  -2.825   5.628
  316    HB   THR  44           HB       THR  44  -3.743  -4.611   6.638
  317    HG1  THR  44           HG1      THR  44  -5.303  -6.240   7.732
  318   HG21  THR  44          3HG2      THR  44  -4.714  -4.380   8.868
  319   HG22  THR  44          1HG2      THR  44  -6.243  -3.862   8.157
  320   HG23  THR  44          2HG2      THR  44  -4.803  -2.857   7.982
  321    H    VAL  45           H        VAL  45  -3.101  -3.284   4.692
  322    HA   VAL  45           HA       VAL  45  -3.209  -5.144   2.411
  323    HB   VAL  45           HB       VAL  45  -2.069  -2.342   2.279
  324   HG11  VAL  45          2HG1      VAL  45  -0.896  -3.905   0.849
  325   HG12  VAL  45          1HG1      VAL  45  -1.870  -2.804  -0.124
  326   HG13  VAL  45          3HG1      VAL  45  -2.422  -4.455   0.160
  327   HG21  VAL  45          3HG2      VAL  45  -3.921  -1.834   0.764
  328   HG22  VAL  45          2HG2      VAL  45  -4.503  -2.268   2.371
  329   HG23  VAL  45          1HG2      VAL  45  -4.599  -3.436   1.052
  330    H    GLU  46           H        GLU  46  -1.536  -6.500   2.427
  331    HA   GLU  46           HA       GLU  46   0.784  -5.959   4.104
  332    HB2  GLU  46           HB2      GLU  46   0.193  -8.358   2.359
  333    HB3  GLU  46           HB3      GLU  46   1.459  -8.242   3.571
  334    HG2  GLU  46           HG2      GLU  46  -0.286  -7.993   5.301
  335    HG3  GLU  46           HG3      GLU  46  -1.507  -8.236   4.052
  336    H    VAL  47           H        VAL  47   2.438  -4.834   3.292
  337    HA   VAL  47           HA       VAL  47   2.995  -5.089   0.405
  338    HB   VAL  47           HB       VAL  47   3.300  -2.579   2.062
  339   HG11  VAL  47          2HG1      VAL  47   3.706  -1.481  -0.084
  340   HG12  VAL  47          1HG1      VAL  47   3.608  -3.041  -0.899
  341   HG13  VAL  47          3HG1      VAL  47   4.910  -2.726   0.248
  342   HG21  VAL  47          3HG2      VAL  47   1.211  -3.284   0.006
  343   HG22  VAL  47          2HG2      VAL  47   1.416  -1.700   0.755
  344   HG23  VAL  47          1HG2      VAL  47   0.948  -3.087   1.739
  345    H    THR  48           H        THR  48   5.074  -5.362  -0.198
  346    HA   THR  48           HA       THR  48   7.181  -4.972   1.836
  347    HB   THR  48           HB       THR  48   7.270  -6.955  -0.454
  348    HG1  THR  48           HG1      THR  48   6.156  -7.125   2.027
  349   HG21  THR  48          3HG2      THR  48   9.235  -7.835   0.809
  350   HG22  THR  48          1HG2      THR  48   9.127  -6.426   1.865
  351   HG23  THR  48          2HG2      THR  48   9.474  -6.217   0.148
  352    H    ILE  49           H        ILE  49   8.541  -3.367   1.312
  353    HA   ILE  49           HA       ILE  49   8.744  -2.622  -1.535
  354    HB   ILE  49           HB       ILE  49   8.862  -0.266  -0.896
  355   HG12  ILE  49          2HG1      ILE  49   7.891  -0.951   1.856
  356   HG13  ILE  49          3HG1      ILE  49   9.622  -0.959   1.532
  357   HG21  ILE  49          2HG2      ILE  49   6.728  -1.186  -1.548
  358   HG22  ILE  49          1HG2      ILE  49   6.499   0.019  -0.278
  359   HG23  ILE  49          3HG2      ILE  49   6.415  -1.701   0.110
  360   HD11  ILE  49          3HD1      ILE  49   9.476   1.373   0.793
  361   HD12  ILE  49          2HD1      ILE  49   8.924   1.166   2.455
  362   HD13  ILE  49          1HD1      ILE  49   7.750   1.370   1.154
  363    H    ASP  50           H        ASP  50  10.653  -1.591  -2.179
  364    HA   ASP  50           HA       ASP  50  13.001  -2.216  -0.591
  365    HB2  ASP  50           HB2      ASP  50  12.871  -2.495  -3.113
  366    HB3  ASP  50           HB3      ASP  50  12.863  -0.739  -3.229
  367    H    SER  51           H        SER  51  13.295  -0.870   1.072
  368    HA   SER  51           HA       SER  51  12.298   1.808   1.078
  369    HB2  SER  51           HB2      SER  51  13.342   1.915   3.339
  370    HB3  SER  51           HB3      SER  51  12.282   0.523   3.125
  371    HG   SER  51           HG       SER  51  14.282  -0.658   2.583
  372    H    SER  52           H        SER  52  15.034   0.484  -0.255
  373    HA   SER  52           HA       SER  52  16.693   2.847   0.134
  374    HB2  SER  52           HB2      SER  52  17.610   0.456   0.022
  375    HB3  SER  52           HB3      SER  52  17.257   0.515  -1.704
  376    HG   SER  52           HG       SER  52  18.561   2.647  -1.448
  377    H    VAL  53           H        VAL  53  14.065   2.143  -1.584
  378    HA   VAL  53           HA       VAL  53  14.827   3.926  -3.799
  379    HB   VAL  53           HB       VAL  53  12.916   1.588  -3.960
  380   HG11  VAL  53          2HG1      VAL  53  12.225   3.500  -5.334
  381   HG12  VAL  53          1HG1      VAL  53  12.734   2.131  -6.324
  382   HG13  VAL  53          3HG1      VAL  53  13.812   3.509  -6.108
  383   HG21  VAL  53          3HG2      VAL  53  14.544   0.593  -5.475
  384   HG22  VAL  53          2HG2      VAL  53  15.268   0.900  -3.893
  385   HG23  VAL  53          1HG2      VAL  53  15.617   1.976  -5.247
  386    H    VAL  54           H        VAL  54  11.908   2.487  -2.345
  387    HA   VAL  54           HA       VAL  54  10.633   5.135  -2.495
  388    HB   VAL  54           HB       VAL  54   9.586   3.323  -3.847
  389   HG11  VAL  54          2HG1      VAL  54   9.042   2.052  -1.170
  390   HG12  VAL  54          1HG1      VAL  54  10.078   1.418  -2.451
  391   HG13  VAL  54          3HG1      VAL  54   8.336   1.542  -2.704
  392   HG21  VAL  54          3HG2      VAL  54   7.274   3.684  -3.082
  393   HG22  VAL  54          2HG2      VAL  54   8.215   5.176  -3.130
  394   HG23  VAL  54          1HG2      VAL  54   7.898   4.384  -1.587
  395    H    THR  55           H        THR  55   9.362   5.829  -0.687
  396    HA   THR  55           HA       THR  55  10.082   4.517   1.840
  397    HB   THR  55           HB       THR  55   9.427   6.581   2.956
  398    HG1  THR  55           HG1      THR  55   8.999   7.819   0.431
  399   HG21  THR  55          3HG2      THR  55  11.128   8.107   2.044
  400   HG22  THR  55          1HG2      THR  55  11.235   7.110   0.594
  401   HG23  THR  55          2HG2      THR  55  11.724   6.451   2.155
  402    H    LEU  56           H        LEU  56   8.332   4.504   3.526
  403    HA   LEU  56           HA       LEU  56   5.982   3.274   2.503
  404    HB2  LEU  56           HB2      LEU  56   6.729   4.246   5.259
  405    HB3  LEU  56           HB3      LEU  56   5.178   3.513   4.916
  406    HG   LEU  56           HG       LEU  56   6.551   1.841   5.886
  407   HD11  LEU  56          2HD1      LEU  56   6.482   1.392   2.910
  408   HD12  LEU  56          1HD1      LEU  56   5.159   1.095   4.037
  409   HD13  LEU  56          3HD1      LEU  56   6.642   0.147   4.150
  410   HD21  LEU  56          3HD2      LEU  56   8.731   2.835   5.553
  411   HD22  LEU  56          2HD2      LEU  56   8.633   2.527   3.818
  412   HD23  LEU  56          1HD2      LEU  56   8.722   1.178   4.950
  413    H    LYS  57           H        LYS  57   6.781   6.464   3.718
  414    HA   LYS  57           HA       LYS  57   4.152   7.444   3.959
  415    HB2  LYS  57           HB2      LYS  57   6.662   8.382   4.580
  416    HB3  LYS  57           HB3      LYS  57   6.150   9.466   3.292
  417    HG2  LYS  57           HG2      LYS  57   4.501   8.868   5.731
  418    HG3  LYS  57           HG3      LYS  57   5.601  10.240   5.598
  419    HD2  LYS  57           HD2      LYS  57   3.269   9.715   3.749
  420    HD3  LYS  57           HD3      LYS  57   3.230  10.813   5.129
  421    HE2  LYS  57           HE2      LYS  57   4.974  11.040   2.679
  422    HE3  LYS  57           HE3      LYS  57   3.606  12.069   3.102
  423    HZ1  LYS  57           HZ1      LYS  57   6.234  11.891   4.464
  424    HZ2  LYS  57           HZ2      LYS  57   4.899  12.665   5.157
  425    HZ3  LYS  57           HZ3      LYS  57   5.548  13.242   3.699
  426    H    ASP  58           H        ASP  58   6.435   7.448   1.243
  427    HA   ASP  58           HA       ASP  58   4.983   9.165  -0.440
  428    HB2  ASP  58           HB2      ASP  58   6.958   6.977  -0.981
  429    HB3  ASP  58           HB3      ASP  58   6.082   7.715  -2.317
  430    H    ILE  59           H        ILE  59   4.791   5.684   0.045
  431    HA   ILE  59           HA       ILE  59   2.799   5.208  -1.908
  432    HB   ILE  59           HB       ILE  59   3.420   3.620   0.588
  433   HG12  ILE  59          2HG1      ILE  59   4.413   3.286  -2.252
  434   HG13  ILE  59          3HG1      ILE  59   5.356   3.941  -0.918
  435   HG21  ILE  59          2HG2      ILE  59   1.964   2.810  -1.928
  436   HG22  ILE  59          1HG2      ILE  59   1.227   3.079  -0.348
  437   HG23  ILE  59          3HG2      ILE  59   2.363   1.749  -0.577
  438   HD11  ILE  59          3HD1      ILE  59   4.253   1.151  -1.091
  439   HD12  ILE  59          2HD1      ILE  59   5.206   1.807   0.239
  440   HD13  ILE  59          1HD1      ILE  59   5.928   1.629  -1.361
  441    H    VAL  60           H        VAL  60   2.644   5.704   1.611
  442    HA   VAL  60           HA       VAL  60  -0.117   5.540   1.942
  443    HB   VAL  60           HB       VAL  60   1.849   7.307   3.420
  444   HG11  VAL  60          2HG1      VAL  60   0.183   7.394   5.209
  445   HG12  VAL  60          1HG1      VAL  60  -0.955   6.505   4.196
  446   HG13  VAL  60          3HG1      VAL  60  -0.431   8.121   3.723
  447   HG21  VAL  60          3HG2      VAL  60   0.731   4.583   4.075
  448   HG22  VAL  60          2HG2      VAL  60   1.783   5.539   5.121
  449   HG23  VAL  60          1HG2      VAL  60   2.384   4.942   3.574
  450    H    ALA  61           H        ALA  61   1.896   8.342   1.112
  451    HA   ALA  61           HA       ALA  61  -0.074  10.296   1.008
  452    HB1  ALA  61           HB1      ALA  61   1.434  11.517  -0.481
  453    HB2  ALA  61           HB2      ALA  61   2.304  10.797   0.874
  454    HB3  ALA  61           HB3      ALA  61   2.383  10.050  -0.722
  455    H    VAL  62           H        VAL  62   1.043   8.097  -1.559
  456    HA   VAL  62           HA       VAL  62  -0.669   9.075  -3.577
  457    HB   VAL  62           HB       VAL  62   0.540   6.318  -3.283
  458   HG11  VAL  62          2HG1      VAL  62  -0.717   7.646  -5.686
  459   HG12  VAL  62          1HG1      VAL  62  -1.334   6.238  -4.820
  460   HG13  VAL  62          3HG1      VAL  62   0.179   6.126  -5.718
  461   HG21  VAL  62          3HG2      VAL  62   2.226   7.143  -4.858
  462   HG22  VAL  62          2HG2      VAL  62   2.206   8.094  -3.372
  463   HG23  VAL  62          1HG2      VAL  62   1.464   8.732  -4.839
  464    H    ILE  63           H        ILE  63  -1.069   6.487  -1.189
  465    HA   ILE  63           HA       ILE  63  -3.552   5.530  -2.100
  466    HB   ILE  63           HB       ILE  63  -2.450   5.555   0.715
  467   HG12  ILE  63          2HG1      ILE  63  -2.430   3.378  -1.388
  468   HG13  ILE  63          3HG1      ILE  63  -1.045   4.374  -0.955
  469   HG21  ILE  63          2HG2      ILE  63  -4.698   3.924  -0.461
  470   HG22  ILE  63          1HG2      ILE  63  -4.864   5.227   0.716
  471   HG23  ILE  63          3HG2      ILE  63  -4.027   3.740   1.161
  472   HD11  ILE  63          3HD1      ILE  63  -2.480   2.454   0.866
  473   HD12  ILE  63          2HD1      ILE  63  -1.095   3.451   1.307
  474   HD13  ILE  63          1HD1      ILE  63  -0.920   2.187   0.089
  475    H    GLU  64           H        GLU  64  -2.755   8.022   0.313
  476    HA   GLU  64           HA       GLU  64  -5.437   8.620   0.980
  477    HB2  GLU  64           HB2      GLU  64  -3.022  10.427   1.171
  478    HB3  GLU  64           HB3      GLU  64  -4.570  10.678   1.967
  479    HG2  GLU  64           HG2      GLU  64  -4.197   8.517   3.172
  480    HG3  GLU  64           HG3      GLU  64  -2.563   8.510   2.505
  481    H    ASP  65           H        ASP  65  -3.314   9.668  -1.551
  482    HA   ASP  65           HA       ASP  65  -4.719  11.939  -2.434
  483    HB2  ASP  65           HB2      ASP  65  -2.446  11.517  -3.136
  484    HB3  ASP  65           HB3      ASP  65  -2.918  10.010  -3.911
  485    H    GLN  66           H        GLN  66  -5.378   8.572  -2.761
  486    HA   GLN  66           HA       GLN  66  -7.176   8.862  -5.006
  487    HB2  GLN  66           HB2      GLN  66  -7.033   6.535  -3.092
  488    HB3  GLN  66           HB3      GLN  66  -7.648   6.536  -4.736
  489    HG2  GLN  66           HG2      GLN  66  -5.389   6.917  -5.580
  490    HG3  GLN  66           HG3      GLN  66  -4.777   6.902  -3.924
  491   HE21  GLN  66          1HE2      GLN  66  -5.962   5.012  -6.556
  492   HE22  GLN  66          2HE2      GLN  66  -5.606   3.459  -5.877
  493    H    GLY  67           H        GLY  67  -7.340   9.693  -1.805
  494    HA2  GLY  67           HA1      GLY  67  -9.273  10.660  -0.821
  495    HA3  GLY  67           HA2      GLY  67 -10.273   9.639  -1.846
  496    H    TYR  68           H        TYR  68  -7.539   8.423  -0.053
  497    HA   TYR  68           HA       TYR  68  -9.391   7.015   1.748
  498    HB2  TYR  68           HB2      TYR  68  -6.801   6.031   0.550
  499    HB3  TYR  68           HB3      TYR  68  -7.684   5.188   1.818
  500    HD1  TYR  68           HD1      TYR  68  -9.828   4.115   1.344
  501    HD2  TYR  68           HD2      TYR  68  -7.617   6.048  -1.732
  502    HE1  TYR  68           HE1      TYR  68 -11.234   3.019  -0.349
  503    HE2  TYR  68           HE2      TYR  68  -9.016   4.957  -3.434
  504    HH   TYR  68           HH       TYR  68 -11.939   3.432  -2.698
  505    H    ASP  69           H        ASP  69  -8.627   6.552   3.870
  506    HA   ASP  69           HA       ASP  69  -6.627   8.522   4.752
  507    HB2  ASP  69           HB2      ASP  69  -8.967   8.847   5.599
  508    HB3  ASP  69           HB3      ASP  69  -8.829   7.294   6.423
  509    H    VAL  70           H        VAL  70  -4.769   7.694   5.364
  510    HA   VAL  70           HA       VAL  70  -4.729   5.026   6.585
  511    HB   VAL  70           HB       VAL  70  -2.919   5.951   4.340
  512   HG11  VAL  70          2HG1      VAL  70  -1.694   4.670   6.048
  513   HG12  VAL  70          1HG1      VAL  70  -1.816   3.796   4.521
  514   HG13  VAL  70          3HG1      VAL  70  -2.856   3.355   5.875
  515   HG21  VAL  70          3HG2      VAL  70  -4.887   3.660   4.458
  516   HG22  VAL  70          2HG2      VAL  70  -3.876   4.101   3.081
  517   HG23  VAL  70          1HG2      VAL  70  -5.157   5.193   3.619
  518    H    GLN  71           H        GLN  71  -3.763   5.114   8.464
  519    HA   GLN  71           HA       GLN  71  -2.415   5.662  10.191
  520    HB2  GLN  71           HB2      GLN  71  -0.623   5.091   8.530
  521    HB3  GLN  71           HB3      GLN  71  -0.525   6.798   8.121
  522    HG2  GLN  71           HG2      GLN  71   0.157   7.335  10.382
  523    HG3  GLN  71           HG3      GLN  71  -0.018   5.647  10.857
  524   HE21  GLN  71          1HE2      GLN  71   2.118   5.480  11.486
  525   HE22  GLN  71          2HE2      GLN  71   3.423   5.426  10.353
  Start of MODEL   17
    1    H1   SER   1           H1       SER   1  14.140  -3.955  -5.763
    2    H2   SER   1           H2       SER   1  15.816  -4.172  -5.644
    3    H3   SER   1           H3       SER   1  15.014  -3.125  -4.573
    4    HA   SER   1           HA       SER   1  13.830  -4.954  -3.596
    5    HB2  SER   1           HB2      SER   1  15.447  -6.656  -5.513
    6    HB3  SER   1           HB3      SER   1  14.353  -7.260  -4.269
    7    HG   SER   1           HG       SER   1  12.639  -6.616  -5.407
    8    H    ASN   2           H        ASN   2  16.028  -3.297  -3.009
    9    HA   ASN   2           HA       ASN   2  18.241  -4.952  -2.160
   10    HB2  ASN   2           HB2      ASN   2  18.673  -2.698  -2.986
   11    HB3  ASN   2           HB3      ASN   2  17.661  -2.018  -1.715
   12   HD21  ASN   2          1HD2      ASN   2  20.671  -3.622  -2.435
   13   HD22  ASN   2          2HD2      ASN   2  21.467  -3.218  -0.949
   14    H    ALA   3           H        ALA   3  16.077  -2.712  -0.392
   15    HA   ALA   3           HA       ALA   3  16.465  -4.415   1.991
   16    HB1  ALA   3           HB1      ALA   3  15.990  -2.434   3.337
   17    HB2  ALA   3           HB2      ALA   3  17.350  -2.146   2.252
   18    HB3  ALA   3           HB3      ALA   3  15.763  -1.481   1.871
   19    H    MET   4           H        MET   4  14.776  -5.708   2.272
   20    HA   MET   4           HA       MET   4  12.205  -4.987   1.132
   21    HB2  MET   4           HB2      MET   4  13.091  -7.513   2.530
   22    HB3  MET   4           HB3      MET   4  11.546  -7.289   1.729
   23    HG2  MET   4           HG2      MET   4  14.202  -7.112   0.331
   24    HG3  MET   4           HG3      MET   4  13.240  -8.582   0.442
   25    HE1  MET   4           HE1      MET   4  13.864  -5.249  -1.296
   26    HE2  MET   4           HE2      MET   4  12.395  -4.933  -2.222
   27    HE3  MET   4           HE3      MET   4  12.403  -4.699  -0.476
   28    H    GLU   5           H        GLU   5  11.072  -3.623   2.321
   29    HA   GLU   5           HA       GLU   5  10.808  -4.113   5.205
   30    HB2  GLU   5           HB2      GLU   5   9.927  -1.750   3.531
   31    HB3  GLU   5           HB3      GLU   5   9.779  -1.877   5.278
   32    HG2  GLU   5           HG2      GLU   5  12.418  -2.009   3.859
   33    HG3  GLU   5           HG3      GLU   5  11.692  -0.498   4.402
   34    H    GLN   6           H        GLN   6   9.244  -5.595   5.555
   35    HA   GLN   6           HA       GLN   6   6.776  -5.442   4.004
   36    HB2  GLN   6           HB2      GLN   6   7.778  -7.460   6.015
   37    HB3  GLN   6           HB3      GLN   6   6.168  -7.515   5.312
   38    HG2  GLN   6           HG2      GLN   6   7.219  -7.634   3.065
   39    HG3  GLN   6           HG3      GLN   6   8.788  -7.751   3.859
   40   HE21  GLN   6          1HE2      GLN   6   7.291  -9.617   2.118
   41   HE22  GLN   6          2HE2      GLN   6   7.212 -11.102   3.002
   42    H    LEU   7           H        LEU   7   5.274  -4.115   4.666
   43    HA   LEU   7           HA       LEU   7   4.887  -3.735   7.562
   44    HB2  LEU   7           HB2      LEU   7   4.606  -1.675   5.374
   45    HB3  LEU   7           HB3      LEU   7   4.180  -1.416   7.053
   46    HG   LEU   7           HG       LEU   7   6.969  -2.013   6.060
   47   HD11  LEU   7          2HD1      LEU   7   6.217   0.165   5.295
   48   HD12  LEU   7          1HD1      LEU   7   7.421   0.341   6.570
   49   HD13  LEU   7          3HD1      LEU   7   5.711   0.586   6.932
   50   HD21  LEU   7          3HD2      LEU   7   5.948  -1.192   8.779
   51   HD22  LEU   7          2HD2      LEU   7   7.644  -1.355   8.323
   52   HD23  LEU   7          1HD2      LEU   7   6.595  -2.774   8.342
   53    H    THR   8           H        THR   8   2.831  -3.831   8.303
   54    HA   THR   8           HA       THR   8   0.723  -4.428   6.356
   55    HB   THR   8           HB       THR   8   0.672  -4.713   9.372
   56    HG1  THR   8           HG1      THR   8   0.619  -7.082   8.284
   57   HG21  THR   8          3HG2      THR   8  -1.196  -5.780   7.248
   58   HG22  THR   8          1HG2      THR   8  -1.549  -4.457   8.360
   59   HG23  THR   8          2HG2      THR   8  -1.311  -6.091   8.980
   60    H    LEU   9           H        LEU   9  -0.159  -2.583   5.639
   61    HA   LEU   9           HA       LEU   9  -0.602  -0.363   7.486
   62    HB2  LEU   9           HB2      LEU   9  -1.156  -0.579   4.517
   63    HB3  LEU   9           HB3      LEU   9  -1.395   0.855   5.481
   64    HG   LEU   9           HG       LEU   9   1.081   0.888   5.921
   65   HD11  LEU   9          2HD1      LEU   9   1.138  -1.192   3.734
   66   HD12  LEU   9          1HD1      LEU   9   1.569  -1.462   5.422
   67   HD13  LEU   9          3HD1      LEU   9   2.537  -0.372   4.429
   68   HD21  LEU   9          3HD2      LEU   9   0.157   1.054   3.056
   69   HD22  LEU   9          2HD2      LEU   9   1.620   1.797   3.710
   70   HD23  LEU   9          1HD2      LEU   9   0.035   2.332   4.269
   71    H    GLN  10           H        GLN  10  -2.795   0.713   7.332
   72    HA   GLN  10           HA       GLN  10  -4.902  -1.320   7.062
   73    HB2  GLN  10           HB2      GLN  10  -6.180   0.015   8.734
   74    HB3  GLN  10           HB3      GLN  10  -4.733  -0.738   9.375
   75    HG2  GLN  10           HG2      GLN  10  -3.550   1.357   9.266
   76    HG3  GLN  10           HG3      GLN  10  -4.958   2.143   8.554
   77   HE21  GLN  10          1HE2      GLN  10  -5.085   3.626  10.248
   78   HE22  GLN  10          2HE2      GLN  10  -5.671   3.171  11.817
   79    H    VAL  11           H        VAL  11  -6.854  -0.687   6.100
   80    HA   VAL  11           HA       VAL  11  -6.526   1.667   4.367
   81    HB   VAL  11           HB       VAL  11  -8.434  -0.620   3.907
   82   HG11  VAL  11          2HG1      VAL  11  -7.268   1.462   2.062
   83   HG12  VAL  11          1HG1      VAL  11  -8.917   1.425   2.687
   84   HG13  VAL  11          3HG1      VAL  11  -8.363   0.165   1.586
   85   HG21  VAL  11          3HG2      VAL  11  -6.774  -1.546   2.346
   86   HG22  VAL  11          2HG2      VAL  11  -6.207  -1.567   4.019
   87   HG23  VAL  11          1HG2      VAL  11  -5.607  -0.343   2.896
   88    H    GLU  12           H        GLU  12  -7.590   3.366   5.179
   89    HA   GLU  12           HA       GLU  12 -10.172   2.939   6.484
   90    HB2  GLU  12           HB2      GLU  12  -8.407   4.376   7.556
   91    HB3  GLU  12           HB3      GLU  12  -8.605   5.508   6.226
   92    HG2  GLU  12           HG2      GLU  12  -9.839   6.199   8.212
   93    HG3  GLU  12           HG3      GLU  12 -10.912   5.886   6.847
   94    H    GLY  13           H        GLY  13 -11.810   2.839   5.100
   95    HA2  GLY  13           HA1      GLY  13 -13.166   4.633   3.836
   96    HA3  GLY  13           HA2      GLY  13 -11.796   4.586   2.733
   97    H    MET  14           H        MET  14 -11.630   2.969   1.276
   98    HA   MET  14           HA       MET  14 -12.198   1.291  -0.097
   99    HB2  MET  14           HB2      MET  14 -13.187   0.198   2.516
  100    HB3  MET  14           HB3      MET  14 -13.373  -0.682   1.015
  101    HG2  MET  14           HG2      MET  14 -10.951  -0.655   0.694
  102    HG3  MET  14           HG3      MET  14 -10.773   0.204   2.224
  103    HE1  MET  14           HE1      MET  14  -9.464  -2.705   1.246
  104    HE2  MET  14           HE2      MET  14  -8.987  -1.856   2.716
  105    HE3  MET  14           HE3      MET  14  -9.487  -3.546   2.797
  106    H    SER  15           H        SER  15 -14.217  -0.241  -0.621
  107    HA   SER  15           HA       SER  15 -16.758   1.079  -0.248
  108    HB2  SER  15           HB2      SER  15 -15.983   2.267  -2.208
  109    HB3  SER  15           HB3      SER  15 -15.517   0.757  -2.992
  110    HG   SER  15           HG       SER  15 -17.855   1.991  -3.107
  111    H    CYS  16           H        CYS  16 -15.546  -1.277  -2.658
  112    HA   CYS  16           HA       CYS  16 -16.728  -3.453  -1.159
  113    HB2  CYS  16           HB2      CYS  16 -18.633  -2.542  -2.453
  114    HB3  CYS  16           HB3      CYS  16 -17.728  -2.812  -3.939
  115    HG   CYS  16           HG       CYS  16 -18.811  -5.248  -1.787
  116    H    GLY  17           H        GLY  17 -15.875  -3.038  -4.616
  117    HA2  GLY  17           HA1      GLY  17 -13.808  -5.109  -4.190
  118    HA3  GLY  17           HA2      GLY  17 -14.919  -5.176  -5.552
  119    H    HIS  18           H        HIS  18 -14.906  -2.560  -6.423
  120    HA   HIS  18           HA       HIS  18 -12.647  -2.404  -8.024
  121    HB2  HIS  18           HB2      HIS  18 -14.537  -0.219  -7.143
  122    HB3  HIS  18           HB3      HIS  18 -13.272   0.034  -8.339
  123    HD1  HIS  18           HD1      HIS  18 -13.474  -1.940 -10.381
  124    HD2  HIS  18           HD2      HIS  18 -16.890  -0.782  -8.308
  125    HE1  HIS  18           HE1      HIS  18 -15.407  -2.546 -11.864
  126    HE2  HIS  18           HE2      HIS  18 -17.462  -2.034 -10.503
  127    H    CYS  19           H        CYS  19 -13.227  -1.022  -4.851
  128    HA   CYS  19           HA       CYS  19 -11.000   0.666  -4.685
  129    HB2  CYS  19           HB2      CYS  19 -11.285   0.427  -2.216
  130    HB3  CYS  19           HB3      CYS  19 -12.778   0.815  -3.063
  131    HG   CYS  19           HG       CYS  19 -11.955  -2.367  -2.099
  132    H    VAL  20           H        VAL  20 -11.275  -2.785  -4.410
  133    HA   VAL  20           HA       VAL  20  -8.936  -3.331  -2.932
  134    HB   VAL  20           HB       VAL  20 -10.348  -5.053  -4.984
  135   HG11  VAL  20          2HG1      VAL  20  -8.081  -5.844  -4.597
  136   HG12  VAL  20          1HG1      VAL  20  -9.255  -6.949  -3.886
  137   HG13  VAL  20          3HG1      VAL  20  -8.359  -5.832  -2.856
  138   HG21  VAL  20          3HG2      VAL  20 -11.795  -4.384  -3.136
  139   HG22  VAL  20          2HG2      VAL  20 -10.603  -4.979  -1.980
  140   HG23  VAL  20          1HG2      VAL  20 -11.422  -6.106  -3.060
  141    H    ASN  21           H        ASN  21  -9.520  -3.423  -6.455
  142    HA   ASN  21           HA       ASN  21  -6.810  -3.863  -7.137
  143    HB2  ASN  21           HB2      ASN  21  -8.646  -4.327  -8.706
  144    HB3  ASN  21           HB3      ASN  21  -9.008  -2.606  -8.797
  145   HD21  ASN  21          1HD2      ASN  21  -5.820  -4.139  -8.741
  146   HD22  ASN  21          2HD2      ASN  21  -5.350  -3.610 -10.319
  147    H    ALA  22           H        ALA  22  -8.751  -0.965  -6.696
  148    HA   ALA  22           HA       ALA  22  -7.012   0.934  -7.752
  149    HB1  ALA  22           HB1      ALA  22  -8.900   1.237  -5.423
  150    HB2  ALA  22           HB2      ALA  22  -8.173   2.556  -6.341
  151    HB3  ALA  22           HB3      ALA  22  -9.301   1.452  -7.127
  152    H    ILE  23           H        ILE  23  -7.315  -0.055  -4.320
  153    HA   ILE  23           HA       ILE  23  -5.107   1.505  -3.475
  154    HB   ILE  23           HB       ILE  23  -6.779   0.825  -1.861
  155   HG12  ILE  23          2HG1      ILE  23  -5.279  -0.113  -0.085
  156   HG13  ILE  23          3HG1      ILE  23  -4.056  -0.372  -1.328
  157   HG21  ILE  23          2HG2      ILE  23  -5.826  -1.998  -2.297
  158   HG22  ILE  23          1HG2      ILE  23  -7.376  -1.338  -2.820
  159   HG23  ILE  23          3HG2      ILE  23  -7.008  -1.471  -1.100
  160   HD11  ILE  23          3HD1      ILE  23  -5.215   2.284  -0.525
  161   HD12  ILE  23          2HD1      ILE  23  -3.993   2.021  -1.770
  162   HD13  ILE  23          1HD1      ILE  23  -3.626   1.658  -0.082
  163    H    GLU  24           H        GLU  24  -5.423  -1.824  -4.572
  164    HA   GLU  24           HA       GLU  24  -2.917  -2.815  -3.939
  165    HB2  GLU  24           HB2      GLU  24  -4.572  -4.271  -4.879
  166    HB3  GLU  24           HB3      GLU  24  -4.657  -3.317  -6.356
  167    HG2  GLU  24           HG2      GLU  24  -2.358  -3.962  -6.892
  168    HG3  GLU  24           HG3      GLU  24  -2.297  -4.933  -5.424
  169    H    SER  25           H        SER  25  -3.867  -1.189  -6.985
  170    HA   SER  25           HA       SER  25  -1.175  -1.008  -7.874
  171    HB2  SER  25           HB2      SER  25  -2.098   0.643  -9.540
  172    HB3  SER  25           HB3      SER  25  -2.819  -0.971  -9.583
  173    HG   SER  25           HG       SER  25  -3.971   1.112  -8.047
  174    H    SER  26           H        SER  26  -3.240   1.048  -5.945
  175    HA   SER  26           HA       SER  26  -1.941   3.481  -6.205
  176    HB2  SER  26           HB2      SER  26  -4.022   3.205  -4.929
  177    HB3  SER  26           HB3      SER  26  -3.152   2.302  -3.690
  178    HG   SER  26           HG       SER  26  -1.806   4.486  -3.907
  179    H    VAL  27           H        VAL  27  -1.125   0.706  -4.167
  180    HA   VAL  27           HA       VAL  27   1.355   1.951  -3.312
  181    HB   VAL  27           HB       VAL  27   0.529  -0.941  -3.010
  182   HG11  VAL  27          2HG1      VAL  27   2.901  -0.528  -2.672
  183   HG12  VAL  27          1HG1      VAL  27   2.112  -0.925  -1.144
  184   HG13  VAL  27          3HG1      VAL  27   2.525   0.750  -1.516
  185   HG21  VAL  27          3HG2      VAL  27   0.067   1.371  -1.125
  186   HG22  VAL  27          2HG2      VAL  27  -0.237  -0.329  -0.761
  187   HG23  VAL  27          1HG2      VAL  27  -1.174   0.484  -2.015
  188    H    LYS  28           H        LYS  28   0.353  -0.647  -5.504
  189    HA   LYS  28           HA       LYS  28   2.905  -1.650  -6.076
  190    HB2  LYS  28           HB2      LYS  28   0.882  -2.930  -6.450
  191    HB3  LYS  28           HB3      LYS  28   0.351  -1.786  -7.670
  192    HG2  LYS  28           HG2      LYS  28   1.202  -3.777  -8.712
  193    HG3  LYS  28           HG3      LYS  28   2.254  -2.408  -9.074
  194    HD2  LYS  28           HD2      LYS  28   3.758  -3.150  -7.247
  195    HD3  LYS  28           HD3      LYS  28   2.734  -4.576  -7.034
  196    HE2  LYS  28           HE2      LYS  28   3.126  -5.098  -9.442
  197    HE3  LYS  28           HE3      LYS  28   4.317  -3.798  -9.472
  198    HZ1  LYS  28           HZ1      LYS  28   5.387  -5.920  -9.110
  199    HZ2  LYS  28           HZ2      LYS  28   4.419  -6.216  -7.752
  200    HZ3  LYS  28           HZ3      LYS  28   5.548  -4.954  -7.727
  201    H    GLU  29           H        GLU  29   1.144   1.004  -7.557
  202    HA   GLU  29           HA       GLU  29   2.685   1.198  -9.924
  203    HB2  GLU  29           HB2      GLU  29   0.953   3.139  -8.428
  204    HB3  GLU  29           HB3      GLU  29   1.833   3.619  -9.874
  205    HG2  GLU  29           HG2      GLU  29   0.045   1.230  -9.853
  206    HG3  GLU  29           HG3      GLU  29  -0.597   2.851 -10.126
  207    H    LEU  30           H        LEU  30   3.282   2.015  -6.686
  208    HA   LEU  30           HA       LEU  30   5.207   4.076  -7.080
  209    HB2  LEU  30           HB2      LEU  30   4.461   2.300  -4.798
  210    HB3  LEU  30           HB3      LEU  30   5.977   3.170  -4.711
  211    HG   LEU  30           HG       LEU  30   4.115   4.312  -3.542
  212   HD11  LEU  30          2HD1      LEU  30   6.002   5.594  -4.343
  213   HD12  LEU  30          1HD1      LEU  30   4.513   6.526  -4.500
  214   HD13  LEU  30          3HD1      LEU  30   5.235   5.772  -5.920
  215   HD21  LEU  30          3HD2      LEU  30   2.302   3.644  -5.055
  216   HD22  LEU  30          2HD2      LEU  30   2.978   4.685  -6.307
  217   HD23  LEU  30          1HD2      LEU  30   2.357   5.390  -4.814
  218    H    ASN  31           H        ASN  31   7.246   3.973  -7.703
  219    HA   ASN  31           HA       ASN  31   8.432   1.532  -8.544
  220    HB2  ASN  31           HB2      ASN  31   8.893   3.788  -9.546
  221    HB3  ASN  31           HB3      ASN  31   9.813   4.189  -8.099
  222   HD21  ASN  31          1HD2      ASN  31  11.735   4.447  -9.234
  223   HD22  ASN  31          2HD2      ASN  31  12.598   3.105  -9.917
  224    H    GLY  32           H        GLY  32   9.201   0.023  -7.211
  225    HA2  GLY  32           HA1      GLY  32  11.173  -0.379  -5.725
  226    HA3  GLY  32           HA2      GLY  32  10.516   0.909  -4.722
  227    H    VAL  33           H        VAL  33   7.811  -0.449  -5.720
  228    HA   VAL  33           HA       VAL  33   7.565  -2.001  -3.285
  229    HB   VAL  33           HB       VAL  33   5.505  -1.166  -5.330
  230   HG11  VAL  33          2HG1      VAL  33   4.841  -3.274  -4.323
  231   HG12  VAL  33          1HG1      VAL  33   3.836  -1.961  -3.709
  232   HG13  VAL  33          3HG1      VAL  33   5.132  -2.620  -2.711
  233   HG21  VAL  33          3HG2      VAL  33   4.722   0.286  -3.481
  234   HG22  VAL  33          2HG2      VAL  33   6.351   0.680  -4.031
  235   HG23  VAL  33          1HG2      VAL  33   6.122  -0.223  -2.535
  236    H    GLU  34           H        GLU  34   7.574  -4.108  -3.151
  237    HA   GLU  34           HA       GLU  34   8.101  -5.707  -5.488
  238    HB2  GLU  34           HB2      GLU  34   7.746  -6.498  -2.591
  239    HB3  GLU  34           HB3      GLU  34   8.306  -7.562  -3.872
  240    HG2  GLU  34           HG2      GLU  34   9.711  -5.054  -2.997
  241    HG3  GLU  34           HG3      GLU  34  10.109  -6.682  -2.449
  242    H    GLN  35           H        GLN  35   5.746  -6.078  -2.844
  243    HA   GLN  35           HA       GLN  35   3.754  -6.958  -4.793
  244    HB2  GLN  35           HB2      GLN  35   3.138  -8.881  -3.415
  245    HB3  GLN  35           HB3      GLN  35   4.815  -8.996  -3.939
  246    HG2  GLN  35           HG2      GLN  35   5.570  -8.235  -1.785
  247    HG3  GLN  35           HG3      GLN  35   3.908  -8.027  -1.243
  248   HE21  GLN  35          1HE2      GLN  35   6.410 -10.320  -2.004
  249   HE22  GLN  35          2HE2      GLN  35   5.646 -11.696  -1.288
  250    H    VAL  36           H        VAL  36   1.592  -6.761  -4.086
  251    HA   VAL  36           HA       VAL  36   1.190  -5.294  -1.564
  252    HB   VAL  36           HB       VAL  36  -0.184  -4.600  -4.168
  253   HG11  VAL  36          2HG1      VAL  36  -1.563  -4.224  -2.187
  254   HG12  VAL  36          1HG1      VAL  36  -1.093  -2.700  -2.937
  255   HG13  VAL  36          3HG1      VAL  36  -0.278  -3.249  -1.472
  256   HG21  VAL  36          3HG2      VAL  36   2.169  -3.920  -4.200
  257   HG22  VAL  36          2HG2      VAL  36   1.934  -3.050  -2.685
  258   HG23  VAL  36          1HG2      VAL  36   1.087  -2.529  -4.143
  259    H    LYS  37           H        LYS  37  -0.139  -6.492  -0.347
  260    HA   LYS  37           HA       LYS  37  -2.349  -7.880  -1.721
  261    HB2  LYS  37           HB2      LYS  37  -0.657  -9.385  -0.609
  262    HB3  LYS  37           HB3      LYS  37  -1.137  -8.673   0.926
  263    HG2  LYS  37           HG2      LYS  37  -3.391  -9.498   0.653
  264    HG3  LYS  37           HG3      LYS  37  -2.983 -10.153  -0.934
  265    HD2  LYS  37           HD2      LYS  37  -1.739 -10.987   1.685
  266    HD3  LYS  37           HD3      LYS  37  -2.980 -11.883   0.807
  267    HE2  LYS  37           HE2      LYS  37  -0.246 -11.206  -0.270
  268    HE3  LYS  37           HE3      LYS  37  -0.696 -12.757   0.435
  269    HZ1  LYS  37           HZ1      LYS  37  -0.768 -12.693  -2.028
  270    HZ2  LYS  37           HZ2      LYS  37  -2.035 -11.571  -1.939
  271    HZ3  LYS  37           HZ3      LYS  37  -2.241 -13.136  -1.317
  272    H    VAL  38           H        VAL  38  -3.924  -6.360  -1.537
  273    HA   VAL  38           HA       VAL  38  -4.460  -5.171   1.051
  274    HB   VAL  38           HB       VAL  38  -4.878  -3.724  -0.806
  275   HG11  VAL  38          2HG1      VAL  38  -6.640  -4.228  -2.481
  276   HG12  VAL  38          1HG1      VAL  38  -6.713  -5.873  -1.851
  277   HG13  VAL  38          3HG1      VAL  38  -5.230  -5.275  -2.596
  278   HG21  VAL  38          3HG2      VAL  38  -7.489  -4.672   0.362
  279   HG22  VAL  38          2HG2      VAL  38  -7.222  -3.122  -0.435
  280   HG23  VAL  38          1HG2      VAL  38  -6.391  -3.491   1.075
  281    H    GLN  39           H        GLN  39  -5.565  -6.106   2.541
  282    HA   GLN  39           HA       GLN  39  -7.127  -8.476   1.943
  283    HB2  GLN  39           HB2      GLN  39  -5.615  -7.518   4.172
  284    HB3  GLN  39           HB3      GLN  39  -7.273  -7.774   4.698
  285    HG2  GLN  39           HG2      GLN  39  -5.558  -9.816   3.305
  286    HG3  GLN  39           HG3      GLN  39  -5.860  -9.742   5.041
  287   HE21  GLN  39          1HE2      GLN  39  -6.465 -11.852   3.121
  288   HE22  GLN  39          2HE2      GLN  39  -8.176 -12.122   3.244
  289    H    LEU  40           H        LEU  40  -9.160  -8.107   1.279
  290    HA   LEU  40           HA       LEU  40 -10.534  -5.664   1.929
  291    HB2  LEU  40           HB2      LEU  40 -10.666  -7.051  -0.243
  292    HB3  LEU  40           HB3      LEU  40 -11.761  -8.094   0.635
  293    HG   LEU  40           HG       LEU  40 -12.794  -6.325  -0.895
  294   HD11  LEU  40          2HD1      LEU  40 -14.097  -7.551   0.774
  295   HD12  LEU  40          1HD1      LEU  40 -14.642  -5.881   0.631
  296   HD13  LEU  40          3HD1      LEU  40 -13.644  -6.369   2.000
  297   HD21  LEU  40          3HD2      LEU  40 -11.356  -4.462  -0.249
  298   HD22  LEU  40          2HD2      LEU  40 -11.996  -4.528   1.395
  299   HD23  LEU  40          1HD2      LEU  40 -13.053  -4.094   0.052
  300    H    ALA  41           H        ALA  41 -10.460  -8.915   3.136
  301    HA   ALA  41           HA       ALA  41 -12.925  -8.732   4.600
  302    HB1  ALA  41           HB1      ALA  41 -12.092 -10.889   3.823
  303    HB2  ALA  41           HB2      ALA  41 -10.662 -10.712   4.841
  304    HB3  ALA  41           HB3      ALA  41 -12.257 -10.869   5.580
  305    H    GLU  42           H        GLU  42  -9.513  -8.249   5.279
  306    HA   GLU  42           HA       GLU  42 -10.046  -7.762   8.096
  307    HB2  GLU  42           HB2      GLU  42  -7.524  -7.813   6.455
  308    HB3  GLU  42           HB3      GLU  42  -7.539  -7.250   8.120
  309    HG2  GLU  42           HG2      GLU  42  -8.409  -9.419   8.840
  310    HG3  GLU  42           HG3      GLU  42  -8.371  -9.982   7.169
  311    H    GLY  43           H        GLY  43  -9.379  -5.956   5.175
  312    HA2  GLY  43           HA1      GLY  43  -9.800  -3.683   4.821
  313    HA3  GLY  43           HA2      GLY  43 -10.031  -3.479   6.553
  314    H    THR  44           H        THR  44  -7.256  -5.011   5.036
  315    HA   THR  44           HA       THR  44  -5.587  -2.759   5.899
  316    HB   THR  44           HB       THR  44  -3.897  -4.530   6.671
  317    HG1  THR  44           HG1      THR  44  -5.137  -6.447   7.493
  318   HG21  THR  44          3HG2      THR  44  -5.044  -3.056   8.233
  319   HG22  THR  44          1HG2      THR  44  -4.911  -4.680   8.908
  320   HG23  THR  44          2HG2      THR  44  -6.447  -4.126   8.241
  321    H    VAL  45           H        VAL  45  -3.193  -3.325   5.212
  322    HA   VAL  45           HA       VAL  45  -3.170  -4.517   2.541
  323    HB   VAL  45           HB       VAL  45  -1.517  -2.293   2.249
  324   HG11  VAL  45          2HG1      VAL  45  -2.876  -3.275   0.508
  325   HG12  VAL  45          1HG1      VAL  45  -3.245  -1.555   0.644
  326   HG13  VAL  45          3HG1      VAL  45  -4.350  -2.752   1.324
  327   HG21  VAL  45          3HG2      VAL  45  -2.486  -1.217   4.201
  328   HG22  VAL  45          2HG2      VAL  45  -4.111  -1.470   3.561
  329   HG23  VAL  45          1HG2      VAL  45  -2.995  -0.382   2.734
  330    H    GLU  46           H        GLU  46  -1.748  -6.096   2.800
  331    HA   GLU  46           HA       GLU  46   0.657  -5.680   4.396
  332    HB2  GLU  46           HB2      GLU  46  -0.246  -8.154   2.905
  333    HB3  GLU  46           HB3      GLU  46   1.035  -8.062   4.106
  334    HG2  GLU  46           HG2      GLU  46  -0.634  -7.436   5.805
  335    HG3  GLU  46           HG3      GLU  46  -1.902  -7.624   4.595
  336    H    VAL  47           H        VAL  47   2.294  -4.692   3.404
  337    HA   VAL  47           HA       VAL  47   2.705  -5.239   0.535
  338    HB   VAL  47           HB       VAL  47   3.111  -2.579   1.913
  339   HG11  VAL  47          2HG1      VAL  47   3.288  -3.344  -0.996
  340   HG12  VAL  47          1HG1      VAL  47   4.640  -2.926   0.058
  341   HG13  VAL  47          3HG1      VAL  47   3.430  -1.709  -0.351
  342   HG21  VAL  47          3HG2      VAL  47   1.176  -1.802   0.644
  343   HG22  VAL  47          2HG2      VAL  47   0.737  -3.121   1.729
  344   HG23  VAL  47          1HG2      VAL  47   0.936  -3.427   0.003
  345    H    THR  48           H        THR  48   4.745  -5.606  -0.135
  346    HA   THR  48           HA       THR  48   6.942  -5.295   1.807
  347    HB   THR  48           HB       THR  48   6.988  -6.944  -0.736
  348    HG1  THR  48           HG1      THR  48   5.717  -7.455   1.590
  349   HG21  THR  48          3HG2      THR  48   8.918  -8.028   0.332
  350   HG22  THR  48          1HG2      THR  48   8.765  -6.938   1.712
  351   HG23  THR  48          2HG2      THR  48   9.183  -6.299   0.124
  352    H    ILE  49           H        ILE  49   8.122  -3.491   1.463
  353    HA   ILE  49           HA       ILE  49   8.308  -2.491  -1.310
  354    HB   ILE  49           HB       ILE  49   8.618  -0.251  -0.435
  355   HG12  ILE  49          2HG1      ILE  49   8.071  -1.309   2.339
  356   HG13  ILE  49          3HG1      ILE  49   9.707  -1.111   1.725
  357   HG21  ILE  49          2HG2      ILE  49   6.348  -0.959  -0.874
  358   HG22  ILE  49          1HG2      ILE  49   6.386   0.122   0.522
  359   HG23  ILE  49          3HG2      ILE  49   6.211  -1.618   0.757
  360   HD11  ILE  49          3HD1      ILE  49   7.659   1.068   2.055
  361   HD12  ILE  49          2HD1      ILE  49   9.285   1.277   1.402
  362   HD13  ILE  49          1HD1      ILE  49   9.066   0.779   3.080
  363    H    ASP  50           H        ASP  50  10.282  -1.432  -1.905
  364    HA   ASP  50           HA       ASP  50  12.631  -2.311  -0.377
  365    HB2  ASP  50           HB2      ASP  50  12.535  -2.703  -2.888
  366    HB3  ASP  50           HB3      ASP  50  12.573  -0.955  -3.084
  367    H    SER  51           H        SER  51  13.030  -0.866   1.211
  368    HA   SER  51           HA       SER  51  12.289   1.897   0.912
  369    HB2  SER  51           HB2      SER  51  11.955   0.890   3.056
  370    HB3  SER  51           HB3      SER  51  13.636   0.388   3.153
  371    HG   SER  51           HG       SER  51  13.785   2.937   2.818
  372    H    SER  52           H        SER  52  14.857   0.222  -0.241
  373    HA   SER  52           HA       SER  52  16.760   2.405   0.051
  374    HB2  SER  52           HB2      SER  52  16.903  -0.198  -1.491
  375    HB3  SER  52           HB3      SER  52  18.212   0.982  -1.401
  376    HG   SER  52           HG       SER  52  18.244  -0.847   0.153
  377    H    VAL  53           H        VAL  53  14.060   1.887  -1.677
  378    HA   VAL  53           HA       VAL  53  14.991   3.566  -3.906
  379    HB   VAL  53           HB       VAL  53  13.002   1.295  -4.073
  380   HG11  VAL  53          2HG1      VAL  53  13.919   3.199  -6.228
  381   HG12  VAL  53          1HG1      VAL  53  12.333   3.210  -5.451
  382   HG13  VAL  53          3HG1      VAL  53  12.825   1.831  -6.441
  383   HG21  VAL  53          3HG2      VAL  53  15.696   1.626  -5.390
  384   HG22  VAL  53          2HG2      VAL  53  14.604   0.253  -5.571
  385   HG23  VAL  53          1HG2      VAL  53  15.358   0.584  -4.009
  386    H    VAL  54           H        VAL  54  12.005   2.351  -2.377
  387    HA   VAL  54           HA       VAL  54  10.899   5.069  -2.635
  388    HB   VAL  54           HB       VAL  54   9.721   3.349  -3.983
  389   HG11  VAL  54          2HG1      VAL  54   9.060   2.113  -1.317
  390   HG12  VAL  54          1HG1      VAL  54  10.070   1.409  -2.581
  391   HG13  VAL  54          3HG1      VAL  54   8.347   1.657  -2.865
  392   HG21  VAL  54          3HG2      VAL  54   8.119   4.522  -1.718
  393   HG22  VAL  54          2HG2      VAL  54   7.444   3.885  -3.218
  394   HG23  VAL  54          1HG2      VAL  54   8.500   5.298  -3.255
  395    H    THR  55           H        THR  55   9.821   5.966  -0.837
  396    HA   THR  55           HA       THR  55  10.244   4.496   1.672
  397    HB   THR  55           HB       THR  55  10.026   6.712   2.808
  398    HG1  THR  55           HG1      THR  55   9.629   7.523   0.159
  399   HG21  THR  55          3HG2      THR  55  12.225   6.466   0.753
  400   HG22  THR  55          1HG2      THR  55  12.222   5.765   2.372
  401   HG23  THR  55          2HG2      THR  55  12.268   7.517   2.170
  402    H    LEU  56           H        LEU  56   8.581   5.007   3.391
  403    HA   LEU  56           HA       LEU  56   6.121   4.003   2.477
  404    HB2  LEU  56           HB2      LEU  56   7.006   3.672   4.749
  405    HB3  LEU  56           HB3      LEU  56   6.757   5.375   5.091
  406    HG   LEU  56           HG       LEU  56   4.314   5.045   4.780
  407   HD11  LEU  56          2HD1      LEU  56   3.411   2.782   4.714
  408   HD12  LEU  56          1HD1      LEU  56   5.042   2.124   4.602
  409   HD13  LEU  56          3HD1      LEU  56   4.397   3.111   3.289
  410   HD21  LEU  56          3HD2      LEU  56   5.594   3.234   6.824
  411   HD22  LEU  56          2HD2      LEU  56   3.944   3.857   6.878
  412   HD23  LEU  56          1HD2      LEU  56   5.311   4.966   7.008
  413    H    LYS  57           H        LYS  57   7.139   7.292   3.284
  414    HA   LYS  57           HA       LYS  57   4.581   8.455   3.349
  415    HB2  LYS  57           HB2      LYS  57   7.037   9.347   3.958
  416    HB3  LYS  57           HB3      LYS  57   6.841  10.117   2.389
  417    HG2  LYS  57           HG2      LYS  57   4.787  10.352   4.564
  418    HG3  LYS  57           HG3      LYS  57   6.156  11.454   4.431
  419    HD2  LYS  57           HD2      LYS  57   5.417  12.109   2.195
  420    HD3  LYS  57           HD3      LYS  57   4.064  10.977   2.303
  421    HE2  LYS  57           HE2      LYS  57   4.505  13.231   4.251
  422    HE3  LYS  57           HE3      LYS  57   3.508  13.383   2.804
  423    HZ1  LYS  57           HZ1      LYS  57   2.010  11.762   3.614
  424    HZ2  LYS  57           HZ2      LYS  57   2.287  12.827   4.905
  425    HZ3  LYS  57           HZ3      LYS  57   3.042  11.311   4.881
  426    H    ASP  58           H        ASP  58   6.812   7.891   0.656
  427    HA   ASP  58           HA       ASP  58   5.517   9.375  -1.337
  428    HB2  ASP  58           HB2      ASP  58   6.847   6.665  -1.652
  429    HB3  ASP  58           HB3      ASP  58   6.457   7.768  -2.962
  430    H    ILE  59           H        ILE  59   5.105   6.025  -0.366
  431    HA   ILE  59           HA       ILE  59   2.998   5.375  -2.100
  432    HB   ILE  59           HB       ILE  59   3.642   4.156   0.589
  433   HG12  ILE  59          2HG1      ILE  59   4.639   3.388  -2.164
  434   HG13  ILE  59          3HG1      ILE  59   5.583   4.264  -0.963
  435   HG21  ILE  59          2HG2      ILE  59   2.185   3.030  -1.800
  436   HG22  ILE  59          1HG2      ILE  59   1.460   3.494  -0.260
  437   HG23  ILE  59          3HG2      ILE  59   2.593   2.144  -0.329
  438   HD11  ILE  59          3HD1      ILE  59   5.492   2.361   0.527
  439   HD12  ILE  59          2HD1      ILE  59   6.148   1.895  -1.043
  440   HD13  ILE  59          1HD1      ILE  59   4.482   1.487  -0.627
  441    H    VAL  60           H        VAL  60   2.999   6.347   1.324
  442    HA   VAL  60           HA       VAL  60   0.256   6.291   1.773
  443    HB   VAL  60           HB       VAL  60   2.332   8.142   2.957
  444   HG11  VAL  60          2HG1      VAL  60   0.739   8.528   4.770
  445   HG12  VAL  60          1HG1      VAL  60  -0.476   7.589   3.905
  446   HG13  VAL  60          3HG1      VAL  60   0.110   9.109   3.228
  447   HG21  VAL  60          3HG2      VAL  60   2.762   5.795   3.395
  448   HG22  VAL  60          2HG2      VAL  60   1.107   5.578   3.962
  449   HG23  VAL  60          1HG2      VAL  60   2.222   6.600   4.869
  450    H    ALA  61           H        ALA  61   2.265   8.925   0.504
  451    HA   ALA  61           HA       ALA  61   0.298  10.895   0.321
  452    HB1  ALA  61           HB1      ALA  61   2.682  11.348   0.037
  453    HB2  ALA  61           HB2      ALA  61   2.670  10.472  -1.495
  454    HB3  ALA  61           HB3      ALA  61   1.746  11.966  -1.325
  455    H    VAL  62           H        VAL  62   1.219   8.355  -1.976
  456    HA   VAL  62           HA       VAL  62  -0.658   9.168  -3.974
  457    HB   VAL  62           HB       VAL  62   0.701   6.490  -3.609
  458   HG11  VAL  62          2HG1      VAL  62  -1.277   6.324  -5.033
  459   HG12  VAL  62          1HG1      VAL  62   0.199   6.136  -5.981
  460   HG13  VAL  62          3HG1      VAL  62  -0.688   7.660  -6.019
  461   HG21  VAL  62          3HG2      VAL  62   2.261   7.310  -5.322
  462   HG22  VAL  62          2HG2      VAL  62   2.301   8.301  -3.864
  463   HG23  VAL  62          1HG2      VAL  62   1.450   8.877  -5.298
  464    H    ILE  63           H        ILE  63  -0.706   6.761  -1.375
  465    HA   ILE  63           HA       ILE  63  -3.109   5.484  -2.056
  466    HB   ILE  63           HB       ILE  63  -1.820   5.858   0.648
  467   HG12  ILE  63          2HG1      ILE  63  -1.903   3.485  -1.234
  468   HG13  ILE  63          3HG1      ILE  63  -0.518   4.544  -0.986
  469   HG21  ILE  63          2HG2      ILE  63  -4.192   5.464   0.954
  470   HG22  ILE  63          1HG2      ILE  63  -3.272   4.033   1.420
  471   HG23  ILE  63          3HG2      ILE  63  -4.121   4.070  -0.126
  472   HD11  ILE  63          3HD1      ILE  63  -0.400   3.833   1.349
  473   HD12  ILE  63          2HD1      ILE  63  -0.259   2.471   0.237
  474   HD13  ILE  63          1HD1      ILE  63  -1.777   2.763   1.085
  475    H    GLU  64           H        GLU  64  -2.537   8.207   0.176
  476    HA   GLU  64           HA       GLU  64  -5.253   8.444   0.938
  477    HB2  GLU  64           HB2      GLU  64  -3.090  10.551   1.019
  478    HB3  GLU  64           HB3      GLU  64  -4.615  10.599   1.895
  479    HG2  GLU  64           HG2      GLU  64  -3.897   8.484   3.059
  480    HG3  GLU  64           HG3      GLU  64  -2.314   8.714   2.311
  481    H    ASP  65           H        ASP  65  -3.418   9.625  -1.734
  482    HA   ASP  65           HA       ASP  65  -5.199  11.627  -2.640
  483    HB2  ASP  65           HB2      ASP  65  -2.936  11.561  -3.474
  484    HB3  ASP  65           HB3      ASP  65  -3.162   9.929  -4.092
  485    H    GLN  66           H        GLN  66  -5.224   8.178  -2.775
  486    HA   GLN  66           HA       GLN  66  -7.206   8.022  -4.878
  487    HB2  GLN  66           HB2      GLN  66  -6.199   5.867  -3.009
  488    HB3  GLN  66           HB3      GLN  66  -7.146   5.615  -4.469
  489    HG2  GLN  66           HG2      GLN  66  -4.380   6.789  -4.370
  490    HG3  GLN  66           HG3      GLN  66  -4.767   5.117  -4.775
  491   HE21  GLN  66          1HE2      GLN  66  -3.442   7.200  -6.317
  492   HE22  GLN  66          2HE2      GLN  66  -4.343   7.354  -7.786
  493    H    GLY  67           H        GLY  67  -7.287   8.831  -1.664
  494    HA2  GLY  67           HA1      GLY  67  -9.322   9.488  -0.629
  495    HA3  GLY  67           HA2      GLY  67 -10.167   8.282  -1.585
  496    H    TYR  68           H        TYR  68  -7.260   7.858   0.401
  497    HA   TYR  68           HA       TYR  68  -8.858   6.337   2.330
  498    HB2  TYR  68           HB2      TYR  68  -6.206   5.339   1.282
  499    HB3  TYR  68           HB3      TYR  68  -7.277   4.523   2.408
  500    HD1  TYR  68           HD1      TYR  68  -9.500   3.671   1.590
  501    HD2  TYR  68           HD2      TYR  68  -6.483   5.068  -1.061
  502    HE1  TYR  68           HE1      TYR  68 -10.603   2.505  -0.273
  503    HE2  TYR  68           HE2      TYR  68  -7.579   3.910  -2.930
  504    HH   TYR  68           HH       TYR  68  -9.114   2.091  -3.323
  505    H    ASP  69           H        ASP  69  -8.175   6.532   4.417
  506    HA   ASP  69           HA       ASP  69  -5.994   8.448   4.852
  507    HB2  ASP  69           HB2      ASP  69  -8.223   7.570   6.706
  508    HB3  ASP  69           HB3      ASP  69  -6.956   8.717   7.132
  509    H    VAL  70           H        VAL  70  -4.171   7.238   4.853
  510    HA   VAL  70           HA       VAL  70  -4.172   4.812   6.517
  511    HB   VAL  70           HB       VAL  70  -2.330   3.978   5.101
  512   HG11  VAL  70          2HG1      VAL  70  -4.705   3.449   4.618
  513   HG12  VAL  70          1HG1      VAL  70  -3.680   3.429   3.181
  514   HG13  VAL  70          3HG1      VAL  70  -4.740   4.810   3.491
  515   HG21  VAL  70          3HG2      VAL  70  -1.754   5.091   3.030
  516   HG22  VAL  70          2HG2      VAL  70  -1.469   6.184   4.383
  517   HG23  VAL  70          1HG2      VAL  70  -2.903   6.385   3.371
  518    H    GLN  71           H        GLN  71  -2.512   4.370   7.865
  519    HA   GLN  71           HA       GLN  71  -0.918   4.754   9.409
  520    HB2  GLN  71           HB2      GLN  71   0.315   6.459   7.237
  521    HB3  GLN  71           HB3      GLN  71   1.139   5.875   8.674
  522    HG2  GLN  71           HG2      GLN  71  -0.010   4.143   6.494
  523    HG3  GLN  71           HG3      GLN  71   1.689   4.570   6.681
  524   HE21  GLN  71          1HE2      GLN  71   2.331   2.449   6.890
  525   HE22  GLN  71          2HE2      GLN  71   2.002   1.497   8.301
  Start of MODEL   18
    1    H1   SER   1           H1       SER   1  22.031  -1.763  -0.449
    2    H2   SER   1           H2       SER   1  21.750  -0.209   0.166
    3    H3   SER   1           H3       SER   1  23.250  -0.587  -0.535
    4    HA   SER   1           HA       SER   1  21.935   0.732  -2.038
    5    HB2  SER   1           HB2      SER   1  23.458  -1.036  -2.933
    6    HB3  SER   1           HB3      SER   1  22.098  -2.155  -2.956
    7    HG   SER   1           HG       SER   1  21.101  -0.897  -4.510
    8    H    ASN   2           H        ASN   2  20.328  -2.254  -1.002
    9    HA   ASN   2           HA       ASN   2  17.768  -0.918  -1.344
   10    HB2  ASN   2           HB2      ASN   2  16.797  -2.449  -2.799
   11    HB3  ASN   2           HB3      ASN   2  18.422  -2.320  -3.457
   12   HD21  ASN   2          1HD2      ASN   2  16.092  -4.343  -1.983
   13   HD22  ASN   2          2HD2      ASN   2  17.016  -5.817  -2.012
   14    H    ALA   3           H        ALA   3  16.052  -1.994  -0.160
   15    HA   ALA   3           HA       ALA   3  16.750  -4.169   1.610
   16    HB1  ALA   3           HB1      ALA   3  16.208  -1.438   2.773
   17    HB2  ALA   3           HB2      ALA   3  16.378  -2.935   3.689
   18    HB3  ALA   3           HB3      ALA   3  17.755  -2.283   2.800
   19    H    MET   4           H        MET   4  15.001  -5.377   1.305
   20    HA   MET   4           HA       MET   4  12.423  -4.159   0.806
   21    HB2  MET   4           HB2      MET   4  13.299  -7.042   0.964
   22    HB3  MET   4           HB3      MET   4  11.662  -6.530   0.576
   23    HG2  MET   4           HG2      MET   4  12.453  -5.397  -1.407
   24    HG3  MET   4           HG3      MET   4  14.120  -5.805  -1.005
   25    HE1  MET   4           HE1      MET   4  11.042  -8.194  -0.469
   26    HE2  MET   4           HE2      MET   4  10.594  -7.216  -1.867
   27    HE3  MET   4           HE3      MET   4  10.913  -8.938  -2.063
   28    H    GLU   5           H        GLU   5  10.740  -4.018   2.157
   29    HA   GLU   5           HA       GLU   5  10.970  -5.291   4.799
   30    HB2  GLU   5           HB2      GLU   5  10.224  -2.434   4.196
   31    HB3  GLU   5           HB3      GLU   5   9.877  -3.205   5.736
   32    HG2  GLU   5           HG2      GLU   5  12.365  -3.704   5.861
   33    HG3  GLU   5           HG3      GLU   5  12.536  -2.563   4.526
   34    H    GLN   6           H        GLN   6   9.086  -5.929   5.768
   35    HA   GLN   6           HA       GLN   6   6.704  -5.964   4.056
   36    HB2  GLN   6           HB2      GLN   6   7.388  -7.547   6.540
   37    HB3  GLN   6           HB3      GLN   6   5.887  -7.699   5.641
   38    HG2  GLN   6           HG2      GLN   6   8.571  -8.179   4.397
   39    HG3  GLN   6           HG3      GLN   6   7.665  -9.440   5.225
   40   HE21  GLN   6          1HE2      GLN   6   6.117  -6.928   3.339
   41   HE22  GLN   6          2HE2      GLN   6   5.615  -7.951   2.040
   42    H    LEU   7           H        LEU   7   5.247  -4.436   4.413
   43    HA   LEU   7           HA       LEU   7   4.838  -3.495   7.177
   44    HB2  LEU   7           HB2      LEU   7   4.657  -1.864   4.639
   45    HB3  LEU   7           HB3      LEU   7   4.280  -1.281   6.248
   46    HG   LEU   7           HG       LEU   7   7.007  -2.165   5.293
   47   HD11  LEU   7          2HD1      LEU   7   6.296  -0.044   4.314
   48   HD12  LEU   7          1HD1      LEU   7   7.592   0.196   5.484
   49   HD13  LEU   7          3HD1      LEU   7   5.928   0.580   5.923
   50   HD21  LEU   7          3HD2      LEU   7   6.684  -2.635   7.659
   51   HD22  LEU   7          2HD2      LEU   7   6.139  -0.980   7.925
   52   HD23  LEU   7          1HD2      LEU   7   7.804  -1.292   7.434
   53    H    THR   8           H        THR   8   2.654  -2.756   7.645
   54    HA   THR   8           HA       THR   8   0.638  -3.838   5.787
   55    HB   THR   8           HB       THR   8   0.417  -4.005   8.798
   56    HG1  THR   8           HG1      THR   8   1.988  -5.437   7.237
   57   HG21  THR   8          3HG2      THR   8  -1.376  -5.602   8.300
   58   HG22  THR   8          1HG2      THR   8  -1.115  -5.360   6.571
   59   HG23  THR   8          2HG2      THR   8  -1.707  -4.030   7.568
   60    H    LEU   9           H        LEU   9  -0.291  -2.065   4.991
   61    HA   LEU   9           HA       LEU   9  -0.649   0.328   6.588
   62    HB2  LEU   9           HB2      LEU   9  -1.095  -0.418   3.733
   63    HB3  LEU   9           HB3      LEU   9  -1.966   0.957   4.378
   64    HG   LEU   9           HG       LEU   9   0.166   2.038   4.957
   65   HD11  LEU   9          2HD1      LEU   9   2.261   1.129   4.124
   66   HD12  LEU   9          1HD1      LEU   9   1.423  -0.330   3.593
   67   HD13  LEU   9          3HD1      LEU   9   1.520   0.057   5.312
   68   HD21  LEU   9          3HD2      LEU   9  -0.894   2.478   2.805
   69   HD22  LEU   9          2HD2      LEU   9  -0.006   1.134   2.088
   70   HD23  LEU   9          1HD2      LEU   9   0.863   2.548   2.684
   71    H    GLN  10           H        GLN  10  -2.589   1.147   7.338
   72    HA   GLN  10           HA       GLN  10  -4.846  -0.713   7.273
   73    HB2  GLN  10           HB2      GLN  10  -4.550   1.838   8.858
   74    HB3  GLN  10           HB3      GLN  10  -5.843   0.651   9.019
   75    HG2  GLN  10           HG2      GLN  10  -4.255  -0.986   9.827
   76    HG3  GLN  10           HG3      GLN  10  -2.935   0.156   9.584
   77   HE21  GLN  10          1HE2      GLN  10  -2.338   0.089  11.742
   78   HE22  GLN  10          2HE2      GLN  10  -3.283   0.823  12.993
   79    H    VAL  11           H        VAL  11  -6.730  -0.288   6.245
   80    HA   VAL  11           HA       VAL  11  -6.696   2.130   4.553
   81    HB   VAL  11           HB       VAL  11  -8.044  -0.465   3.842
   82   HG11  VAL  11          2HG1      VAL  11  -7.195   1.917   2.201
   83   HG12  VAL  11          1HG1      VAL  11  -8.844   1.475   2.643
   84   HG13  VAL  11          3HG1      VAL  11  -7.915   0.440   1.559
   85   HG21  VAL  11          3HG2      VAL  11  -6.102  -0.963   2.422
   86   HG22  VAL  11          2HG2      VAL  11  -5.692  -0.955   4.141
   87   HG23  VAL  11          1HG2      VAL  11  -5.256   0.420   3.119
   88    H    GLU  12           H        GLU  12  -8.049   3.464   5.699
   89    HA   GLU  12           HA       GLU  12 -10.702   2.479   6.402
   90    HB2  GLU  12           HB2      GLU  12  -9.391   5.176   6.782
   91    HB3  GLU  12           HB3      GLU  12 -11.033   4.798   7.284
   92    HG2  GLU  12           HG2      GLU  12  -8.555   3.407   8.278
   93    HG3  GLU  12           HG3      GLU  12  -9.412   4.693   9.126
   94    H    GLY  13           H        GLY  13 -12.322   2.566   5.030
   95    HA2  GLY  13           HA1      GLY  13 -13.734   3.864   3.547
   96    HA3  GLY  13           HA2      GLY  13 -12.276   4.606   2.901
   97    H    MET  14           H        MET  14 -13.338   1.247   3.444
   98    HA   MET  14           HA       MET  14 -12.326   0.583   0.781
   99    HB2  MET  14           HB2      MET  14 -12.850  -0.972   3.269
  100    HB3  MET  14           HB3      MET  14 -12.938  -1.816   1.730
  101    HG2  MET  14           HG2      MET  14 -10.658  -1.212   1.227
  102    HG3  MET  14           HG3      MET  14 -10.561  -0.248   2.701
  103    HE1  MET  14           HE1      MET  14  -8.231  -1.957   2.686
  104    HE2  MET  14           HE2      MET  14  -8.387  -3.694   2.955
  105    HE3  MET  14           HE3      MET  14  -8.915  -2.989   1.428
  106    H    SER  15           H        SER  15 -14.883  -1.072   2.524
  107    HA   SER  15           HA       SER  15 -17.002  -1.639   2.013
  108    HB2  SER  15           HB2      SER  15 -17.442   0.767   1.850
  109    HB3  SER  15           HB3      SER  15 -16.924   0.760   0.165
  110    HG   SER  15           HG       SER  15 -19.202   0.653   0.359
  111    H    CYS  16           H        CYS  16 -15.926  -0.437  -1.174
  112    HA   CYS  16           HA       CYS  16 -17.010  -2.878  -2.342
  113    HB2  CYS  16           HB2      CYS  16 -16.038  -0.340  -3.674
  114    HB3  CYS  16           HB3      CYS  16 -16.867  -1.676  -4.471
  115    HG   CYS  16           HG       CYS  16 -18.963  -1.083  -2.248
  116    H    GLY  17           H        GLY  17 -15.880  -4.113  -3.895
  117    HA2  GLY  17           HA1      GLY  17 -13.176  -4.653  -3.155
  118    HA3  GLY  17           HA2      GLY  17 -14.080  -5.433  -4.445
  119    H    HIS  18           H        HIS  18 -14.607  -2.677  -5.624
  120    HA   HIS  18           HA       HIS  18 -12.413  -2.603  -7.398
  121    HB2  HIS  18           HB2      HIS  18 -14.695  -1.744  -7.934
  122    HB3  HIS  18           HB3      HIS  18 -14.398  -0.382  -6.858
  123    HD1  HIS  18           HD1      HIS  18 -12.784  -1.932  -9.948
  124    HD2  HIS  18           HD2      HIS  18 -13.373   1.773  -8.140
  125    HE1  HIS  18           HE1      HIS  18 -11.865  -0.231 -11.563
  126    HE2  HIS  18           HE2      HIS  18 -12.281   2.009 -10.476
  127    H    CYS  19           H        CYS  19 -13.128  -0.878  -4.426
  128    HA   CYS  19           HA       CYS  19 -11.059   1.016  -4.501
  129    HB2  CYS  19           HB2      CYS  19 -12.133  -0.403  -2.053
  130    HB3  CYS  19           HB3      CYS  19 -11.320   1.156  -2.089
  131    HG   CYS  19           HG       CYS  19 -14.153   1.339  -1.610
  132    H    VAL  20           H        VAL  20 -11.180  -2.298  -3.342
  133    HA   VAL  20           HA       VAL  20  -8.631  -2.651  -2.344
  134    HB   VAL  20           HB       VAL  20 -10.362  -4.596  -3.876
  135   HG11  VAL  20          2HG1      VAL  20  -8.041  -5.366  -3.826
  136   HG12  VAL  20          1HG1      VAL  20  -9.085  -6.375  -2.823
  137   HG13  VAL  20          3HG1      VAL  20  -8.025  -5.182  -2.072
  138   HG21  VAL  20          3HG2      VAL  20 -10.033  -4.102  -0.925
  139   HG22  VAL  20          2HG2      VAL  20 -10.993  -5.395  -1.642
  140   HG23  VAL  20          1HG2      VAL  20 -11.445  -3.711  -1.905
  141    H    ASN  21           H        ASN  21  -9.739  -3.173  -5.697
  142    HA   ASN  21           HA       ASN  21  -7.220  -3.916  -6.715
  143    HB2  ASN  21           HB2      ASN  21  -9.641  -2.751  -8.094
  144    HB3  ASN  21           HB3      ASN  21  -8.219  -3.330  -8.953
  145   HD21  ASN  21          1HD2      ASN  21  -7.769  -5.521  -7.074
  146   HD22  ASN  21          2HD2      ASN  21  -8.985  -6.703  -7.419
  147    H    ALA  22           H        ALA  22  -8.841  -0.785  -6.503
  148    HA   ALA  22           HA       ALA  22  -7.018   0.716  -7.999
  149    HB1  ALA  22           HB1      ALA  22  -7.903   2.672  -6.830
  150    HB2  ALA  22           HB2      ALA  22  -9.195   1.588  -7.350
  151    HB3  ALA  22           HB3      ALA  22  -8.693   1.616  -5.659
  152    H    ILE  23           H        ILE  23  -7.164   0.300  -4.441
  153    HA   ILE  23           HA       ILE  23  -4.821   1.815  -3.987
  154    HB   ILE  23           HB       ILE  23  -6.443   1.492  -2.207
  155   HG12  ILE  23          2HG1      ILE  23  -3.770   0.252  -1.519
  156   HG13  ILE  23          3HG1      ILE  23  -4.096   1.978  -1.629
  157   HG21  ILE  23          2HG2      ILE  23  -6.599  -0.656  -1.008
  158   HG22  ILE  23          1HG2      ILE  23  -5.600  -1.400  -2.255
  159   HG23  ILE  23          3HG2      ILE  23  -7.189  -0.756  -2.668
  160   HD11  ILE  23          3HD1      ILE  23  -5.344   0.073   0.337
  161   HD12  ILE  23          2HD1      ILE  23  -5.656   1.806   0.230
  162   HD13  ILE  23          1HD1      ILE  23  -4.053   1.225   0.674
  163    H    GLU  24           H        GLU  24  -5.362  -1.617  -4.564
  164    HA   GLU  24           HA       GLU  24  -2.861  -2.631  -3.893
  165    HB2  GLU  24           HB2      GLU  24  -4.631  -4.130  -4.510
  166    HB3  GLU  24           HB3      GLU  24  -4.756  -3.412  -6.112
  167    HG2  GLU  24           HG2      GLU  24  -2.094  -4.270  -5.818
  168    HG3  GLU  24           HG3      GLU  24  -3.121  -5.573  -5.221
  169    H    SER  25           H        SER  25  -3.954  -1.389  -7.063
  170    HA   SER  25           HA       SER  25  -1.323  -1.533  -8.144
  171    HB2  SER  25           HB2      SER  25  -3.706   0.008  -9.166
  172    HB3  SER  25           HB3      SER  25  -2.206  -0.309 -10.050
  173    HG   SER  25           HG       SER  25  -3.296  -2.601  -9.034
  174    H    SER  26           H        SER  26  -3.155   0.969  -6.491
  175    HA   SER  26           HA       SER  26  -1.581   3.168  -7.162
  176    HB2  SER  26           HB2      SER  26  -2.926   2.577  -4.507
  177    HB3  SER  26           HB3      SER  26  -2.326   4.156  -5.014
  178    HG   SER  26           HG       SER  26  -4.100   2.819  -6.717
  179    H    VAL  27           H        VAL  27  -1.018   0.565  -4.872
  180    HA   VAL  27           HA       VAL  27   1.525   1.651  -4.026
  181    HB   VAL  27           HB       VAL  27   0.523  -1.181  -3.696
  182   HG11  VAL  27          2HG1      VAL  27   2.085  -1.205  -1.785
  183   HG12  VAL  27          1HG1      VAL  27   2.638   0.404  -2.251
  184   HG13  VAL  27          3HG1      VAL  27   2.897  -0.966  -3.333
  185   HG21  VAL  27          3HG2      VAL  27   0.167   1.194  -1.871
  186   HG22  VAL  27          2HG2      VAL  27  -0.181  -0.480  -1.432
  187   HG23  VAL  27          1HG2      VAL  27  -1.104   0.307  -2.713
  188    H    LYS  28           H        LYS  28   0.449  -1.073  -6.044
  189    HA   LYS  28           HA       LYS  28   2.968  -2.097  -6.658
  190    HB2  LYS  28           HB2      LYS  28   1.065  -3.460  -7.016
  191    HB3  LYS  28           HB3      LYS  28   0.321  -2.275  -8.078
  192    HG2  LYS  28           HG2      LYS  28   1.985  -2.709  -9.784
  193    HG3  LYS  28           HG3      LYS  28   2.821  -3.831  -8.710
  194    HD2  LYS  28           HD2      LYS  28  -0.058  -4.214  -9.470
  195    HD3  LYS  28           HD3      LYS  28   1.257  -4.817 -10.479
  196    HE2  LYS  28           HE2      LYS  28   0.875  -5.498  -7.566
  197    HE3  LYS  28           HE3      LYS  28   0.352  -6.513  -8.910
  198    HZ1  LYS  28           HZ1      LYS  28   2.717  -6.516  -9.653
  199    HZ2  LYS  28           HZ2      LYS  28   2.440  -7.322  -8.191
  200    HZ3  LYS  28           HZ3      LYS  28   3.136  -5.772  -8.187
  201    H    GLU  29           H        GLU  29   1.094   0.377  -8.361
  202    HA   GLU  29           HA       GLU  29   2.690   0.417 -10.706
  203    HB2  GLU  29           HB2      GLU  29   0.866   2.520  -9.536
  204    HB3  GLU  29           HB3      GLU  29   1.609   2.627 -11.123
  205    HG2  GLU  29           HG2      GLU  29   0.459   0.488 -11.712
  206    HG3  GLU  29           HG3      GLU  29  -0.398   0.597 -10.180
  207    H    LEU  30           H        LEU  30   3.185   1.638  -7.581
  208    HA   LEU  30           HA       LEU  30   4.924   3.799  -8.323
  209    HB2  LEU  30           HB2      LEU  30   4.795   2.352  -5.677
  210    HB3  LEU  30           HB3      LEU  30   5.541   3.908  -5.974
  211    HG   LEU  30           HG       LEU  30   2.608   3.245  -5.980
  212   HD11  LEU  30          2HD1      LEU  30   4.266   5.166  -4.357
  213   HD12  LEU  30          1HD1      LEU  30   3.617   3.622  -3.803
  214   HD13  LEU  30          3HD1      LEU  30   2.521   4.936  -4.227
  215   HD21  LEU  30          3HD2      LEU  30   2.223   5.611  -6.559
  216   HD22  LEU  30          2HD2      LEU  30   3.003   4.713  -7.863
  217   HD23  LEU  30          1HD2      LEU  30   3.953   5.802  -6.850
  218    H    ASN  31           H        ASN  31   7.245   3.843  -7.614
  219    HA   ASN  31           HA       ASN  31   8.541   1.390  -8.555
  220    HB2  ASN  31           HB2      ASN  31   9.146   3.516  -9.656
  221    HB3  ASN  31           HB3      ASN  31   9.700   4.150  -8.109
  222   HD21  ASN  31          1HD2      ASN  31  10.313   1.828 -10.642
  223   HD22  ASN  31          2HD2      ASN  31  11.983   1.544 -10.245
  224    H    GLY  32           H        GLY  32   9.945   0.214  -7.341
  225    HA2  GLY  32           HA1      GLY  32  11.311  -0.231  -5.459
  226    HA3  GLY  32           HA2      GLY  32  10.602   1.157  -4.643
  227    H    VAL  33           H        VAL  33   8.258  -0.665  -6.161
  228    HA   VAL  33           HA       VAL  33   7.529  -1.937  -3.638
  229    HB   VAL  33           HB       VAL  33   5.805  -1.123  -5.984
  230   HG11  VAL  33          2HG1      VAL  33   5.017  -2.523  -3.432
  231   HG12  VAL  33          1HG1      VAL  33   5.007  -3.228  -5.048
  232   HG13  VAL  33          3HG1      VAL  33   3.905  -1.908  -4.653
  233   HG21  VAL  33          3HG2      VAL  33   6.486   0.724  -4.559
  234   HG22  VAL  33          2HG2      VAL  33   5.930  -0.154  -3.134
  235   HG23  VAL  33          1HG2      VAL  33   4.768   0.382  -4.349
  236    H    GLU  34           H        GLU  34   7.494  -4.033  -3.508
  237    HA   GLU  34           HA       GLU  34   8.182  -5.591  -5.881
  238    HB2  GLU  34           HB2      GLU  34   9.689  -5.899  -4.076
  239    HB3  GLU  34           HB3      GLU  34   8.381  -6.074  -2.921
  240    HG2  GLU  34           HG2      GLU  34   9.371  -8.216  -3.293
  241    HG3  GLU  34           HG3      GLU  34   7.770  -8.214  -4.029
  242    H    GLN  35           H        GLN  35   6.051  -5.894  -3.028
  243    HA   GLN  35           HA       GLN  35   4.022  -7.103  -4.759
  244    HB2  GLN  35           HB2      GLN  35   4.977  -8.291  -2.147
  245    HB3  GLN  35           HB3      GLN  35   3.566  -8.837  -3.039
  246    HG2  GLN  35           HG2      GLN  35   4.989  -9.448  -4.923
  247    HG3  GLN  35           HG3      GLN  35   6.405  -8.899  -4.027
  248   HE21  GLN  35          1HE2      GLN  35   5.784 -11.527  -5.099
  249   HE22  GLN  35          2HE2      GLN  35   5.796 -12.625  -3.756
  250    H    VAL  36           H        VAL  36   1.885  -6.993  -3.911
  251    HA   VAL  36           HA       VAL  36   1.472  -5.440  -1.485
  252    HB   VAL  36           HB       VAL  36   1.603  -3.652  -3.054
  253   HG11  VAL  36          2HG1      VAL  36   0.275  -3.541  -5.103
  254   HG12  VAL  36          1HG1      VAL  36  -0.340  -5.164  -4.793
  255   HG13  VAL  36          3HG1      VAL  36   1.376  -4.918  -5.118
  256   HG21  VAL  36          3HG2      VAL  36  -0.653  -2.707  -2.989
  257   HG22  VAL  36          2HG2      VAL  36  -0.216  -3.463  -1.457
  258   HG23  VAL  36          1HG2      VAL  36  -1.301  -4.293  -2.571
  259    H    LYS  37           H        LYS  37   0.219  -6.804  -0.393
  260    HA   LYS  37           HA       LYS  37  -1.994  -8.129  -1.814
  261    HB2  LYS  37           HB2      LYS  37  -0.805  -8.874   0.863
  262    HB3  LYS  37           HB3      LYS  37  -2.006  -9.784  -0.043
  263    HG2  LYS  37           HG2      LYS  37  -0.329 -10.125  -1.836
  264    HG3  LYS  37           HG3      LYS  37   0.867  -9.322  -0.815
  265    HD2  LYS  37           HD2      LYS  37  -0.634 -11.862  -0.183
  266    HD3  LYS  37           HD3      LYS  37   1.074 -11.726  -0.601
  267    HE2  LYS  37           HE2      LYS  37   1.459 -10.404   1.429
  268    HE3  LYS  37           HE3      LYS  37  -0.248 -10.557   1.847
  269    HZ1  LYS  37           HZ1      LYS  37   0.093 -13.002   1.870
  270    HZ2  LYS  37           HZ2      LYS  37   0.973 -12.183   3.065
  271    HZ3  LYS  37           HZ3      LYS  37   1.758 -12.739   1.668
  272    H    VAL  38           H        VAL  38  -3.563  -6.591  -1.701
  273    HA   VAL  38           HA       VAL  38  -4.178  -5.308   0.825
  274    HB   VAL  38           HB       VAL  38  -4.365  -3.836  -1.007
  275   HG11  VAL  38          2HG1      VAL  38  -5.963  -5.995  -2.351
  276   HG12  VAL  38          1HG1      VAL  38  -4.445  -5.262  -2.879
  277   HG13  VAL  38          3HG1      VAL  38  -5.937  -4.329  -2.922
  278   HG21  VAL  38          3HG2      VAL  38  -7.161  -4.723  -0.312
  279   HG22  VAL  38          2HG2      VAL  38  -6.717  -3.167  -1.012
  280   HG23  VAL  38          1HG2      VAL  38  -6.172  -3.592   0.613
  281    H    GLN  39           H        GLN  39  -5.679  -5.947   2.218
  282    HA   GLN  39           HA       GLN  39  -7.474  -8.141   1.396
  283    HB2  GLN  39           HB2      GLN  39  -6.283  -7.587   4.123
  284    HB3  GLN  39           HB3      GLN  39  -7.383  -8.904   3.738
  285    HG2  GLN  39           HG2      GLN  39  -4.669  -8.537   2.493
  286    HG3  GLN  39           HG3      GLN  39  -5.003  -9.577   3.875
  287   HE21  GLN  39          1HE2      GLN  39  -5.473  -9.108   0.458
  288   HE22  GLN  39          2HE2      GLN  39  -5.985 -10.721   0.106
  289    H    LEU  40           H        LEU  40  -9.514  -7.497   1.254
  290    HA   LEU  40           HA       LEU  40 -10.428  -4.988   2.189
  291    HB2  LEU  40           HB2      LEU  40 -11.290  -6.743   0.325
  292    HB3  LEU  40           HB3      LEU  40 -12.417  -7.109   1.614
  293    HG   LEU  40           HG       LEU  40 -12.025  -4.436   0.266
  294   HD11  LEU  40          2HD1      LEU  40 -13.258  -6.013  -1.082
  295   HD12  LEU  40          1HD1      LEU  40 -14.340  -4.765  -0.465
  296   HD13  LEU  40          3HD1      LEU  40 -14.334  -6.370   0.269
  297   HD21  LEU  40          3HD2      LEU  40 -13.869  -5.173   2.533
  298   HD22  LEU  40          2HD2      LEU  40 -13.892  -3.651   1.642
  299   HD23  LEU  40          1HD2      LEU  40 -12.484  -4.079   2.617
  300    H    ALA  41           H        ALA  41 -10.981  -8.311   3.295
  301    HA   ALA  41           HA       ALA  41 -12.805  -7.700   5.347
  302    HB1  ALA  41           HB1      ALA  41 -12.335  -9.952   6.184
  303    HB2  ALA  41           HB2      ALA  41 -12.557  -9.942   4.434
  304    HB3  ALA  41           HB3      ALA  41 -10.936 -10.053   5.117
  305    H    GLU  42           H        GLU  42  -9.304  -7.696   5.287
  306    HA   GLU  42           HA       GLU  42  -9.044  -7.580   8.150
  307    HB2  GLU  42           HB2      GLU  42  -7.002  -7.051   5.984
  308    HB3  GLU  42           HB3      GLU  42  -6.650  -7.180   7.700
  309    HG2  GLU  42           HG2      GLU  42  -7.763  -9.371   5.964
  310    HG3  GLU  42           HG3      GLU  42  -6.100  -9.236   6.534
  311    H    GLY  43           H        GLY  43  -9.278  -5.283   5.527
  312    HA2  GLY  43           HA1      GLY  43  -9.490  -2.962   5.633
  313    HA3  GLY  43           HA2      GLY  43  -9.353  -3.072   7.381
  314    H    THR  44           H        THR  44  -6.998  -4.649   5.436
  315    HA   THR  44           HA       THR  44  -5.094  -2.466   5.799
  316    HB   THR  44           HB       THR  44  -3.417  -4.087   6.741
  317    HG1  THR  44           HG1      THR  44  -4.895  -5.880   7.875
  318   HG21  THR  44          3HG2      THR  44  -4.586  -2.515   8.210
  319   HG22  THR  44          1HG2      THR  44  -4.289  -4.049   9.028
  320   HG23  THR  44          2HG2      THR  44  -5.900  -3.677   8.411
  321    H    VAL  45           H        VAL  45  -3.006  -2.938   4.738
  322    HA   VAL  45           HA       VAL  45  -3.220  -4.869   2.522
  323    HB   VAL  45           HB       VAL  45  -1.923  -2.144   2.308
  324   HG11  VAL  45          2HG1      VAL  45  -0.896  -3.824   0.894
  325   HG12  VAL  45          1HG1      VAL  45  -1.794  -2.661  -0.082
  326   HG13  VAL  45          3HG1      VAL  45  -2.473  -4.258   0.234
  327   HG21  VAL  45          3HG2      VAL  45  -4.553  -3.080   1.173
  328   HG22  VAL  45          2HG2      VAL  45  -3.769  -1.543   0.816
  329   HG23  VAL  45          1HG2      VAL  45  -4.336  -1.885   2.450
  330    H    GLU  46           H        GLU  46  -1.672  -6.350   2.745
  331    HA   GLU  46           HA       GLU  46   0.727  -5.760   4.267
  332    HB2  GLU  46           HB2      GLU  46  -0.013  -8.297   2.798
  333    HB3  GLU  46           HB3      GLU  46   1.258  -8.113   4.000
  334    HG2  GLU  46           HG2      GLU  46  -0.553  -7.485   5.638
  335    HG3  GLU  46           HG3      GLU  46  -1.712  -8.001   4.415
  336    H    VAL  47           H        VAL  47   2.240  -4.626   3.257
  337    HA   VAL  47           HA       VAL  47   2.574  -5.009   0.356
  338    HB   VAL  47           HB       VAL  47   3.414  -2.586   1.947
  339   HG11  VAL  47          2HG1      VAL  47   3.482  -1.509  -0.252
  340   HG12  VAL  47          1HG1      VAL  47   3.040  -3.040  -1.008
  341   HG13  VAL  47          3HG1      VAL  47   4.579  -2.887  -0.160
  342   HG21  VAL  47          3HG2      VAL  47   0.992  -2.836   2.113
  343   HG22  VAL  47          2HG2      VAL  47   0.881  -2.976   0.358
  344   HG23  VAL  47          1HG2      VAL  47   1.421  -1.465   1.090
  345    H    THR  48           H        THR  48   4.516  -5.471  -0.474
  346    HA   THR  48           HA       THR  48   6.818  -5.631   1.357
  347    HB   THR  48           HB       THR  48   6.725  -6.924  -1.364
  348    HG1  THR  48           HG1      THR  48   5.774  -8.731  -0.460
  349   HG21  THR  48          3HG2      THR  48   8.876  -6.803  -0.212
  350   HG22  THR  48          1HG2      THR  48   8.317  -8.474  -0.303
  351   HG23  THR  48          2HG2      THR  48   8.173  -7.577   1.210
  352    H    ILE  49           H        ILE  49   7.852  -3.691   1.192
  353    HA   ILE  49           HA       ILE  49   8.259  -2.593  -1.520
  354    HB   ILE  49           HB       ILE  49   8.558  -0.384  -0.477
  355   HG12  ILE  49          2HG1      ILE  49   7.579  -1.647   2.089
  356   HG13  ILE  49          3HG1      ILE  49   9.279  -1.313   1.765
  357   HG21  ILE  49          2HG2      ILE  49   6.209   0.021   0.113
  358   HG22  ILE  49          1HG2      ILE  49   5.946  -1.722   0.199
  359   HG23  ILE  49          3HG2      ILE  49   6.376  -0.969  -1.337
  360   HD11  ILE  49          3HD1      ILE  49   8.755   1.065   1.551
  361   HD12  ILE  49          2HD1      ILE  49   8.293   0.423   3.129
  362   HD13  ILE  49          1HD1      ILE  49   7.062   0.717   1.901
  363    H    ASP  50           H        ASP  50  10.249  -1.291  -1.739
  364    HA   ASP  50           HA       ASP  50  12.437  -2.356  -0.090
  365    HB2  ASP  50           HB2      ASP  50  12.469  -2.584  -2.662
  366    HB3  ASP  50           HB3      ASP  50  12.760  -0.847  -2.682
  367    H    SER  51           H        SER  51  12.862  -0.985   1.557
  368    HA   SER  51           HA       SER  51  11.822   1.687   1.464
  369    HB2  SER  51           HB2      SER  51  12.669   1.799   3.819
  370    HB3  SER  51           HB3      SER  51  11.577   0.455   3.502
  371    HG   SER  51           HG       SER  51  13.257  -0.407   4.605
  372    H    SER  52           H        SER  52  14.694   0.388   0.409
  373    HA   SER  52           HA       SER  52  16.237   2.810   0.894
  374    HB2  SER  52           HB2      SER  52  16.919   0.301  -0.657
  375    HB3  SER  52           HB3      SER  52  18.025   1.643  -0.362
  376    HG   SER  52           HG       SER  52  16.869   0.745   1.932
  377    H    VAL  53           H        VAL  53  13.793   2.033  -1.034
  378    HA   VAL  53           HA       VAL  53  14.737   3.781  -3.207
  379    HB   VAL  53           HB       VAL  53  12.806   1.469  -3.453
  380   HG11  VAL  53          2HG1      VAL  53  12.826   1.959  -5.842
  381   HG12  VAL  53          1HG1      VAL  53  13.876   3.348  -5.555
  382   HG13  VAL  53          3HG1      VAL  53  12.230   3.337  -4.913
  383   HG21  VAL  53          3HG2      VAL  53  14.506   0.371  -4.753
  384   HG22  VAL  53          2HG2      VAL  53  15.184   0.813  -3.184
  385   HG23  VAL  53          1HG2      VAL  53  15.573   1.769  -4.617
  386    H    VAL  54           H        VAL  54  11.665   2.410  -2.021
  387    HA   VAL  54           HA       VAL  54  10.516   5.109  -2.230
  388    HB   VAL  54           HB       VAL  54   9.498   3.355  -3.692
  389   HG11  VAL  54          2HG1      VAL  54   8.624   2.128  -1.085
  390   HG12  VAL  54          1HG1      VAL  54   9.724   1.419  -2.266
  391   HG13  VAL  54          3HG1      VAL  54   8.027   1.671  -2.682
  392   HG21  VAL  54          3HG2      VAL  54   7.173   3.885  -3.162
  393   HG22  VAL  54          2HG2      VAL  54   8.213   5.307  -3.057
  394   HG23  VAL  54          1HG2      VAL  54   7.676   4.498  -1.584
  395    H    THR  55           H        THR  55   9.415   5.971  -0.455
  396    HA   THR  55           HA       THR  55   9.911   4.537   2.056
  397    HB   THR  55           HB       THR  55   9.637   6.660   3.193
  398    HG1  THR  55           HG1      THR  55   9.133   7.793   0.612
  399   HG21  THR  55          3HG2      THR  55  11.844   6.191   2.266
  400   HG22  THR  55          1HG2      THR  55  11.501   7.920   2.210
  401   HG23  THR  55          2HG2      THR  55  11.377   6.949   0.745
  402    H    LEU  56           H        LEU  56   8.259   4.624   3.742
  403    HA   LEU  56           HA       LEU  56   5.720   3.815   2.894
  404    HB2  LEU  56           HB2      LEU  56   6.616   3.279   5.100
  405    HB3  LEU  56           HB3      LEU  56   6.560   4.972   5.554
  406    HG   LEU  56           HG       LEU  56   4.086   4.914   5.348
  407   HD11  LEU  56          2HD1      LEU  56   3.929   3.081   3.730
  408   HD12  LEU  56          1HD1      LEU  56   2.941   2.780   5.160
  409   HD13  LEU  56          3HD1      LEU  56   4.484   1.950   4.963
  410   HD21  LEU  56          3HD2      LEU  56   3.679   3.614   7.380
  411   HD22  LEU  56          2HD2      LEU  56   5.142   4.587   7.520
  412   HD23  LEU  56          1HD2      LEU  56   5.262   2.853   7.213
  413    H    LYS  57           H        LYS  57   7.000   6.972   3.649
  414    HA   LYS  57           HA       LYS  57   4.561   8.375   3.817
  415    HB2  LYS  57           HB2      LYS  57   7.008   9.108   4.396
  416    HB3  LYS  57           HB3      LYS  57   7.045   9.637   2.720
  417    HG2  LYS  57           HG2      LYS  57   4.939  10.500   4.678
  418    HG3  LYS  57           HG3      LYS  57   6.437  11.393   4.407
  419    HD2  LYS  57           HD2      LYS  57   5.821  11.608   2.020
  420    HD3  LYS  57           HD3      LYS  57   4.294  10.793   2.366
  421    HE2  LYS  57           HE2      LYS  57   3.971  13.195   2.314
  422    HE3  LYS  57           HE3      LYS  57   3.715  12.577   3.946
  423    HZ1  LYS  57           HZ1      LYS  57   5.883  13.349   4.582
  424    HZ2  LYS  57           HZ2      LYS  57   5.031  14.638   3.885
  425    HZ3  LYS  57           HZ3      LYS  57   6.235  13.834   2.997
  426    H    ASP  58           H        ASP  58   6.740   7.665   1.093
  427    HA   ASP  58           HA       ASP  58   5.336   9.099  -0.882
  428    HB2  ASP  58           HB2      ASP  58   6.991   6.583  -1.199
  429    HB3  ASP  58           HB3      ASP  58   6.451   7.606  -2.523
  430    H    ILE  59           H        ILE  59   5.106   5.736   0.175
  431    HA   ILE  59           HA       ILE  59   3.079   4.873  -1.537
  432    HB   ILE  59           HB       ILE  59   3.510   4.044   1.341
  433   HG12  ILE  59          2HG1      ILE  59   5.548   3.807  -0.040
  434   HG13  ILE  59          3HG1      ILE  59   4.900   2.246   0.452
  435   HG21  ILE  59          2HG2      ILE  59   1.342   3.354   0.431
  436   HG22  ILE  59          1HG2      ILE  59   2.401   1.973   0.724
  437   HG23  ILE  59          3HG2      ILE  59   2.163   2.569  -0.920
  438   HD11  ILE  59          3HD1      ILE  59   3.909   1.961  -1.756
  439   HD12  ILE  59          2HD1      ILE  59   5.652   2.209  -1.855
  440   HD13  ILE  59          1HD1      ILE  59   4.549   3.529  -2.247
  441    H    VAL  60           H        VAL  60   2.785   6.086   1.795
  442    HA   VAL  60           HA       VAL  60   0.010   6.188   1.930
  443    HB   VAL  60           HB       VAL  60   2.203   7.632   3.373
  444   HG11  VAL  60          2HG1      VAL  60   0.421   9.298   3.192
  445   HG12  VAL  60          1HG1      VAL  60   0.569   8.697   4.844
  446   HG13  VAL  60          3HG1      VAL  60  -0.741   8.124   3.810
  447   HG21  VAL  60          3HG2      VAL  60   1.684   5.315   3.937
  448   HG22  VAL  60          2HG2      VAL  60   0.004   5.763   4.245
  449   HG23  VAL  60          1HG2      VAL  60   1.291   6.398   5.274
  450    H    ALA  61           H        ALA  61   2.286   8.660   0.776
  451    HA   ALA  61           HA       ALA  61   0.522  10.769   0.406
  452    HB1  ALA  61           HB1      ALA  61   2.906  10.040  -1.292
  453    HB2  ALA  61           HB2      ALA  61   2.109  11.615  -1.254
  454    HB3  ALA  61           HB3      ALA  61   2.935  11.009   0.183
  455    H    VAL  62           H        VAL  62   1.300   8.094  -1.797
  456    HA   VAL  62           HA       VAL  62  -0.487   9.037  -3.843
  457    HB   VAL  62           HB       VAL  62   0.831   6.336  -3.510
  458   HG11  VAL  62          2HG1      VAL  62  -1.137   6.199  -4.941
  459   HG12  VAL  62          1HG1      VAL  62   0.341   6.001  -5.883
  460   HG13  VAL  62          3HG1      VAL  62  -0.530   7.534  -5.921
  461   HG21  VAL  62          3HG2      VAL  62   2.422   7.145  -5.189
  462   HG22  VAL  62          2HG2      VAL  62   2.447   8.141  -3.735
  463   HG23  VAL  62          1HG2      VAL  62   1.623   8.717  -5.184
  464    H    ILE  63           H        ILE  63  -0.561   6.355  -1.504
  465    HA   ILE  63           HA       ILE  63  -2.988   5.253  -2.343
  466    HB   ILE  63           HB       ILE  63  -1.366   5.060   0.160
  467   HG12  ILE  63          2HG1      ILE  63  -1.093   2.780  -0.495
  468   HG13  ILE  63          3HG1      ILE  63  -2.345   2.905  -1.719
  469   HG21  ILE  63          2HG2      ILE  63  -3.635   5.026   0.989
  470   HG22  ILE  63          1HG2      ILE  63  -2.940   3.407   1.069
  471   HG23  ILE  63          3HG2      ILE  63  -4.083   3.815  -0.211
  472   HD11  ILE  63          3HD1      ILE  63  -0.176   2.846  -2.746
  473   HD12  ILE  63          2HD1      ILE  63   0.367   4.207  -1.762
  474   HD13  ILE  63          1HD1      ILE  63  -0.890   4.444  -2.977
  475    H    GLU  64           H        GLU  64  -2.357   7.635   0.262
  476    HA   GLU  64           HA       GLU  64  -5.092   7.734   1.059
  477    HB2  GLU  64           HB2      GLU  64  -2.882   9.738   1.538
  478    HB3  GLU  64           HB3      GLU  64  -4.469   9.795   2.289
  479    HG2  GLU  64           HG2      GLU  64  -3.800   7.347   3.059
  480    HG3  GLU  64           HG3      GLU  64  -2.175   7.996   2.822
  481    H    ASP  65           H        ASP  65  -3.190   9.371  -1.339
  482    HA   ASP  65           HA       ASP  65  -4.886  11.539  -1.909
  483    HB2  ASP  65           HB2      ASP  65  -2.606  11.361  -2.800
  484    HB3  ASP  65           HB3      ASP  65  -3.084   9.973  -3.771
  485    H    GLN  66           H        GLN  66  -5.069   8.167  -2.669
  486    HA   GLN  66           HA       GLN  66  -6.996   8.414  -4.777
  487    HB2  GLN  66           HB2      GLN  66  -6.203   6.017  -3.116
  488    HB3  GLN  66           HB3      GLN  66  -7.181   5.965  -4.577
  489    HG2  GLN  66           HG2      GLN  66  -4.314   6.863  -4.397
  490    HG3  GLN  66           HG3      GLN  66  -4.887   5.317  -5.024
  491   HE21  GLN  66          1HE2      GLN  66  -4.592   8.720  -5.616
  492   HE22  GLN  66          2HE2      GLN  66  -5.024   8.670  -7.290
  493    H    GLY  67           H        GLY  67  -7.288   9.093  -1.610
  494    HA2  GLY  67           HA1      GLY  67  -9.335   9.745  -0.636
  495    HA3  GLY  67           HA2      GLY  67 -10.176   8.653  -1.726
  496    H    TYR  68           H        TYR  68  -7.384   7.696   0.157
  497    HA   TYR  68           HA       TYR  68  -9.173   6.084   1.849
  498    HB2  TYR  68           HB2      TYR  68  -6.396   5.323   0.938
  499    HB3  TYR  68           HB3      TYR  68  -7.465   4.350   1.938
  500    HD1  TYR  68           HD2      TYR  68  -9.872   3.943   0.814
  501    HD2  TYR  68           HD1      TYR  68  -6.280   4.786  -1.302
  502    HE1  TYR  68           HE2      TYR  68 -10.825   2.916  -1.208
  503    HE2  TYR  68           HE1      TYR  68  -7.220   3.757  -3.325
  504    HH   TYR  68           HH       TYR  68  -8.986   2.056  -3.868
  505    H    ASP  69           H        ASP  69  -8.687   5.909   3.997
  506    HA   ASP  69           HA       ASP  69  -6.772   7.882   5.013
  507    HB2  ASP  69           HB2      ASP  69  -9.049   8.054   5.885
  508    HB3  ASP  69           HB3      ASP  69  -8.998   6.375   6.409
  509    H    VAL  70           H        VAL  70  -4.800   7.124   5.366
  510    HA   VAL  70           HA       VAL  70  -4.515   4.375   6.398
  511    HB   VAL  70           HB       VAL  70  -2.667   5.652   4.375
  512   HG11  VAL  70          2HG1      VAL  70  -2.831   2.826   5.421
  513   HG12  VAL  70          1HG1      VAL  70  -1.579   4.011   5.803
  514   HG13  VAL  70          3HG1      VAL  70  -1.738   3.397   4.156
  515   HG21  VAL  70          3HG2      VAL  70  -4.863   5.202   3.387
  516   HG22  VAL  70          2HG2      VAL  70  -4.748   3.522   3.913
  517   HG23  VAL  70          1HG2      VAL  70  -3.608   4.156   2.724
  518    H    GLN  71           H        GLN  71  -4.016   4.915   8.487
  519    HA   GLN  71           HA       GLN  71  -1.690   6.670   8.867
  520    HB2  GLN  71           HB2      GLN  71  -3.820   5.882  10.864
  521    HB3  GLN  71           HB3      GLN  71  -2.443   6.922  11.203
  522    HG2  GLN  71           HG2      GLN  71  -3.280   8.516   9.515
  523    HG3  GLN  71           HG3      GLN  71  -4.697   7.490   9.292
  524   HE21  GLN  71          1HE2      GLN  71  -3.039   9.675  11.420
  525   HE22  GLN  71          2HE2      GLN  71  -4.369   9.939  12.508
  Start of MODEL   19
    1    H1   SER   1           H1       SER   1  22.460  -2.346   0.665
    2    H2   SER   1           H2       SER   1  21.693  -0.870   1.000
    3    H3   SER   1           H3       SER   1  23.296  -0.884   0.439
    4    HA   SER   1           HA       SER   1  21.629  -0.259  -1.251
    5    HB2  SER   1           HB2      SER   1  23.862  -1.223  -1.829
    6    HB3  SER   1           HB3      SER   1  23.129  -2.827  -1.835
    7    HG   SER   1           HG       SER   1  22.202  -2.421  -3.698
    8    H    ASN   2           H        ASN   2  19.507  -0.460  -1.209
    9    HA   ASN   2           HA       ASN   2  17.428  -1.312  -1.495
   10    HB2  ASN   2           HB2      ASN   2  18.876  -3.838  -2.303
   11    HB3  ASN   2           HB3      ASN   2  17.131  -3.612  -2.406
   12   HD21  ASN   2          1HD2      ASN   2  16.282  -2.256  -3.941
   13   HD22  ASN   2          2HD2      ASN   2  17.211  -1.673  -5.293
   14    H    ALA   3           H        ALA   3  15.946  -1.969  -0.071
   15    HA   ALA   3           HA       ALA   3  16.630  -3.949   1.961
   16    HB1  ALA   3           HB1      ALA   3  16.101  -2.467   3.822
   17    HB2  ALA   3           HB2      ALA   3  17.465  -1.846   2.894
   18    HB3  ALA   3           HB3      ALA   3  15.867  -1.125   2.703
   19    H    MET   4           H        MET   4  14.935  -5.249   2.154
   20    HA   MET   4           HA       MET   4  12.361  -4.452   1.121
   21    HB2  MET   4           HB2      MET   4  13.432  -7.037   2.228
   22    HB3  MET   4           HB3      MET   4  11.733  -6.827   1.828
   23    HG2  MET   4           HG2      MET   4  14.029  -6.481  -0.084
   24    HG3  MET   4           HG3      MET   4  12.988  -7.899   0.030
   25    HE1  MET   4           HE1      MET   4  12.546  -7.615  -2.620
   26    HE2  MET   4           HE2      MET   4  11.925  -6.129  -3.337
   27    HE3  MET   4           HE3      MET   4  13.545  -6.160  -2.638
   28    H    GLU   5           H        GLU   5  10.942  -3.422   2.264
   29    HA   GLU   5           HA       GLU   5  10.741  -3.957   5.156
   30    HB2  GLU   5           HB2      GLU   5   9.994  -1.508   3.551
   31    HB3  GLU   5           HB3      GLU   5   9.569  -1.736   5.242
   32    HG2  GLU   5           HG2      GLU   5  12.399  -1.805   4.242
   33    HG3  GLU   5           HG3      GLU   5  11.598  -0.330   4.785
   34    H    GLN   6           H        GLN   6   8.961  -4.939   5.840
   35    HA   GLN   6           HA       GLN   6   6.635  -4.975   4.038
   36    HB2  GLN   6           HB2      GLN   6   7.407  -6.982   6.161
   37    HB3  GLN   6           HB3      GLN   6   5.960  -7.058   5.165
   38    HG2  GLN   6           HG2      GLN   6   7.513  -7.090   3.167
   39    HG3  GLN   6           HG3      GLN   6   8.816  -7.379   4.319
   40   HE21  GLN   6          1HE2      GLN   6   8.859  -9.313   5.473
   41   HE22  GLN   6          2HE2      GLN   6   7.966 -10.699   4.960
   42    H    LEU   7           H        LEU   7   4.734  -4.228   4.761
   43    HA   LEU   7           HA       LEU   7   4.530  -3.452   7.580
   44    HB2  LEU   7           HB2      LEU   7   5.460  -1.577   6.119
   45    HB3  LEU   7           HB3      LEU   7   3.896  -1.544   5.335
   46    HG   LEU   7           HG       LEU   7   2.828  -0.969   7.461
   47   HD11  LEU   7          2HD1      LEU   7   4.191  -0.393   9.403
   48   HD12  LEU   7          1HD1      LEU   7   5.643  -0.908   8.544
   49   HD13  LEU   7          3HD1      LEU   7   4.401  -2.089   8.962
   50   HD21  LEU   7          3HD2      LEU   7   5.149   0.784   6.668
   51   HD22  LEU   7          2HD2      LEU   7   3.779   1.300   7.655
   52   HD23  LEU   7          1HD2      LEU   7   3.526   0.808   5.981
   53    H    THR   8           H        THR   8   2.504  -3.654   8.393
   54    HA   THR   8           HA       THR   8   0.318  -4.174   6.487
   55    HB   THR   8           HB       THR   8   0.347  -4.760   9.454
   56    HG1  THR   8           HG1      THR   8   1.879  -5.932   7.870
   57   HG21  THR   8          3HG2      THR   8  -1.438  -5.741   7.222
   58   HG22  THR   8          1HG2      THR   8  -1.881  -4.558   8.453
   59   HG23  THR   8          2HG2      THR   8  -1.540  -6.226   8.914
   60    H    LEU   9           H        LEU   9  -0.663  -2.289   6.038
   61    HA   LEU   9           HA       LEU   9  -1.008  -0.332   8.191
   62    HB2  LEU   9           HB2      LEU   9  -1.804   1.097   6.121
   63    HB3  LEU   9           HB3      LEU   9  -0.112   0.921   6.514
   64    HG   LEU   9           HG       LEU   9  -1.441  -0.854   4.474
   65   HD11  LEU   9          2HD1      LEU   9  -1.799   1.494   3.831
   66   HD12  LEU   9          1HD1      LEU   9  -0.657   0.682   2.758
   67   HD13  LEU   9          3HD1      LEU   9  -0.067   1.789   3.999
   68   HD21  LEU   9          3HD2      LEU   9   0.851  -1.043   3.622
   69   HD22  LEU   9          2HD2      LEU   9   0.748  -1.568   5.303
   70   HD23  LEU   9          1HD2      LEU   9   1.417   0.017   4.913
   71    H    GLN  10           H        GLN  10  -2.970   0.536   8.726
   72    HA   GLN  10           HA       GLN  10  -5.275  -1.139   8.133
   73    HB2  GLN  10           HB2      GLN  10  -4.963   1.255   9.956
   74    HB3  GLN  10           HB3      GLN  10  -6.424   0.287   9.818
   75    HG2  GLN  10           HG2      GLN  10  -5.130  -1.675  10.579
   76    HG3  GLN  10           HG3      GLN  10  -3.739  -0.618  10.805
   77   HE21  GLN  10          1HE2      GLN  10  -5.247  -2.233  12.731
   78   HE22  GLN  10          2HE2      GLN  10  -5.780  -1.132  13.954
   79    H    VAL  11           H        VAL  11  -6.993  -0.569   6.882
   80    HA   VAL  11           HA       VAL  11  -6.660   1.959   5.396
   81    HB   VAL  11           HB       VAL  11  -7.783  -0.622   4.314
   82   HG11  VAL  11          2HG1      VAL  11  -7.558   0.459   2.139
   83   HG12  VAL  11          1HG1      VAL  11  -6.955   1.920   2.921
   84   HG13  VAL  11          3HG1      VAL  11  -8.612   1.389   3.206
   85   HG21  VAL  11          3HG2      VAL  11  -5.023   0.551   4.010
   86   HG22  VAL  11          2HG2      VAL  11  -5.659  -0.787   3.052
   87   HG23  VAL  11          1HG2      VAL  11  -5.453  -0.972   4.795
   88    H    GLU  12           H        GLU  12  -8.271   3.331   5.680
   89    HA   GLU  12           HA       GLU  12 -10.998   2.232   5.800
   90    HB2  GLU  12           HB2      GLU  12  -9.927   4.772   7.039
   91    HB3  GLU  12           HB3      GLU  12 -11.642   4.400   6.903
   92    HG2  GLU  12           HG2      GLU  12 -11.097   2.251   8.161
   93    HG3  GLU  12           HG3      GLU  12  -9.551   3.011   8.541
   94    H    GLY  13           H        GLY  13 -12.491   3.012   4.406
   95    HA2  GLY  13           HA1      GLY  13 -13.035   4.970   2.895
   96    HA3  GLY  13           HA2      GLY  13 -11.412   4.732   2.263
   97    H    MET  14           H        MET  14 -12.327   1.711   2.947
   98    HA   MET  14           HA       MET  14 -12.736   0.964   0.248
   99    HB2  MET  14           HB2      MET  14 -13.276  -0.561   2.806
  100    HB3  MET  14           HB3      MET  14 -13.314  -1.271   1.197
  101    HG2  MET  14           HG2      MET  14 -10.957  -0.777   0.899
  102    HG3  MET  14           HG3      MET  14 -10.908   0.013   2.475
  103    HE1  MET  14           HE1      MET  14  -8.802  -1.525   3.055
  104    HE2  MET  14           HE2      MET  14  -8.844  -3.289   3.032
  105    HE3  MET  14           HE3      MET  14  -8.925  -2.386   1.520
  106    H    SER  15           H        SER  15 -14.474   1.539  -0.865
  107    HA   SER  15           HA       SER  15 -17.067   1.613   0.515
  108    HB2  SER  15           HB2      SER  15 -16.315   2.954  -2.087
  109    HB3  SER  15           HB3      SER  15 -17.758   3.242  -1.114
  110    HG   SER  15           HG       SER  15 -15.236   3.598   0.071
  111    H    CYS  16           H        CYS  16 -15.393   0.359  -2.321
  112    HA   CYS  16           HA       CYS  16 -17.569  -1.547  -2.707
  113    HB2  CYS  16           HB2      CYS  16 -17.635  -1.155  -5.125
  114    HB3  CYS  16           HB3      CYS  16 -18.062   0.311  -4.246
  115    HG   CYS  16           HG       CYS  16 -16.127   1.827  -5.097
  116    H    GLY  17           H        GLY  17 -16.789  -3.012  -4.737
  117    HA2  GLY  17           HA1      GLY  17 -14.526  -4.409  -3.819
  118    HA3  GLY  17           HA2      GLY  17 -15.328  -4.659  -5.362
  119    H    HIS  18           H        HIS  18 -14.881  -1.969  -6.344
  120    HA   HIS  18           HA       HIS  18 -12.397  -2.396  -7.603
  121    HB2  HIS  18           HB2      HIS  18 -14.281  -0.066  -7.508
  122    HB3  HIS  18           HB3      HIS  18 -12.707   0.097  -8.280
  123    HD1  HIS  18           HD1      HIS  18 -15.554   0.208  -9.707
  124    HD2  HIS  18           HD2      HIS  18 -12.891  -2.992  -9.702
  125    HE1  HIS  18           HE1      HIS  18 -16.096  -1.132 -11.767
  126    HE2  HIS  18           HE2      HIS  18 -14.518  -3.095 -11.716
  127    H    CYS  19           H        CYS  19 -13.177  -0.909  -4.610
  128    HA   CYS  19           HA       CYS  19 -11.050   0.900  -4.360
  129    HB2  CYS  19           HB2      CYS  19 -12.461  -0.692  -2.209
  130    HB3  CYS  19           HB3      CYS  19 -11.415   0.695  -1.920
  131    HG   CYS  19           HG       CYS  19 -13.172   2.332  -3.614
  132    H    VAL  20           H        VAL  20 -11.243  -2.577  -3.845
  133    HA   VAL  20           HA       VAL  20  -8.770  -2.852  -2.495
  134    HB   VAL  20           HB       VAL  20 -10.698  -4.552  -2.685
  135   HG11  VAL  20          2HG1      VAL  20  -9.181  -5.358  -5.147
  136   HG12  VAL  20          1HG1      VAL  20 -10.833  -4.745  -5.084
  137   HG13  VAL  20          3HG1      VAL  20 -10.443  -6.303  -4.358
  138   HG21  VAL  20          3HG2      VAL  20  -9.188  -6.450  -2.313
  139   HG22  VAL  20          2HG2      VAL  20  -8.694  -5.006  -1.429
  140   HG23  VAL  20          1HG2      VAL  20  -7.845  -5.470  -2.902
  141    H    ASN  21           H        ASN  21  -9.697  -3.026  -5.885
  142    HA   ASN  21           HA       ASN  21  -7.128  -3.746  -6.866
  143    HB2  ASN  21           HB2      ASN  21  -9.324  -2.314  -8.371
  144    HB3  ASN  21           HB3      ASN  21  -8.019  -3.276  -9.058
  145   HD21  ASN  21          1HD2      ASN  21  -8.071  -5.562  -8.741
  146   HD22  ASN  21          2HD2      ASN  21  -9.575  -6.364  -8.455
  147    H    ALA  22           H        ALA  22  -8.861  -0.688  -6.505
  148    HA   ALA  22           HA       ALA  22  -7.048   0.978  -7.816
  149    HB1  ALA  22           HB1      ALA  22  -8.837   1.666  -5.487
  150    HB2  ALA  22           HB2      ALA  22  -8.093   2.813  -6.604
  151    HB3  ALA  22           HB3      ALA  22  -9.307   1.672  -7.188
  152    H    ILE  23           H        ILE  23  -7.264   0.215  -4.326
  153    HA   ILE  23           HA       ILE  23  -5.015   1.829  -3.673
  154    HB   ILE  23           HB       ILE  23  -6.691   1.289  -1.978
  155   HG12  ILE  23          2HG1      ILE  23  -3.943   0.217  -1.309
  156   HG13  ILE  23          3HG1      ILE  23  -4.423   1.909  -1.271
  157   HG21  ILE  23          2HG2      ILE  23  -7.250  -0.976  -2.618
  158   HG22  ILE  23          1HG2      ILE  23  -6.736  -0.943  -0.931
  159   HG23  ILE  23          3HG2      ILE  23  -5.633  -1.525  -2.177
  160   HD11  ILE  23          3HD1      ILE  23  -4.355   0.960   0.957
  161   HD12  ILE  23          2HD1      ILE  23  -5.517  -0.278   0.481
  162   HD13  ILE  23          1HD1      ILE  23  -6.002   1.417   0.522
  163    H    GLU  24           H        GLU  24  -5.411  -1.583  -4.484
  164    HA   GLU  24           HA       GLU  24  -2.864  -2.504  -3.842
  165    HB2  GLU  24           HB2      GLU  24  -4.624  -4.017  -4.563
  166    HB3  GLU  24           HB3      GLU  24  -4.640  -3.281  -6.160
  167    HG2  GLU  24           HG2      GLU  24  -2.336  -4.055  -6.513
  168    HG3  GLU  24           HG3      GLU  24  -2.378  -4.844  -4.937
  169    H    SER  25           H        SER  25  -4.013  -1.031  -6.887
  170    HA   SER  25           HA       SER  25  -1.413  -1.007  -8.049
  171    HB2  SER  25           HB2      SER  25  -3.784   0.709  -8.796
  172    HB3  SER  25           HB3      SER  25  -2.350   0.385  -9.779
  173    HG   SER  25           HG       SER  25  -2.988  -1.723 -10.018
  174    H    SER  26           H        SER  26  -3.212   1.263  -6.057
  175    HA   SER  26           HA       SER  26  -1.704   3.564  -6.437
  176    HB2  SER  26           HB2      SER  26  -2.845   2.545  -3.817
  177    HB3  SER  26           HB3      SER  26  -2.367   4.208  -4.156
  178    HG   SER  26           HG       SER  26  -4.283   2.865  -5.743
  179    H    VAL  27           H        VAL  27  -1.060   0.727  -4.447
  180    HA   VAL  27           HA       VAL  27   1.543   1.701  -3.657
  181    HB   VAL  27           HB       VAL  27   0.517  -1.129  -3.451
  182   HG11  VAL  27          2HG1      VAL  27   2.645   0.381  -1.945
  183   HG12  VAL  27          1HG1      VAL  27   2.895  -0.921  -3.108
  184   HG13  VAL  27          3HG1      VAL  27   2.100  -1.253  -1.568
  185   HG21  VAL  27          3HG2      VAL  27  -1.093   0.347  -2.390
  186   HG22  VAL  27          2HG2      VAL  27   0.197   1.124  -1.472
  187   HG23  VAL  27          1HG2      VAL  27  -0.200  -0.568  -1.174
  188    H    LYS  28           H        LYS  28   0.322  -0.899  -5.763
  189    HA   LYS  28           HA       LYS  28   2.838  -1.962  -6.397
  190    HB2  LYS  28           HB2      LYS  28   0.699  -3.179  -6.588
  191    HB3  LYS  28           HB3      LYS  28   0.279  -2.191  -7.980
  192    HG2  LYS  28           HG2      LYS  28   2.218  -3.079  -9.188
  193    HG3  LYS  28           HG3      LYS  28   2.612  -4.087  -7.796
  194    HD2  LYS  28           HD2      LYS  28   0.063  -4.227  -9.408
  195    HD3  LYS  28           HD3      LYS  28   1.420  -5.348  -9.524
  196    HE2  LYS  28           HE2      LYS  28   1.090  -5.968  -7.174
  197    HE3  LYS  28           HE3      LYS  28  -0.285  -4.871  -7.084
  198    HZ1  LYS  28           HZ1      LYS  28  -1.389  -6.192  -8.793
  199    HZ2  LYS  28           HZ2      LYS  28  -1.004  -7.141  -7.438
  200    HZ3  LYS  28           HZ3      LYS  28  -0.068  -7.255  -8.843
  201    H    GLU  29           H        GLU  29   1.043   0.633  -7.945
  202    HA   GLU  29           HA       GLU  29   2.495   0.510 -10.397
  203    HB2  GLU  29           HB2      GLU  29   0.682   2.558  -9.177
  204    HB3  GLU  29           HB3      GLU  29   1.544   2.872 -10.680
  205    HG2  GLU  29           HG2      GLU  29  -0.190   0.469 -10.256
  206    HG3  GLU  29           HG3      GLU  29  -0.804   1.984 -10.922
  207    H    LEU  30           H        LEU  30   3.217   1.654  -7.322
  208    HA   LEU  30           HA       LEU  30   5.013   3.747  -8.155
  209    HB2  LEU  30           HB2      LEU  30   4.879   2.384  -5.467
  210    HB3  LEU  30           HB3      LEU  30   5.647   3.917  -5.829
  211    HG   LEU  30           HG       LEU  30   2.702   3.307  -5.758
  212   HD11  LEU  30          2HD1      LEU  30   2.672   5.062  -4.066
  213   HD12  LEU  30          1HD1      LEU  30   4.417   5.261  -4.234
  214   HD13  LEU  30          3HD1      LEU  30   3.757   3.748  -3.610
  215   HD21  LEU  30          3HD2      LEU  30   3.058   4.694  -7.696
  216   HD22  LEU  30          2HD2      LEU  30   4.087   5.790  -6.768
  217   HD23  LEU  30          1HD2      LEU  30   2.364   5.676  -6.403
  218    H    ASN  31           H        ASN  31   7.174   3.655  -8.450
  219    HA   ASN  31           HA       ASN  31   8.372   1.110  -8.938
  220    HB2  ASN  31           HB2      ASN  31   8.914   3.148 -10.255
  221    HB3  ASN  31           HB3      ASN  31   9.681   3.838  -8.831
  222   HD21  ASN  31          1HD2      ASN  31   9.846   0.462  -9.788
  223   HD22  ASN  31          2HD2      ASN  31  11.545   0.455 -10.148
  224    H    GLY  32           H        GLY  32   9.341  -0.159  -7.523
  225    HA2  GLY  32           HA1      GLY  32  11.095  -0.371  -5.814
  226    HA3  GLY  32           HA2      GLY  32  10.419   1.065  -5.055
  227    H    VAL  33           H        VAL  33   7.968  -0.847  -6.246
  228    HA   VAL  33           HA       VAL  33   7.472  -1.949  -3.589
  229    HB   VAL  33           HB       VAL  33   5.568  -1.316  -5.848
  230   HG11  VAL  33          2HG1      VAL  33   4.998  -2.633  -3.189
  231   HG12  VAL  33          1HG1      VAL  33   4.862  -3.386  -4.778
  232   HG13  VAL  33          3HG1      VAL  33   3.779  -2.068  -4.333
  233   HG21  VAL  33          3HG2      VAL  33   5.884  -0.221  -3.061
  234   HG22  VAL  33          2HG2      VAL  33   4.610   0.235  -4.193
  235   HG23  VAL  33          1HG2      VAL  33   6.295   0.606  -4.563
  236    H    GLU  34           H        GLU  34   7.902  -3.951  -3.357
  237    HA   GLU  34           HA       GLU  34   8.469  -5.630  -5.635
  238    HB2  GLU  34           HB2      GLU  34   9.978  -5.614  -3.742
  239    HB3  GLU  34           HB3      GLU  34   8.672  -6.056  -2.659
  240    HG2  GLU  34           HG2      GLU  34  10.048  -7.973  -3.074
  241    HG3  GLU  34           HG3      GLU  34   8.478  -8.214  -3.842
  242    H    GLN  35           H        GLN  35   6.403  -5.886  -2.743
  243    HA   GLN  35           HA       GLN  35   4.425  -7.338  -4.343
  244    HB2  GLN  35           HB2      GLN  35   5.545  -8.292  -1.700
  245    HB3  GLN  35           HB3      GLN  35   4.082  -8.932  -2.434
  246    HG2  GLN  35           HG2      GLN  35   5.403  -9.645  -4.384
  247    HG3  GLN  35           HG3      GLN  35   6.862  -9.059  -3.582
  248   HE21  GLN  35          1HE2      GLN  35   7.670 -10.182  -1.813
  249   HE22  GLN  35          2HE2      GLN  35   7.167 -11.792  -1.427
  250    H    VAL  36           H        VAL  36   2.292  -7.319  -3.382
  251    HA   VAL  36           HA       VAL  36   1.784  -5.806  -1.015
  252    HB   VAL  36           HB       VAL  36   2.205  -3.881  -2.376
  253   HG11  VAL  36          2HG1      VAL  36   2.013  -4.876  -4.582
  254   HG12  VAL  36          1HG1      VAL  36   1.010  -3.429  -4.469
  255   HG13  VAL  36          3HG1      VAL  36   0.267  -5.026  -4.381
  256   HG21  VAL  36          3HG2      VAL  36   0.319  -3.665  -0.878
  257   HG22  VAL  36          2HG2      VAL  36  -0.765  -4.321  -2.105
  258   HG23  VAL  36          1HG2      VAL  36   0.014  -2.760  -2.360
  259    H    LYS  37           H        LYS  37   0.171  -6.918  -0.149
  260    HA   LYS  37           HA       LYS  37  -2.025  -7.725  -1.933
  261    HB2  LYS  37           HB2      LYS  37  -2.518  -9.550  -0.298
  262    HB3  LYS  37           HB3      LYS  37  -0.996  -9.733  -1.153
  263    HG2  LYS  37           HG2      LYS  37   0.255  -9.102   0.767
  264    HG3  LYS  37           HG3      LYS  37  -1.204  -8.590   1.621
  265    HD2  LYS  37           HD2      LYS  37  -2.012 -10.891   1.645
  266    HD3  LYS  37           HD3      LYS  37  -0.585 -11.412   0.748
  267    HE2  LYS  37           HE2      LYS  37  -0.461 -10.072   3.442
  268    HE3  LYS  37           HE3      LYS  37  -0.510 -11.821   3.229
  269    HZ1  LYS  37           HZ1      LYS  37   1.539 -11.740   2.015
  270    HZ2  LYS  37           HZ2      LYS  37   1.757 -10.937   3.493
  271    HZ3  LYS  37           HZ3      LYS  37   1.568 -10.046   2.062
  272    H    VAL  38           H        VAL  38  -3.677  -6.439  -1.672
  273    HA   VAL  38           HA       VAL  38  -4.191  -5.201   0.906
  274    HB   VAL  38           HB       VAL  38  -4.429  -3.665  -0.866
  275   HG11  VAL  38          2HG1      VAL  38  -4.568  -5.058  -2.778
  276   HG12  VAL  38          1HG1      VAL  38  -6.027  -4.069  -2.762
  277   HG13  VAL  38          3HG1      VAL  38  -6.099  -5.752  -2.244
  278   HG21  VAL  38          3HG2      VAL  38  -6.816  -3.038  -0.802
  279   HG22  VAL  38          2HG2      VAL  38  -6.164  -3.427   0.790
  280   HG23  VAL  38          1HG2      VAL  38  -7.180  -4.594  -0.055
  281    H    GLN  39           H        GLN  39  -5.595  -5.925   2.319
  282    HA   GLN  39           HA       GLN  39  -7.251  -8.231   1.592
  283    HB2  GLN  39           HB2      GLN  39  -6.665  -7.137   4.346
  284    HB3  GLN  39           HB3      GLN  39  -7.318  -8.718   3.943
  285    HG2  GLN  39           HG2      GLN  39  -5.249  -9.454   3.066
  286    HG3  GLN  39           HG3      GLN  39  -4.577  -7.825   3.104
  287   HE21  GLN  39          1HE2      GLN  39  -5.404 -10.635   4.962
  288   HE22  GLN  39          2HE2      GLN  39  -4.560 -10.168   6.404
  289    H    LEU  40           H        LEU  40  -9.130  -7.412   0.749
  290    HA   LEU  40           HA       LEU  40 -10.379  -5.023   1.593
  291    HB2  LEU  40           HB2      LEU  40 -10.660  -6.437  -0.585
  292    HB3  LEU  40           HB3      LEU  40 -11.870  -7.308   0.331
  293    HG   LEU  40           HG       LEU  40 -12.834  -5.584  -1.148
  294   HD11  LEU  40          2HD1      LEU  40 -14.306  -4.524   0.481
  295   HD12  LEU  40          1HD1      LEU  40 -13.210  -4.992   1.781
  296   HD13  LEU  40          3HD1      LEU  40 -14.057  -6.229   0.854
  297   HD21  LEU  40          3HD2      LEU  40 -11.319  -3.660   0.603
  298   HD22  LEU  40          2HD2      LEU  40 -12.557  -3.208  -0.569
  299   HD23  LEU  40          1HD2      LEU  40 -11.056  -3.957  -1.115
  300    H    ALA  41           H        ALA  41 -10.912  -8.423   2.410
  301    HA   ALA  41           HA       ALA  41 -13.206  -8.035   4.004
  302    HB1  ALA  41           HB1      ALA  41 -12.787 -10.294   4.824
  303    HB2  ALA  41           HB2      ALA  41 -12.603 -10.200   3.072
  304    HB3  ALA  41           HB3      ALA  41 -11.177 -10.257   4.107
  305    H    GLU  42           H        GLU  42  -9.789  -7.789   4.739
  306    HA   GLU  42           HA       GLU  42 -10.312  -7.751   7.606
  307    HB2  GLU  42           HB2      GLU  42  -7.670  -7.352   6.200
  308    HB3  GLU  42           HB3      GLU  42  -7.925  -7.734   7.895
  309    HG2  GLU  42           HG2      GLU  42  -8.467  -9.521   5.540
  310    HG3  GLU  42           HG3      GLU  42  -7.188  -9.698   6.739
  311    H    GLY  43           H        GLY  43  -9.516  -5.569   5.003
  312    HA2  GLY  43           HA1      GLY  43  -9.700  -3.249   4.985
  313    HA3  GLY  43           HA2      GLY  43  -9.990  -3.282   6.720
  314    H    THR  44           H        THR  44  -7.307  -4.973   5.343
  315    HA   THR  44           HA       THR  44  -5.465  -2.827   6.122
  316    HB   THR  44           HB       THR  44  -3.948  -4.700   7.027
  317    HG1  THR  44           HG1      THR  44  -4.940  -6.580   6.573
  318   HG21  THR  44          3HG2      THR  44  -5.025  -2.987   8.436
  319   HG22  THR  44          1HG2      THR  44  -4.922  -4.547   9.253
  320   HG23  THR  44          2HG2      THR  44  -6.454  -4.012   8.564
  321    H    VAL  45           H        VAL  45  -3.255  -3.175   5.252
  322    HA   VAL  45           HA       VAL  45  -3.201  -4.920   2.882
  323    HB   VAL  45           HB       VAL  45  -2.170  -2.072   2.920
  324   HG11  VAL  45          2HG1      VAL  45  -0.848  -3.554   1.510
  325   HG12  VAL  45          1HG1      VAL  45  -1.776  -2.420   0.529
  326   HG13  VAL  45          3HG1      VAL  45  -2.310  -4.094   0.685
  327   HG21  VAL  45          3HG2      VAL  45  -4.604  -2.108   2.861
  328   HG22  VAL  45          2HG2      VAL  45  -4.565  -3.220   1.492
  329   HG23  VAL  45          1HG2      VAL  45  -3.944  -1.580   1.313
  330    H    GLU  46           H        GLU  46  -1.453  -6.194   2.891
  331    HA   GLU  46           HA       GLU  46   0.859  -5.374   4.505
  332    HB2  GLU  46           HB2      GLU  46   0.111  -8.073   3.370
  333    HB3  GLU  46           HB3      GLU  46   1.608  -7.741   4.228
  334    HG2  GLU  46           HG2      GLU  46   0.225  -7.027   6.185
  335    HG3  GLU  46           HG3      GLU  46  -1.188  -7.624   5.317
  336    H    VAL  47           H        VAL  47   2.469  -4.447   3.487
  337    HA   VAL  47           HA       VAL  47   2.777  -4.954   0.593
  338    HB   VAL  47           HB       VAL  47   3.549  -2.428   2.054
  339   HG11  VAL  47          2HG1      VAL  47   3.292  -3.049  -0.880
  340   HG12  VAL  47          1HG1      VAL  47   4.793  -2.823   0.017
  341   HG13  VAL  47          3HG1      VAL  47   3.679  -1.471  -0.194
  342   HG21  VAL  47          3HG2      VAL  47   1.132  -2.698   2.159
  343   HG22  VAL  47          2HG2      VAL  47   1.074  -2.954   0.415
  344   HG23  VAL  47          1HG2      VAL  47   1.571  -1.390   1.061
  345    H    THR  48           H        THR  48   4.770  -5.381  -0.211
  346    HA   THR  48           HA       THR  48   7.060  -5.325   1.648
  347    HB   THR  48           HB       THR  48   6.911  -6.959  -0.896
  348    HG1  THR  48           HG1      THR  48   6.392  -7.907   1.751
  349   HG21  THR  48          3HG2      THR  48   8.651  -7.174   1.569
  350   HG22  THR  48          1HG2      THR  48   9.151  -6.540  -0.001
  351   HG23  THR  48          2HG2      THR  48   8.717  -8.242   0.166
  352    H    ILE  49           H        ILE  49   8.076  -3.411   1.253
  353    HA   ILE  49           HA       ILE  49   8.427  -2.626  -1.576
  354    HB   ILE  49           HB       ILE  49   8.703  -0.308  -0.796
  355   HG12  ILE  49          2HG1      ILE  49   7.763  -1.290   1.904
  356   HG13  ILE  49          3HG1      ILE  49   9.454  -0.977   1.525
  357   HG21  ILE  49          2HG2      ILE  49   6.123  -1.593   0.068
  358   HG22  ILE  49          1HG2      ILE  49   6.527  -1.049  -1.560
  359   HG23  ILE  49          3HG2      ILE  49   6.356   0.126  -0.254
  360   HD11  ILE  49          3HD1      ILE  49   7.225   1.048   1.451
  361   HD12  ILE  49          2HD1      ILE  49   8.923   1.361   1.085
  362   HD13  ILE  49          1HD1      ILE  49   8.447   0.885   2.715
  363    H    ASP  50           H        ASP  50  10.382  -1.374  -2.018
  364    HA   ASP  50           HA       ASP  50  12.644  -2.212  -0.342
  365    HB2  ASP  50           HB2      ASP  50  12.595  -2.628  -2.888
  366    HB3  ASP  50           HB3      ASP  50  12.831  -0.891  -3.048
  367    H    SER  51           H        SER  51  12.952  -0.739   1.228
  368    HA   SER  51           HA       SER  51  11.946   1.922   0.971
  369    HB2  SER  51           HB2      SER  51  12.893   2.223   3.260
  370    HB3  SER  51           HB3      SER  51  11.845   0.815   3.113
  371    HG   SER  51           HG       SER  51  13.843   0.410   4.247
  372    H    SER  52           H        SER  52  14.821   0.500  -0.004
  373    HA   SER  52           HA       SER  52  16.405   2.920   0.241
  374    HB2  SER  52           HB2      SER  52  17.026   0.296  -1.125
  375    HB3  SER  52           HB3      SER  52  18.169   1.615  -0.872
  376    HG   SER  52           HG       SER  52  16.817   0.667   1.375
  377    H    VAL  53           H        VAL  53  14.060   1.729  -1.765
  378    HA   VAL  53           HA       VAL  53  14.994   3.347  -4.041
  379    HB   VAL  53           HB       VAL  53  12.986   1.087  -4.011
  380   HG11  VAL  53          2HG1      VAL  53  14.097   2.662  -6.331
  381   HG12  VAL  53          1HG1      VAL  53  12.461   2.799  -5.682
  382   HG13  VAL  53          3HG1      VAL  53  12.990   1.292  -6.436
  383   HG21  VAL  53          3HG2      VAL  53  14.656  -0.203  -5.163
  384   HG22  VAL  53          2HG2      VAL  53  15.353   0.422  -3.666
  385   HG23  VAL  53          1HG2      VAL  53  15.752   1.179  -5.212
  386    H    VAL  54           H        VAL  54  11.885   2.260  -2.655
  387    HA   VAL  54           HA       VAL  54  10.828   4.945  -3.188
  388    HB   VAL  54           HB       VAL  54   9.619   2.956  -4.154
  389   HG11  VAL  54          2HG1      VAL  54   8.926   2.402  -1.275
  390   HG12  VAL  54          1HG1      VAL  54   9.922   1.390  -2.322
  391   HG13  VAL  54          3HG1      VAL  54   8.208   1.610  -2.679
  392   HG21  VAL  54          3HG2      VAL  54   7.388   3.748  -3.585
  393   HG22  VAL  54          2HG2      VAL  54   8.497   5.093  -3.843
  394   HG23  VAL  54          1HG2      VAL  54   8.044   4.627  -2.203
  395    H    THR  55           H        THR  55   9.718   6.089  -1.476
  396    HA   THR  55           HA       THR  55  10.672   5.270   1.163
  397    HB   THR  55           HB       THR  55  10.021   7.478   1.955
  398    HG1  THR  55           HG1      THR  55   9.048   7.898  -0.705
  399   HG21  THR  55          3HG2      THR  55  11.497   7.623  -0.672
  400   HG22  THR  55          1HG2      THR  55  12.209   7.279   0.902
  401   HG23  THR  55          2HG2      THR  55  11.509   8.865   0.579
  402    H    LEU  56           H        LEU  56   9.221   5.305   3.010
  403    HA   LEU  56           HA       LEU  56   6.806   3.911   2.602
  404    HB2  LEU  56           HB2      LEU  56   8.067   3.827   4.703
  405    HB3  LEU  56           HB3      LEU  56   7.715   5.521   4.993
  406    HG   LEU  56           HG       LEU  56   5.320   4.993   5.166
  407   HD11  LEU  56          2HD1      LEU  56   4.581   2.673   5.278
  408   HD12  LEU  56          1HD1      LEU  56   6.210   2.127   4.880
  409   HD13  LEU  56          3HD1      LEU  56   5.275   3.045   3.700
  410   HD21  LEU  56          3HD2      LEU  56   6.702   5.037   7.175
  411   HD22  LEU  56          2HD2      LEU  56   7.075   3.327   6.965
  412   HD23  LEU  56          1HD2      LEU  56   5.421   3.832   7.311
  413    H    LYS  57           H        LYS  57   7.570   7.312   2.943
  414    HA   LYS  57           HA       LYS  57   4.952   8.283   3.294
  415    HB2  LYS  57           HB2      LYS  57   7.432   9.404   3.321
  416    HB3  LYS  57           HB3      LYS  57   6.798  10.018   1.798
  417    HG2  LYS  57           HG2      LYS  57   5.368  10.243   4.433
  418    HG3  LYS  57           HG3      LYS  57   6.404  11.502   3.757
  419    HD2  LYS  57           HD2      LYS  57   4.933  11.703   1.832
  420    HD3  LYS  57           HD3      LYS  57   3.936  10.374   2.431
  421    HE2  LYS  57           HE2      LYS  57   2.910  12.533   2.922
  422    HE3  LYS  57           HE3      LYS  57   3.353  11.687   4.403
  423    HZ1  LYS  57           HZ1      LYS  57   3.962  13.975   4.596
  424    HZ2  LYS  57           HZ2      LYS  57   4.826  13.934   3.137
  425    HZ3  LYS  57           HZ3      LYS  57   5.386  13.063   4.478
  426    H    ASP  58           H        ASP  58   6.867   7.626   0.366
  427    HA   ASP  58           HA       ASP  58   5.132   8.680  -1.547
  428    HB2  ASP  58           HB2      ASP  58   6.904   6.237  -1.672
  429    HB3  ASP  58           HB3      ASP  58   5.980   6.807  -3.055
  430    H    ILE  59           H        ILE  59   5.208   5.450  -0.128
  431    HA   ILE  59           HA       ILE  59   3.029   4.322  -1.431
  432    HB   ILE  59           HB       ILE  59   3.873   3.819   1.431
  433   HG12  ILE  59          2HG1      ILE  59   5.786   3.618  -0.075
  434   HG13  ILE  59          3HG1      ILE  59   5.296   2.032   0.509
  435   HG21  ILE  59          2HG2      ILE  59   1.723   2.835   0.909
  436   HG22  ILE  59          1HG2      ILE  59   2.947   1.574   1.066
  437   HG23  ILE  59          3HG2      ILE  59   2.395   2.075  -0.533
  438   HD11  ILE  59          3HD1      ILE  59   4.181   1.584  -1.598
  439   HD12  ILE  59          2HD1      ILE  59   5.878   1.991  -1.853
  440   HD13  ILE  59          1HD1      ILE  59   4.624   3.187  -2.185
  441    H    VAL  60           H        VAL  60   3.106   5.896   1.761
  442    HA   VAL  60           HA       VAL  60   0.358   5.717   2.273
  443    HB   VAL  60           HB       VAL  60   2.324   7.766   3.308
  444   HG11  VAL  60          2HG1      VAL  60  -0.361   6.913   4.385
  445   HG12  VAL  60          1HG1      VAL  60   0.029   8.476   3.666
  446   HG13  VAL  60          3HG1      VAL  60   0.771   7.998   5.192
  447   HG21  VAL  60          3HG2      VAL  60   1.477   5.099   4.437
  448   HG22  VAL  60          2HG2      VAL  60   2.512   6.271   5.252
  449   HG23  VAL  60          1HG2      VAL  60   3.059   5.495   3.765
  450    H    ALA  61           H        ALA  61   2.270   8.375   0.890
  451    HA   ALA  61           HA       ALA  61   0.240  10.285   0.762
  452    HB1  ALA  61           HB1      ALA  61   1.631  11.450  -0.855
  453    HB2  ALA  61           HB2      ALA  61   2.609  10.817   0.469
  454    HB3  ALA  61           HB3      ALA  61   2.601   9.995  -1.092
  455    H    VAL  62           H        VAL  62   1.307   7.986  -1.749
  456    HA   VAL  62           HA       VAL  62  -0.513   8.917  -3.700
  457    HB   VAL  62           HB       VAL  62   0.840   6.219  -3.501
  458   HG11  VAL  62          2HG1      VAL  62  -1.113   6.135  -4.968
  459   HG12  VAL  62          1HG1      VAL  62   0.383   6.020  -5.894
  460   HG13  VAL  62          3HG1      VAL  62  -0.514   7.538  -5.855
  461   HG21  VAL  62          3HG2      VAL  62   2.429   8.048  -3.612
  462   HG22  VAL  62          2HG2      VAL  62   1.582   8.732  -5.001
  463   HG23  VAL  62          1HG2      VAL  62   2.404   7.178  -5.145
  464    H    ILE  63           H        ILE  63  -0.704   6.228  -1.381
  465    HA   ILE  63           HA       ILE  63  -3.154   5.172  -2.234
  466    HB   ILE  63           HB       ILE  63  -1.986   5.245   0.549
  467   HG12  ILE  63          2HG1      ILE  63  -2.023   3.054  -1.540
  468   HG13  ILE  63          3HG1      ILE  63  -0.630   4.052  -1.140
  469   HG21  ILE  63          2HG2      ILE  63  -4.373   4.896   0.696
  470   HG22  ILE  63          1HG2      ILE  63  -3.529   3.388   1.047
  471   HG23  ILE  63          3HG2      ILE  63  -4.291   3.627  -0.526
  472   HD11  ILE  63          3HD1      ILE  63  -0.636   3.149   1.129
  473   HD12  ILE  63          2HD1      ILE  63  -0.477   1.877  -0.083
  474   HD13  ILE  63          1HD1      ILE  63  -2.025   2.143   0.719
  475    H    GLU  64           H        GLU  64  -2.499   7.620   0.262
  476    HA   GLU  64           HA       GLU  64  -5.273   7.967   0.846
  477    HB2  GLU  64           HB2      GLU  64  -2.934   9.724   1.603
  478    HB3  GLU  64           HB3      GLU  64  -4.550   9.794   2.299
  479    HG2  GLU  64           HG2      GLU  64  -4.183   7.343   2.928
  480    HG3  GLU  64           HG3      GLU  64  -2.483   7.647   2.578
  481    H    ASP  65           H        ASP  65  -3.038   9.423  -1.371
  482    HA   ASP  65           HA       ASP  65  -4.465  11.751  -2.037
  483    HB2  ASP  65           HB2      ASP  65  -2.159  11.260  -2.812
  484    HB3  ASP  65           HB3      ASP  65  -2.796  10.005  -3.864
  485    H    GLN  66           H        GLN  66  -4.952   8.406  -2.845
  486    HA   GLN  66           HA       GLN  66  -6.829   8.854  -4.958
  487    HB2  GLN  66           HB2      GLN  66  -6.390   6.392  -3.260
  488    HB3  GLN  66           HB3      GLN  66  -7.295   6.455  -4.765
  489    HG2  GLN  66           HG2      GLN  66  -4.345   6.924  -4.416
  490    HG3  GLN  66           HG3      GLN  66  -5.114   5.519  -5.152
  491   HE21  GLN  66          1HE2      GLN  66  -6.044   5.724  -7.210
  492   HE22  GLN  66          2HE2      GLN  66  -5.659   7.049  -8.253
  493    H    GLY  67           H        GLY  67  -6.998   9.071  -1.579
  494    HA2  GLY  67           HA1      GLY  67  -8.986  10.075  -0.631
  495    HA3  GLY  67           HA2      GLY  67  -9.942   9.092  -1.729
  496    H    TYR  68           H        TYR  68  -7.216   7.794   0.041
  497    HA   TYR  68           HA       TYR  68  -9.111   6.290   1.719
  498    HB2  TYR  68           HB2      TYR  68  -6.339   5.472   0.810
  499    HB3  TYR  68           HB3      TYR  68  -7.376   4.541   1.887
  500    HD1  TYR  68           HD2      TYR  68  -9.682   3.836   0.972
  501    HD2  TYR  68           HD1      TYR  68  -6.474   5.135  -1.505
  502    HE1  TYR  68           HE2      TYR  68 -10.735   2.737  -0.958
  503    HE2  TYR  68           HE1      TYR  68  -7.522   4.043  -3.443
  504    HH   TYR  68           HH       TYR  68  -9.123   2.195  -3.867
  505    H    ASP  69           H        ASP  69  -8.443   5.798   3.875
  506    HA   ASP  69           HA       ASP  69  -6.330   7.572   4.924
  507    HB2  ASP  69           HB2      ASP  69  -8.560   8.140   5.824
  508    HB3  ASP  69           HB3      ASP  69  -8.765   6.477   6.370
  509    H    VAL  70           H        VAL  70  -4.536   6.406   5.281
  510    HA   VAL  70           HA       VAL  70  -4.908   3.657   6.261
  511    HB   VAL  70           HB       VAL  70  -2.869   2.995   4.955
  512   HG11  VAL  70          2HG1      VAL  70  -4.091   2.708   2.855
  513   HG12  VAL  70          1HG1      VAL  70  -5.274   3.909   3.378
  514   HG13  VAL  70          3HG1      VAL  70  -5.118   2.381   4.250
  515   HG21  VAL  70          3HG2      VAL  70  -2.057   5.310   4.541
  516   HG22  VAL  70          2HG2      VAL  70  -3.402   5.532   3.418
  517   HG23  VAL  70          1HG2      VAL  70  -2.162   4.319   3.085
  518    H    GLN  71           H        GLN  71  -3.868   3.144   8.001
  519    HA   GLN  71           HA       GLN  71  -1.693   4.892   8.933
  520    HB2  GLN  71           HB2      GLN  71  -3.645   4.982  10.382
  521    HB3  GLN  71           HB3      GLN  71  -3.665   3.228  10.506
  522    HG2  GLN  71           HG2      GLN  71  -1.523   3.277  11.672
  523    HG3  GLN  71           HG3      GLN  71  -1.485   5.036  11.530
  524   HE21  GLN  71          1HE2      GLN  71  -4.335   5.301  11.969
  525   HE22  GLN  71          2HE2      GLN  71  -4.607   5.027  13.655
  Start of MODEL   20
    1    H1   SER   1           H1       SER   1  21.812  -1.640  -1.630
    2    H2   SER   1           H2       SER   1  22.973  -2.337  -2.644
    3    H3   SER   1           H3       SER   1  21.733  -3.291  -1.995
    4    HA   SER   1           HA       SER   1  21.423  -1.083  -3.935
    5    HB2  SER   1           HB2      SER   1  22.386  -3.166  -4.877
    6    HB3  SER   1           HB3      SER   1  20.991  -4.061  -4.274
    7    HG   SER   1           HG       SER   1  20.661  -3.522  -6.440
    8    H    ASN   2           H        ASN   2  19.811  -3.624  -2.029
    9    HA   ASN   2           HA       ASN   2  17.364  -2.014  -2.161
   10    HB2  ASN   2           HB2      ASN   2  15.967  -3.947  -2.564
   11    HB3  ASN   2           HB3      ASN   2  17.171  -3.840  -3.842
   12   HD21  ASN   2          1HD2      ASN   2  15.560  -6.065  -2.498
   13   HD22  ASN   2          2HD2      ASN   2  16.745  -7.289  -2.177
   14    H    ALA   3           H        ALA   3  15.794  -2.569  -0.523
   15    HA   ALA   3           HA       ALA   3  16.692  -4.186   1.730
   16    HB1  ALA   3           HB1      ALA   3  17.623  -1.999   2.270
   17    HB2  ALA   3           HB2      ALA   3  16.043  -1.250   2.034
   18    HB3  ALA   3           HB3      ALA   3  16.292  -2.386   3.360
   19    H    MET   4           H        MET   4  14.988  -5.454   2.128
   20    HA   MET   4           HA       MET   4  12.419  -4.681   1.028
   21    HB2  MET   4           HB2      MET   4  13.183  -7.268   2.368
   22    HB3  MET   4           HB3      MET   4  11.747  -6.974   1.403
   23    HG2  MET   4           HG2      MET   4  14.599  -7.097   0.466
   24    HG3  MET   4           HG3      MET   4  13.283  -8.203   0.080
   25    HE1  MET   4           HE1      MET   4  11.262  -7.600  -1.546
   26    HE2  MET   4           HE2      MET   4  10.873  -6.248  -0.480
   27    HE3  MET   4           HE3      MET   4  11.009  -5.990  -2.221
   28    H    GLU   5           H        GLU   5  10.997  -3.634   2.180
   29    HA   GLU   5           HA       GLU   5  10.821  -4.162   5.076
   30    HB2  GLU   5           HB2      GLU   5   9.966  -1.737   3.482
   31    HB3  GLU   5           HB3      GLU   5   9.639  -1.963   5.193
   32    HG2  GLU   5           HG2      GLU   5  12.426  -1.982   4.088
   33    HG3  GLU   5           HG3      GLU   5  11.607  -0.495   4.555
   34    H    GLN   6           H        GLN   6   9.298  -5.660   5.395
   35    HA   GLN   6           HA       GLN   6   6.836  -5.560   3.804
   36    HB2  GLN   6           HB2      GLN   6   8.021  -7.708   3.899
   37    HB3  GLN   6           HB3      GLN   6   7.886  -7.705   5.648
   38    HG2  GLN   6           HG2      GLN   6   5.493  -7.894   5.513
   39    HG3  GLN   6           HG3      GLN   6   5.547  -7.746   3.758
   40   HE21  GLN   6          1HE2      GLN   6   4.505  -9.743   3.525
   41   HE22  GLN   6          2HE2      GLN   6   5.343 -11.234   3.780
   42    H    LEU   7           H        LEU   7   5.411  -4.204   4.673
   43    HA   LEU   7           HA       LEU   7   5.033  -4.274   7.594
   44    HB2  LEU   7           HB2      LEU   7   4.969  -1.868   5.777
   45    HB3  LEU   7           HB3      LEU   7   4.526  -1.850   7.472
   46    HG   LEU   7           HG       LEU   7   7.275  -2.503   6.400
   47   HD11  LEU   7          2HD1      LEU   7   6.243  -0.043   7.804
   48   HD12  LEU   7          1HD1      LEU   7   6.680  -0.154   6.099
   49   HD13  LEU   7          3HD1      LEU   7   7.918  -0.347   7.341
   50   HD21  LEU   7          3HD2      LEU   7   7.973  -2.391   8.737
   51   HD22  LEU   7          2HD2      LEU   7   6.772  -3.661   8.497
   52   HD23  LEU   7          1HD2      LEU   7   6.300  -2.130   9.232
   53    H    THR   8           H        THR   8   2.943  -3.732   8.362
   54    HA   THR   8           HA       THR   8   0.798  -4.138   6.377
   55    HB   THR   8           HB       THR   8   0.656  -4.558   9.371
   56    HG1  THR   8           HG1      THR   8   1.827  -6.072   7.544
   57   HG21  THR   8          3HG2      THR   8  -1.229  -5.364   7.150
   58   HG22  THR   8          1HG2      THR   8  -1.499  -4.052   8.299
   59   HG23  THR   8          2HG2      THR   8  -1.436  -5.724   8.864
   60    H    LEU   9           H        LEU   9  -0.482  -2.454   5.961
   61    HA   LEU   9           HA       LEU   9  -0.537  -0.251   7.912
   62    HB2  LEU   9           HB2      LEU   9  -1.135   1.164   5.844
   63    HB3  LEU   9           HB3      LEU   9   0.537   0.716   6.109
   64    HG   LEU   9           HG       LEU   9  -1.185  -0.936   4.287
   65   HD11  LEU   9          2HD1      LEU   9  -0.470   0.474   2.422
   66   HD12  LEU   9          1HD1      LEU   9   0.271   1.602   3.556
   67   HD13  LEU   9          3HD1      LEU   9  -1.478   1.373   3.556
   68   HD21  LEU   9          3HD2      LEU   9   1.760  -0.261   4.303
   69   HD22  LEU   9          2HD2      LEU   9   0.949  -1.383   3.210
   70   HD23  LEU   9          1HD2      LEU   9   1.050  -1.749   4.933
   71    H    GLN  10           H        GLN  10  -2.466   0.748   8.354
   72    HA   GLN  10           HA       GLN  10  -4.828  -0.854   7.860
   73    HB2  GLN  10           HB2      GLN  10  -5.920   0.667   9.466
   74    HB3  GLN  10           HB3      GLN  10  -4.441  -0.023  10.117
   75    HG2  GLN  10           HG2      GLN  10  -3.246   2.013   9.682
   76    HG3  GLN  10           HG3      GLN  10  -4.675   2.728   8.938
   77   HE21  GLN  10          1HE2      GLN  10  -3.158   3.699  11.194
   78   HE22  GLN  10          2HE2      GLN  10  -4.245   3.745  12.548
   79    H    VAL  11           H        VAL  11  -6.636  -0.207   6.739
   80    HA   VAL  11           HA       VAL  11  -6.348   2.268   5.162
   81    HB   VAL  11           HB       VAL  11  -7.528  -0.292   4.092
   82   HG11  VAL  11          2HG1      VAL  11  -7.242   0.809   1.919
   83   HG12  VAL  11          1HG1      VAL  11  -6.620   2.244   2.734
   84   HG13  VAL  11          3HG1      VAL  11  -8.290   1.737   2.993
   85   HG21  VAL  11          3HG2      VAL  11  -4.721   0.754   3.762
   86   HG22  VAL  11          2HG2      VAL  11  -5.429  -0.550   2.806
   87   HG23  VAL  11          1HG2      VAL  11  -5.212  -0.751   4.547
   88    H    GLU  12           H        GLU  12  -7.946   3.590   5.720
   89    HA   GLU  12           HA       GLU  12 -10.575   2.438   6.339
   90    HB2  GLU  12           HB2      GLU  12  -9.487   5.210   6.867
   91    HB3  GLU  12           HB3      GLU  12 -11.093   4.651   7.311
   92    HG2  GLU  12           HG2      GLU  12  -8.502   3.531   8.355
   93    HG3  GLU  12           HG3      GLU  12  -9.550   4.663   9.206
   94    H    GLY  13           H        GLY  13 -12.301   2.820   5.047
   95    HA2  GLY  13           HA1      GLY  13 -13.467   4.547   3.711
   96    HA3  GLY  13           HA2      GLY  13 -11.937   4.820   2.898
   97    H    MET  14           H        MET  14 -11.497   1.794   2.882
   98    HA   MET  14           HA       MET  14 -12.954   1.439   0.379
   99    HB2  MET  14           HB2      MET  14 -11.457  -0.393  -0.108
  100    HB3  MET  14           HB3      MET  14 -10.533   1.035   0.344
  101    HG2  MET  14           HG2      MET  14 -10.123   0.113   2.543
  102    HG3  MET  14           HG3      MET  14 -11.136  -1.282   2.168
  103    HE1  MET  14           HE1      MET  14  -7.624  -2.951   2.190
  104    HE2  MET  14           HE2      MET  14  -8.190  -1.677   3.271
  105    HE3  MET  14           HE3      MET  14  -9.273  -2.991   2.817
  106    H    SER  15           H        SER  15 -14.442  -0.083  -0.012
  107    HA   SER  15           HA       SER  15 -14.902  -2.194   1.941
  108    HB2  SER  15           HB2      SER  15 -17.391  -1.592   1.915
  109    HB3  SER  15           HB3      SER  15 -16.329  -0.541   2.854
  110    HG   SER  15           HG       SER  15 -16.914   1.045   1.627
  111    H    CYS  16           H        CYS  16 -14.537  -1.343  -1.193
  112    HA   CYS  16           HA       CYS  16 -16.308  -3.486  -2.130
  113    HB2  CYS  16           HB2      CYS  16 -15.670  -0.912  -3.580
  114    HB3  CYS  16           HB3      CYS  16 -16.669  -2.221  -4.205
  115    HG   CYS  16           HG       CYS  16 -17.486  -0.542  -1.340
  116    H    GLY  17           H        GLY  17 -15.655  -4.267  -4.386
  117    HA2  GLY  17           HA1      GLY  17 -13.033  -5.326  -4.199
  118    HA3  GLY  17           HA2      GLY  17 -14.115  -5.484  -5.575
  119    H    HIS  18           H        HIS  18 -14.431  -2.777  -6.229
  120    HA   HIS  18           HA       HIS  18 -12.183  -2.251  -7.805
  121    HB2  HIS  18           HB2      HIS  18 -14.579  -0.694  -6.985
  122    HB3  HIS  18           HB3      HIS  18 -13.225   0.208  -7.657
  123    HD1  HIS  18           HD1      HIS  18 -12.965   0.205 -10.134
  124    HD2  HIS  18           HD2      HIS  18 -15.662  -2.676  -8.819
  125    HE1  HIS  18           HE1      HIS  18 -14.051  -0.710 -12.212
  126    HE2  HIS  18           HE2      HIS  18 -15.542  -2.576 -11.404
  127    H    CYS  19           H        CYS  19 -12.954  -1.295  -4.538
  128    HA   CYS  19           HA       CYS  19 -11.046   0.705  -4.156
  129    HB2  CYS  19           HB2      CYS  19 -11.976  -1.336  -2.128
  130    HB3  CYS  19           HB3      CYS  19 -11.261   0.234  -1.779
  131    HG   CYS  19           HG       CYS  19 -13.812   0.868  -3.655
  132    H    VAL  20           H        VAL  20 -10.837  -2.802  -3.681
  133    HA   VAL  20           HA       VAL  20  -8.256  -3.004  -2.697
  134    HB   VAL  20           HB       VAL  20  -9.611  -4.934  -4.590
  135   HG11  VAL  20          2HG1      VAL  20  -7.237  -5.401  -4.334
  136   HG12  VAL  20          1HG1      VAL  20  -8.200  -6.634  -3.522
  137   HG13  VAL  20          3HG1      VAL  20  -7.405  -5.374  -2.578
  138   HG21  VAL  20          3HG2      VAL  20 -10.402  -6.074  -2.572
  139   HG22  VAL  20          2HG2      VAL  20 -11.034  -4.432  -2.685
  140   HG23  VAL  20          1HG2      VAL  20  -9.707  -4.792  -1.581
  141    H    ASN  21           H        ASN  21  -9.313  -3.238  -6.089
  142    HA   ASN  21           HA       ASN  21  -6.746  -3.554  -7.183
  143    HB2  ASN  21           HB2      ASN  21  -9.266  -2.452  -8.446
  144    HB3  ASN  21           HB3      ASN  21  -7.810  -2.878  -9.338
  145   HD21  ASN  21          1HD2      ASN  21  -7.304  -5.014  -9.659
  146   HD22  ASN  21          2HD2      ASN  21  -8.403  -6.300  -9.302
  147    H    ALA  22           H        ALA  22  -8.645  -0.682  -6.471
  148    HA   ALA  22           HA       ALA  22  -7.019   1.184  -7.806
  149    HB1  ALA  22           HB1      ALA  22  -8.766   1.607  -5.388
  150    HB2  ALA  22           HB2      ALA  22  -8.137   2.868  -6.450
  151    HB3  ALA  22           HB3      ALA  22  -9.289   1.686  -7.070
  152    H    ILE  23           H        ILE  23  -6.991   0.102  -4.402
  153    HA   ILE  23           HA       ILE  23  -4.767   1.826  -3.799
  154    HB   ILE  23           HB       ILE  23  -6.328   1.410  -2.026
  155   HG12  ILE  23          2HG1      ILE  23  -3.703   0.014  -1.463
  156   HG13  ILE  23          3HG1      ILE  23  -3.977   1.753  -1.401
  157   HG21  ILE  23          2HG2      ILE  23  -6.633  -0.796  -1.013
  158   HG22  ILE  23          1HG2      ILE  23  -5.606  -1.506  -2.258
  159   HG23  ILE  23          3HG2      ILE  23  -7.148  -0.773  -2.700
  160   HD11  ILE  23          3HD1      ILE  23  -5.277  -0.300   0.371
  161   HD12  ILE  23          2HD1      ILE  23  -5.548   1.440   0.435
  162   HD13  ILE  23          1HD1      ILE  23  -3.959   0.781   0.820
  163    H    GLU  24           H        GLU  24  -5.197  -1.592  -4.548
  164    HA   GLU  24           HA       GLU  24  -2.650  -2.537  -3.935
  165    HB2  GLU  24           HB2      GLU  24  -4.407  -4.059  -4.583
  166    HB3  GLU  24           HB3      GLU  24  -4.533  -3.317  -6.173
  167    HG2  GLU  24           HG2      GLU  24  -2.225  -4.092  -6.652
  168    HG3  GLU  24           HG3      GLU  24  -2.234  -4.934  -5.103
  169    H    SER  25           H        SER  25  -3.827  -1.147  -7.008
  170    HA   SER  25           HA       SER  25  -1.212  -1.096  -8.135
  171    HB2  SER  25           HB2      SER  25  -2.230   0.446  -9.835
  172    HB3  SER  25           HB3      SER  25  -2.989  -1.148  -9.703
  173    HG   SER  25           HG       SER  25  -4.725  -0.274  -8.721
  174    H    SER  26           H        SER  26  -3.104   1.162  -6.227
  175    HA   SER  26           HA       SER  26  -1.687   3.505  -6.679
  176    HB2  SER  26           HB2      SER  26  -3.713   3.341  -5.246
  177    HB3  SER  26           HB3      SER  26  -2.747   2.535  -4.009
  178    HG   SER  26           HG       SER  26  -1.385   4.620  -4.415
  179    H    VAL  27           H        VAL  27  -0.881   0.712  -4.709
  180    HA   VAL  27           HA       VAL  27   1.638   1.834  -3.858
  181    HB   VAL  27           HB       VAL  27   0.755  -1.049  -3.702
  182   HG11  VAL  27          2HG1      VAL  27   3.133  -0.698  -3.321
  183   HG12  VAL  27          1HG1      VAL  27   2.321  -1.161  -1.825
  184   HG13  VAL  27          3HG1      VAL  27   2.769   0.522  -2.100
  185   HG21  VAL  27          3HG2      VAL  27  -0.929   0.357  -2.654
  186   HG22  VAL  27          2HG2      VAL  27   0.316   1.167  -1.703
  187   HG23  VAL  27          1HG2      VAL  27  -0.027  -0.542  -1.435
  188    H    LYS  28           H        LYS  28   0.603  -0.732  -6.116
  189    HA   LYS  28           HA       LYS  28   3.203  -1.534  -6.852
  190    HB2  LYS  28           HB2      LYS  28   1.371  -3.036  -7.141
  191    HB3  LYS  28           HB3      LYS  28   0.537  -1.916  -8.205
  192    HG2  LYS  28           HG2      LYS  28   1.527  -3.789  -9.423
  193    HG3  LYS  28           HG3      LYS  28   2.214  -2.245  -9.921
  194    HD2  LYS  28           HD2      LYS  28   3.979  -3.882  -9.728
  195    HD3  LYS  28           HD3      LYS  28   4.159  -2.679  -8.451
  196    HE2  LYS  28           HE2      LYS  28   3.189  -4.198  -6.837
  197    HE3  LYS  28           HE3      LYS  28   2.861  -5.381  -8.104
  198    HZ1  LYS  28           HZ1      LYS  28   5.216  -5.645  -8.461
  199    HZ2  LYS  28           HZ2      LYS  28   4.875  -5.901  -6.822
  200    HZ3  LYS  28           HZ3      LYS  28   5.574  -4.443  -7.321
  201    H    GLU  29           H        GLU  29   1.121   0.962  -8.175
  202    HA   GLU  29           HA       GLU  29   2.392   1.404 -10.625
  203    HB2  GLU  29           HB2      GLU  29   0.820   3.126  -8.759
  204    HB3  GLU  29           HB3      GLU  29   1.647   3.874 -10.120
  205    HG2  GLU  29           HG2      GLU  29  -0.205   1.543 -10.449
  206    HG3  GLU  29           HG3      GLU  29  -0.782   3.211 -10.450
  207    H    LEU  30           H        LEU  30   3.284   2.218  -7.396
  208    HA   LEU  30           HA       LEU  30   5.281   4.167  -8.124
  209    HB2  LEU  30           HB2      LEU  30   4.941   2.716  -5.501
  210    HB3  LEU  30           HB3      LEU  30   5.890   4.165  -5.776
  211    HG   LEU  30           HG       LEU  30   2.890   3.909  -5.868
  212   HD11  LEU  30          2HD1      LEU  30   4.730   5.492  -4.084
  213   HD12  LEU  30          1HD1      LEU  30   3.851   4.031  -3.637
  214   HD13  LEU  30          3HD1      LEU  30   2.967   5.507  -4.026
  215   HD21  LEU  30          3HD2      LEU  30   3.582   5.387  -7.657
  216   HD22  LEU  30          2HD2      LEU  30   4.622   6.284  -6.547
  217   HD23  LEU  30          1HD2      LEU  30   2.871   6.326  -6.343
  218    H    ASN  31           H        ASN  31   7.559   3.941  -7.881
  219    HA   ASN  31           HA       ASN  31   8.509   1.347  -8.705
  220    HB2  ASN  31           HB2      ASN  31   9.610   4.127  -8.596
  221    HB3  ASN  31           HB3      ASN  31  10.683   2.767  -8.796
  222   HD21  ASN  31          1HD2      ASN  31   8.718   1.224 -10.310
  223   HD22  ASN  31          2HD2      ASN  31   8.657   1.938 -11.885
  224    H    GLY  32           H        GLY  32   9.521  -0.058  -7.436
  225    HA2  GLY  32           HA1      GLY  32  11.156  -0.551  -5.727
  226    HA3  GLY  32           HA2      GLY  32  10.624   0.892  -4.871
  227    H    VAL  33           H        VAL  33   8.066  -0.825  -6.243
  228    HA   VAL  33           HA       VAL  33   7.407  -1.923  -3.604
  229    HB   VAL  33           HB       VAL  33   5.625  -1.051  -5.871
  230   HG11  VAL  33          2HG1      VAL  33   4.860  -2.466  -3.318
  231   HG12  VAL  33          1HG1      VAL  33   4.724  -3.114  -4.952
  232   HG13  VAL  33          3HG1      VAL  33   3.733  -1.740  -4.463
  233   HG21  VAL  33          3HG2      VAL  33   6.456   0.726  -4.452
  234   HG22  VAL  33          2HG2      VAL  33   5.941  -0.154  -3.013
  235   HG23  VAL  33          1HG2      VAL  33   4.738   0.466  -4.146
  236    H    GLU  34           H        GLU  34   7.668  -3.985  -3.374
  237    HA   GLU  34           HA       GLU  34   7.840  -5.717  -5.698
  238    HB2  GLU  34           HB2      GLU  34   9.567  -5.935  -4.018
  239    HB3  GLU  34           HB3      GLU  34   8.369  -6.207  -2.762
  240    HG2  GLU  34           HG2      GLU  34   9.496  -8.266  -3.453
  241    HG3  GLU  34           HG3      GLU  34   7.757  -8.316  -3.732
  242    H    GLN  35           H        GLN  35   6.192  -5.987  -2.527
  243    HA   GLN  35           HA       GLN  35   4.029  -7.390  -3.955
  244    HB2  GLN  35           HB2      GLN  35   5.047  -8.010  -1.177
  245    HB3  GLN  35           HB3      GLN  35   3.717  -8.818  -1.995
  246    HG2  GLN  35           HG2      GLN  35   5.317  -9.547  -3.748
  247    HG3  GLN  35           HG3      GLN  35   6.619  -8.860  -2.781
  248   HE21  GLN  35          1HE2      GLN  35   6.188 -11.595  -3.616
  249   HE22  GLN  35          2HE2      GLN  35   6.112 -12.542  -2.163
  250    H    VAL  36           H        VAL  36   1.971  -6.938  -3.416
  251    HA   VAL  36           HA       VAL  36   1.417  -5.224  -1.126
  252    HB   VAL  36           HB       VAL  36   1.741  -3.529  -2.764
  253   HG11  VAL  36          2HG1      VAL  36   1.673  -4.877  -4.779
  254   HG12  VAL  36          1HG1      VAL  36   0.596  -3.487  -4.929
  255   HG13  VAL  36          3HG1      VAL  36  -0.070  -5.087  -4.602
  256   HG21  VAL  36          3HG2      VAL  36  -0.203  -3.195  -1.354
  257   HG22  VAL  36          2HG2      VAL  36  -1.213  -4.070  -2.506
  258   HG23  VAL  36          1HG2      VAL  36  -0.490  -2.527  -2.961
  259    H    LYS  37           H        LYS  37   0.091  -6.569  -0.094
  260    HA   LYS  37           HA       LYS  37  -2.036  -7.877  -1.653
  261    HB2  LYS  37           HB2      LYS  37  -0.811  -8.673   0.994
  262    HB3  LYS  37           HB3      LYS  37  -2.154  -9.506   0.220
  263    HG2  LYS  37           HG2      LYS  37  -0.763 -10.128  -1.641
  264    HG3  LYS  37           HG3      LYS  37   0.577  -9.173  -1.006
  265    HD2  LYS  37           HD2      LYS  37  -0.663 -11.574   0.335
  266    HD3  LYS  37           HD3      LYS  37   0.861 -11.566  -0.555
  267    HE2  LYS  37           HE2      LYS  37   1.745  -9.902   1.041
  268    HE3  LYS  37           HE3      LYS  37   0.240 -10.004   1.948
  269    HZ1  LYS  37           HZ1      LYS  37   2.128 -12.255   1.490
  270    HZ2  LYS  37           HZ2      LYS  37   0.696 -12.334   2.389
  271    HZ3  LYS  37           HZ3      LYS  37   1.980 -11.364   2.929
  272    H    VAL  38           H        VAL  38  -3.690  -6.492  -1.607
  273    HA   VAL  38           HA       VAL  38  -4.410  -5.046   0.784
  274    HB   VAL  38           HB       VAL  38  -5.887  -5.277  -1.842
  275   HG11  VAL  38          2HG1      VAL  38  -6.183  -3.294   0.415
  276   HG12  VAL  38          1HG1      VAL  38  -7.335  -4.558  -0.021
  277   HG13  VAL  38          3HG1      VAL  38  -7.027  -3.225  -1.134
  278   HG21  VAL  38          3HG2      VAL  38  -3.948  -3.182  -0.875
  279   HG22  VAL  38          2HG2      VAL  38  -4.900  -3.087  -2.355
  280   HG23  VAL  38          1HG2      VAL  38  -3.676  -4.343  -2.173
  281    H    GLN  39           H        GLN  39  -5.496  -5.999   2.382
  282    HA   GLN  39           HA       GLN  39  -7.293  -8.204   1.743
  283    HB2  GLN  39           HB2      GLN  39  -6.210  -7.188   4.371
  284    HB3  GLN  39           HB3      GLN  39  -7.428  -8.451   4.253
  285    HG2  GLN  39           HG2      GLN  39  -4.681  -8.603   3.031
  286    HG3  GLN  39           HG3      GLN  39  -5.132  -9.301   4.585
  287   HE21  GLN  39          1HE2      GLN  39  -4.727 -11.394   3.997
  288   HE22  GLN  39          2HE2      GLN  39  -5.691 -12.260   2.842
  289    H    LEU  40           H        LEU  40  -9.126  -7.367   0.983
  290    HA   LEU  40           HA       LEU  40 -10.319  -4.970   1.852
  291    HB2  LEU  40           HB2      LEU  40 -10.697  -6.263  -0.321
  292    HB3  LEU  40           HB3      LEU  40 -11.771  -7.294   0.599
  293    HG   LEU  40           HG       LEU  40 -12.837  -5.437  -0.785
  294   HD11  LEU  40          2HD1      LEU  40 -14.524  -4.932   0.927
  295   HD12  LEU  40          1HD1      LEU  40 -13.452  -5.593   2.162
  296   HD13  LEU  40          3HD1      LEU  40 -14.094  -6.643   0.900
  297   HD21  LEU  40          3HD2      LEU  40 -11.257  -3.673  -0.196
  298   HD22  LEU  40          2HD2      LEU  40 -11.782  -3.756   1.484
  299   HD23  LEU  40          1HD2      LEU  40 -12.908  -3.223   0.234
  300    H    ALA  41           H        ALA  41 -10.718  -8.337   2.797
  301    HA   ALA  41           HA       ALA  41 -13.046  -8.001   4.350
  302    HB1  ALA  41           HB1      ALA  41 -10.910 -10.109   4.613
  303    HB2  ALA  41           HB2      ALA  41 -12.549 -10.197   5.258
  304    HB3  ALA  41           HB3      ALA  41 -12.289 -10.175   3.514
  305    H    GLU  42           H        GLU  42  -9.670  -7.487   5.055
  306    HA   GLU  42           HA       GLU  42 -10.236  -7.284   7.917
  307    HB2  GLU  42           HB2      GLU  42  -7.609  -7.261   6.425
  308    HB3  GLU  42           HB3      GLU  42  -7.774  -7.150   8.169
  309    HG2  GLU  42           HG2      GLU  42  -8.807  -9.356   8.225
  310    HG3  GLU  42           HG3      GLU  42  -8.658  -9.472   6.472
  311    H    GLY  43           H        GLY  43  -9.499  -5.312   5.152
  312    HA2  GLY  43           HA1      GLY  43  -9.703  -2.996   4.985
  313    HA3  GLY  43           HA2      GLY  43  -9.910  -2.915   6.731
  314    H    THR  44           H        THR  44  -7.272  -4.731   5.505
  315    HA   THR  44           HA       THR  44  -5.413  -2.522   6.020
  316    HB   THR  44           HB       THR  44  -3.902  -4.181   7.171
  317    HG1  THR  44           HG1      THR  44  -5.511  -5.930   8.125
  318   HG21  THR  44          3HG2      THR  44  -5.250  -2.550   8.440
  319   HG22  THR  44          1HG2      THR  44  -5.026  -4.060   9.322
  320   HG23  THR  44          2HG2      THR  44  -6.562  -3.726   8.525
  321    H    VAL  45           H        VAL  45  -3.240  -2.945   5.144
  322    HA   VAL  45           HA       VAL  45  -3.249  -4.891   2.933
  323    HB   VAL  45           HB       VAL  45  -2.195  -2.052   2.778
  324   HG11  VAL  45          2HG1      VAL  45  -0.843  -3.626   1.488
  325   HG12  VAL  45          1HG1      VAL  45  -1.757  -2.551   0.428
  326   HG13  VAL  45          3HG1      VAL  45  -2.294  -4.215   0.671
  327   HG21  VAL  45          3HG2      VAL  45  -4.570  -3.330   1.420
  328   HG22  VAL  45          2HG2      VAL  45  -3.950  -1.710   1.097
  329   HG23  VAL  45          1HG2      VAL  45  -4.620  -2.098   2.682
  330    H    GLU  46           H        GLU  46  -1.472  -6.144   2.879
  331    HA   GLU  46           HA       GLU  46   0.825  -5.340   4.525
  332    HB2  GLU  46           HB2      GLU  46  -0.171  -7.622   4.868
  333    HB3  GLU  46           HB3      GLU  46   0.316  -8.023   3.226
  334    HG2  GLU  46           HG2      GLU  46   2.668  -7.495   3.889
  335    HG3  GLU  46           HG3      GLU  46   2.098  -7.350   5.551
  336    H    VAL  47           H        VAL  47   2.495  -4.436   3.532
  337    HA   VAL  47           HA       VAL  47   2.824  -4.933   0.643
  338    HB   VAL  47           HB       VAL  47   3.304  -2.317   2.084
  339   HG11  VAL  47          2HG1      VAL  47   3.635  -1.405  -0.184
  340   HG12  VAL  47          1HG1      VAL  47   3.533  -3.043  -0.832
  341   HG13  VAL  47          3HG1      VAL  47   4.853  -2.605   0.253
  342   HG21  VAL  47          3HG2      VAL  47   1.153  -3.067   0.113
  343   HG22  VAL  47          2HG2      VAL  47   1.411  -1.469   0.809
  344   HG23  VAL  47          1HG2      VAL  47   0.923  -2.813   1.841
  345    H    THR  48           H        THR  48   4.777  -5.514  -0.014
  346    HA   THR  48           HA       THR  48   7.055  -5.213   1.834
  347    HB   THR  48           HB       THR  48   6.900  -7.098  -0.532
  348    HG1  THR  48           HG1      THR  48   5.507  -7.281   1.664
  349   HG21  THR  48          3HG2      THR  48   8.719  -7.004   1.883
  350   HG22  THR  48          1HG2      THR  48   9.161  -6.548   0.238
  351   HG23  THR  48          2HG2      THR  48   8.764  -8.225   0.612
  352    H    ILE  49           H        ILE  49   8.235  -3.485   1.308
  353    HA   ILE  49           HA       ILE  49   8.391  -2.715  -1.540
  354    HB   ILE  49           HB       ILE  49   8.841  -0.417  -0.782
  355   HG12  ILE  49          2HG1      ILE  49   8.117  -1.302   2.008
  356   HG13  ILE  49          3HG1      ILE  49   9.789  -1.239   1.461
  357   HG21  ILE  49          2HG2      ILE  49   6.601   0.133   0.013
  358   HG22  ILE  49          1HG2      ILE  49   6.317  -1.565   0.396
  359   HG23  ILE  49          3HG2      ILE  49   6.550  -1.066  -1.280
  360   HD11  ILE  49          3HD1      ILE  49   9.532   1.151   1.002
  361   HD12  ILE  49          2HD1      ILE  49   9.217   0.754   2.692
  362   HD13  ILE  49          1HD1      ILE  49   7.872   1.076   1.595
  363    H    ASP  50           H        ASP  50  10.344  -1.547  -2.138
  364    HA   ASP  50           HA       ASP  50  12.734  -2.420  -0.679
  365    HB2  ASP  50           HB2      ASP  50  12.705  -2.860  -3.116
  366    HB3  ASP  50           HB3      ASP  50  12.475  -1.141  -3.414
  367    H    SER  51           H        SER  51  13.090  -1.037   0.928
  368    HA   SER  51           HA       SER  51  12.216   1.685   0.795
  369    HB2  SER  51           HB2      SER  51  12.056   0.421   2.867
  370    HB3  SER  51           HB3      SER  51  13.797   0.213   2.907
  371    HG   SER  51           HG       SER  51  13.481   2.770   2.722
  372    H    SER  52           H        SER  52  14.855   0.213  -0.494
  373    HA   SER  52           HA       SER  52  16.718   2.386  -0.036
  374    HB2  SER  52           HB2      SER  52  16.872   0.054  -1.961
  375    HB3  SER  52           HB3      SER  52  18.192   1.159  -1.569
  376    HG   SER  52           HG       SER  52  16.899  -0.690   0.147
  377    H    VAL  53           H        VAL  53  14.044   1.833  -1.917
  378    HA   VAL  53           HA       VAL  53  14.887   3.856  -3.885
  379    HB   VAL  53           HB       VAL  53  12.896   1.615  -4.292
  380   HG11  VAL  53          2HG1      VAL  53  13.897   3.710  -6.221
  381   HG12  VAL  53          1HG1      VAL  53  12.273   3.611  -5.539
  382   HG13  VAL  53          3HG1      VAL  53  12.849   2.350  -6.630
  383   HG21  VAL  53          3HG2      VAL  53  15.629   2.012  -5.499
  384   HG22  VAL  53          2HG2      VAL  53  14.522   0.680  -5.829
  385   HG23  VAL  53          1HG2      VAL  53  15.235   0.860  -4.222
  386    H    VAL  54           H        VAL  54  11.834   2.424  -2.696
  387    HA   VAL  54           HA       VAL  54  10.663   5.116  -2.736
  388    HB   VAL  54           HB       VAL  54   9.548   3.280  -4.026
  389   HG11  VAL  54          2HG1      VAL  54   8.952   2.160  -1.295
  390   HG12  VAL  54          1HG1      VAL  54   9.931   1.410  -2.557
  391   HG13  VAL  54          3HG1      VAL  54   8.198   1.633  -2.800
  392   HG21  VAL  54          3HG2      VAL  54   7.903   4.492  -1.814
  393   HG22  VAL  54          2HG2      VAL  54   7.276   3.820  -3.320
  394   HG23  VAL  54          1HG2      VAL  54   8.304   5.254  -3.354
  395    H    THR  55           H        THR  55   9.487   5.910  -0.908
  396    HA   THR  55           HA       THR  55  10.321   4.691   1.625
  397    HB   THR  55           HB       THR  55   9.715   6.780   2.694
  398    HG1  THR  55           HG1      THR  55   8.909   7.739   0.122
  399   HG21  THR  55          3HG2      THR  55  11.247   8.333   1.570
  400   HG22  THR  55          1HG2      THR  55  11.234   7.306   0.137
  401   HG23  THR  55          2HG2      THR  55  11.923   6.705   1.645
  402    H    LEU  56           H        LEU  56   8.675   4.685   3.401
  403    HA   LEU  56           HA       LEU  56   6.280   3.411   2.571
  404    HB2  LEU  56           HB2      LEU  56   7.389   2.927   4.716
  405    HB3  LEU  56           HB3      LEU  56   7.017   4.548   5.272
  406    HG   LEU  56           HG       LEU  56   4.593   4.006   5.094
  407   HD11  LEU  56          2HD1      LEU  56   3.924   1.660   4.889
  408   HD12  LEU  56          1HD1      LEU  56   5.600   1.215   4.562
  409   HD13  LEU  56          3HD1      LEU  56   4.722   2.243   3.428
  410   HD21  LEU  56          3HD2      LEU  56   6.202   2.172   6.867
  411   HD22  LEU  56          2HD2      LEU  56   4.510   2.613   7.096
  412   HD23  LEU  56          1HD2      LEU  56   5.767   3.842   7.228
  413    H    LYS  57           H        LYS  57   7.128   6.685   3.470
  414    HA   LYS  57           HA       LYS  57   4.539   7.711   3.849
  415    HB2  LYS  57           HB2      LYS  57   7.116   8.725   3.982
  416    HB3  LYS  57           HB3      LYS  57   6.373   9.633   2.671
  417    HG2  LYS  57           HG2      LYS  57   5.216   9.315   5.425
  418    HG3  LYS  57           HG3      LYS  57   6.118  10.724   4.862
  419    HD2  LYS  57           HD2      LYS  57   4.396  11.091   3.128
  420    HD3  LYS  57           HD3      LYS  57   3.494   9.708   3.753
  421    HE2  LYS  57           HE2      LYS  57   3.337  10.844   5.939
  422    HE3  LYS  57           HE3      LYS  57   4.153  12.242   5.246
  423    HZ1  LYS  57           HZ1      LYS  57   1.508  11.157   4.432
  424    HZ2  LYS  57           HZ2      LYS  57   2.304  12.438   3.652
  425    HZ3  LYS  57           HZ3      LYS  57   1.798  12.609   5.260
  426    H    ASP  58           H        ASP  58   6.581   7.424   0.958
  427    HA   ASP  58           HA       ASP  58   4.956   8.731  -0.883
  428    HB2  ASP  58           HB2      ASP  58   6.690   6.281  -1.228
  429    HB3  ASP  58           HB3      ASP  58   5.880   7.071  -2.572
  430    H    ILE  59           H        ILE  59   4.917   5.342   0.109
  431    HA   ILE  59           HA       ILE  59   2.834   4.408  -1.463
  432    HB   ILE  59           HB       ILE  59   3.433   3.561   1.379
  433   HG12  ILE  59          2HG1      ILE  59   5.470   3.498   0.035
  434   HG13  ILE  59          3HG1      ILE  59   4.910   1.862   0.366
  435   HG21  ILE  59          2HG2      ILE  59   2.135   2.055  -0.888
  436   HG22  ILE  59          1HG2      ILE  59   1.319   2.692   0.540
  437   HG23  ILE  59          3HG2      ILE  59   2.509   1.402   0.708
  438   HD11  ILE  59          3HD1      ILE  59   5.693   2.091  -1.917
  439   HD12  ILE  59          2HD1      ILE  59   4.513   3.370  -2.204
  440   HD13  ILE  59          1HD1      ILE  59   3.968   1.726  -1.872
  441    H    VAL  60           H        VAL  60   2.643   5.567   1.900
  442    HA   VAL  60           HA       VAL  60  -0.141   5.376   2.147
  443    HB   VAL  60           HB       VAL  60   1.717   7.275   3.593
  444   HG11  VAL  60          2HG1      VAL  60  -0.638   7.886   3.830
  445   HG12  VAL  60          1HG1      VAL  60   0.028   7.288   5.349
  446   HG13  VAL  60          3HG1      VAL  60  -1.009   6.249   4.372
  447   HG21  VAL  60          3HG2      VAL  60   2.455   4.970   3.816
  448   HG22  VAL  60          2HG2      VAL  60   0.833   4.481   4.307
  449   HG23  VAL  60          1HG2      VAL  60   1.782   5.549   5.340
  450    H    ALA  61           H        ALA  61   1.902   8.127   1.205
  451    HA   ALA  61           HA       ALA  61  -0.071  10.092   1.126
  452    HB1  ALA  61           HB1      ALA  61   2.376   9.894  -0.622
  453    HB2  ALA  61           HB2      ALA  61   1.437  11.351  -0.301
  454    HB3  ALA  61           HB3      ALA  61   2.328  10.570   1.005
  455    H    VAL  62           H        VAL  62   1.072   7.958  -1.487
  456    HA   VAL  62           HA       VAL  62  -0.670   9.039  -3.451
  457    HB   VAL  62           HB       VAL  62   0.707   6.345  -3.393
  458   HG11  VAL  62          2HG1      VAL  62  -1.166   6.369  -4.968
  459   HG12  VAL  62          1HG1      VAL  62   0.378   6.331  -5.819
  460   HG13  VAL  62          3HG1      VAL  62  -0.530   7.838  -5.708
  461   HG21  VAL  62          3HG2      VAL  62   2.283   8.192  -3.272
  462   HG22  VAL  62          2HG2      VAL  62   1.512   8.966  -4.656
  463   HG23  VAL  62          1HG2      VAL  62   2.358   7.433  -4.862
  464    H    ILE  63           H        ILE  63  -0.929   6.320  -1.210
  465    HA   ILE  63           HA       ILE  63  -3.300   5.206  -2.216
  466    HB   ILE  63           HB       ILE  63  -2.194   5.233   0.592
  467   HG12  ILE  63          2HG1      ILE  63  -2.295   3.080  -1.535
  468   HG13  ILE  63          3HG1      ILE  63  -0.873   4.027  -1.104
  469   HG21  ILE  63          2HG2      ILE  63  -4.600   4.960   0.733
  470   HG22  ILE  63          1HG2      ILE  63  -3.791   3.436   1.100
  471   HG23  ILE  63          3HG2      ILE  63  -4.546   3.678  -0.476
  472   HD11  ILE  63          3HD1      ILE  63  -0.909   3.066   1.133
  473   HD12  ILE  63          2HD1      ILE  63  -0.802   1.817  -0.107
  474   HD13  ILE  63          1HD1      ILE  63  -2.337   2.122   0.707
  475    H    GLU  64           H        GLU  64  -2.815   7.699   0.281
  476    HA   GLU  64           HA       GLU  64  -5.577   8.019   0.817
  477    HB2  GLU  64           HB2      GLU  64  -3.298   9.947   1.278
  478    HB3  GLU  64           HB3      GLU  64  -4.918  10.124   1.938
  479    HG2  GLU  64           HG2      GLU  64  -4.567   7.863   3.027
  480    HG3  GLU  64           HG3      GLU  64  -2.868   8.035   2.588
  481    H    ASP  65           H        ASP  65  -3.448   9.343  -1.582
  482    HA   ASP  65           HA       ASP  65  -5.039  11.507  -2.448
  483    HB2  ASP  65           HB2      ASP  65  -2.686  11.243  -3.089
  484    HB3  ASP  65           HB3      ASP  65  -3.091   9.801  -4.012
  485    H    GLN  66           H        GLN  66  -5.290   8.102  -2.880
  486    HA   GLN  66           HA       GLN  66  -7.006   8.196  -5.184
  487    HB2  GLN  66           HB2      GLN  66  -6.488   5.934  -3.245
  488    HB3  GLN  66           HB3      GLN  66  -7.305   5.790  -4.796
  489    HG2  GLN  66           HG2      GLN  66  -4.435   6.594  -4.371
  490    HG3  GLN  66           HG3      GLN  66  -5.007   5.023  -4.933
  491   HE21  GLN  66          1HE2      GLN  66  -3.254   7.018  -6.196
  492   HE22  GLN  66          2HE2      GLN  66  -3.982   7.392  -7.720
  493    H    GLY  67           H        GLY  67  -7.449   8.744  -1.881
  494    HA2  GLY  67           HA1      GLY  67  -9.597   9.586  -1.140
  495    HA3  GLY  67           HA2      GLY  67 -10.363   8.404  -2.191
  496    H    TYR  68           H        TYR  68  -7.650   7.817  -0.019
  497    HA   TYR  68           HA       TYR  68  -9.416   6.168   1.659
  498    HB2  TYR  68           HB2      TYR  68  -6.591   5.501   0.817
  499    HB3  TYR  68           HB3      TYR  68  -7.569   4.562   1.939
  500    HD1  TYR  68           HD2      TYR  68  -9.974   3.907   0.918
  501    HD2  TYR  68           HD1      TYR  68  -6.469   4.741  -1.349
  502    HE1  TYR  68           HE2      TYR  68 -10.892   2.626  -0.967
  503    HE2  TYR  68           HE1      TYR  68  -7.384   3.463  -3.238
  504    HH   TYR  68           HH       TYR  68  -9.068   1.592  -3.549
  505    H    ASP  69           H        ASP  69  -8.800   5.965   3.859
  506    HA   ASP  69           HA       ASP  69  -7.042   8.146   4.771
  507    HB2  ASP  69           HB2      ASP  69  -9.320   8.324   5.624
  508    HB3  ASP  69           HB3      ASP  69  -9.244   6.675   6.237
  509    H    VAL  70           H        VAL  70  -5.056   7.456   5.167
  510    HA   VAL  70           HA       VAL  70  -4.734   4.882   6.565
  511    HB   VAL  70           HB       VAL  70  -2.995   5.897   4.302
  512   HG11  VAL  70          2HG1      VAL  70  -1.808   3.759   4.531
  513   HG12  VAL  70          1HG1      VAL  70  -2.791   3.370   5.942
  514   HG13  VAL  70          3HG1      VAL  70  -1.677   4.737   5.991
  515   HG21  VAL  70          3HG2      VAL  70  -5.150   4.989   3.540
  516   HG22  VAL  70          2HG2      VAL  70  -4.828   3.499   4.430
  517   HG23  VAL  70          1HG2      VAL  70  -3.801   3.952   3.069
  518    H    GLN  71           H        GLN  71  -3.967   5.320   8.497
  519    HA   GLN  71           HA       GLN  71  -2.043   7.525   8.784
  520    HB2  GLN  71           HB2      GLN  71  -4.114   7.936   9.989
  521    HB3  GLN  71           HB3      GLN  71  -3.985   6.383  10.801
  522    HG2  GLN  71           HG2      GLN  71  -2.007   7.120  11.970
  523    HG3  GLN  71           HG3      GLN  71  -2.037   8.655  11.101
  524   HE21  GLN  71          1HE2      GLN  71  -3.530  10.203  11.655
  525   HE22  GLN  71          2HE2      GLN  71  -4.474  10.122  13.102